*HEADER   ELECTRON TRANSPORT                      30-MAY-96   1TOF    
*TITLE    THIOREDOXIN H (OXIDIZED FORM), NMR, 23 STRUCTURES           
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: THIOREDOXIN H;                                   
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: HTRX, HCH1, CH1;                                  
*COMPND  5 ENGINEERED: YES                                            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: CHLAMYDOMONAS REINHARDTII;            
*SOURCE  3 STRAIN: CW15;                                              
*SOURCE  4 CELLULAR_LOCATION: CYTOPLASM;                              
*SOURCE  5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  6 EXPRESSION_SYSTEM_STRAIN: BL21;                            
*SOURCE  7 EXPRESSION_SYSTEM_PLASMID: PET-3D;                         
*SOURCE  8 EXPRESSION_SYSTEM_GENE: THIOREDOXIN H CDNA (X78822,EMBL)   
*KEYWDS   OXIDOREDUCTASE, ELECTRON TRANSPORT                          
*EXPDTA   NMR, 23 STRUCTURES                                          
*AUTHOR   V.MITTARD,M.J.BLACKLEDGE,M.STEIN,J.-P.JACQUOT,D.MARION,     
*AUTHOR  2 J.-M.LANCELIN                                              
*REVDAT  1   07-DEC-96 1TOF    0                                      

!BIOSYM restraint 1
!THIS IS THE NMR RESTRAINTS FILE OF THIOREDOXIN h FROM CHLAMYDOMONAS REINHARDTII.
!lancelin@ginko.cpe.fr
!Virginie.Mittard@ibs.fr
!
#chiral
1:GLYN_1:CA        S
1:GLY_2:CA         S
1:SER_3:CA         S
1:VAL_4:CA         S
1:ILE_5:CA         S
1:ILE_5:CB         S
1:VAL_6:CA         S
1:ILE_7:CA         S
1:ILE_7:CB         S
1:ASX_8:CA         S
1:SER_9:CA         S
1:LYX_10:CA        S
1:ALA_11:CA        S
1:ALA_12:CA        S
1:TRP_13:CA        S
1:ASX_14:CA        S
1:ALA_15:CA        S
1:GLN_16:CA        S
1:LEU_17:CA        S
1:ALA_18:CA        S
1:LYX_19:CA        S
1:GLY_20:CA        S
1:LYX_21:CA        S
1:GLX_22:CA        S
1:GLX_23:CA        S
1:HIS_24:CA        S
1:LYX_25:CA        S
1:PRO_26:CA        S
1:ILE_27:CA        S
1:ILE_27:CB        S
1:VAL_28:CA        S
1:VAL_29:CA        S
1:ASX_30:CA        S
1:PHE_31:CA        S
1:THR_32:CA        S
1:THR_32:CB        R
1:ALA_33:CA        S
1:THR_34:CA        S
1:THR_34:CB        R
1:TRP_35:CA        S
1:CYS_36:CA        R
1:GLY_37:CA        S
1:PRO_38:CA        S
1:CYS_39:CA        R
1:LYX_40:CA        S
1:MET_41:CA        S
1:ILE_42:CA        S
1:ILE_42:CB        S
1:ALA_43:CA        S
1:PRO_44:CA        S
1:LEU_45:CA        S
1:PHE_46:CA        S
1:GLX_47:CA        S
1:THR_48:CA        S
1:THR_48:CB        R
1:LEU_49:CA        S
1:SER_50:CA        S
1:ASN_51:CA        S
1:ASX_52:CA        S
1:TYR_53:CA        S
1:ALA_54:CA        S
1:GLY_55:CA        S
1:LYX_56:CA        S
1:VAL_57:CA        S
1:ILE_58:CA        S
1:ILE_58:CB        S
1:PHE_59:CA        S
1:LEU_60:CA        S
1:LYX_61:CA        S
1:VAL_62:CA        S
1:ASX_63:CA        S
1:VAL_64:CA        S
1:ASX_65:CA        S
1:ALA_66:CA        S
1:VAL_67:CA        S
1:ALA_68:CA        S
1:ALA_69:CA        S
1:VAL_70:CA        S
1:ALA_71:CA        S
1:GLX_72:CA        S
1:ALA_73:CA        S
1:ALA_74:CA        S
1:GLY_75:CA        S
1:ILE_76:CA        S
1:ILE_76:CB        S
1:THR_77:CA        S
1:THR_77:CB        R
1:ALA_78:CA        S
1:MET_79:CA        S
1:PRO_80:CA        S
1:THR_81:CA        S
1:THR_81:CB        R
1:PHE_82:CA        S
1:HIS_83:CA        S
1:VAL_84:CA        S
1:TYR_85:CA        S
1:LYX_86:CA        S
1:ASX_87:CA        S
1:GLY_88:CA        S
1:VAL_89:CA        S
1:LYX_90:CA        S
1:ALA_91:CA        S
1:ASX_92:CA        S
1:ASX_93:CA        S
1:LEU_94:CA        S
1:VAL_95:CA        S
1:GLY_96:CA        S
1:ALA_97:CA        S
1:SER_98:CA        S
1:GLN_99:CA        S
1:ASX_100:CA       S
1:LYX_101:CA       S
1:LEU_102:CA       S
1:LYX_103:CA       S
1:ALA_104:CA       S
1:LEU_105:CA       S
1:VAL_106:CA       S
1:ALA_107:CA       S
1:LYX_108:CA       S
1:HIS_109:CA       S
1:ALA_110:CA       S
1:ALA_111:CA       S
1:ALAC_112:CA      S
!
#distance
1:ALA_15:O         1:LYX_19:HN         0.000  2.300 50.00 50.00 1000.000
1:ALA_15:O         1:LYX_19:N          2.500  3.300 50.00 50.00 1000.000
1:GLX_47:O         1:ASN_51:HN         0.000  2.300 50.00 50.00 1000.000
1:GLX_47:O         1:ASN_51:N          2.500  3.300 50.00 50.00 1000.000
1:GLN_99:O         1:LYX_103:HN        0.000  2.300 50.00 50.00 1000.000
1:GLN_99:O         1:LYX_103:N         2.500  3.300 50.00 50.00 1000.000
1:LEU_102:O        1:VAL_106:HN        0.000  2.300 50.00 50.00 1000.000
1:LEU_102:O        1:VAL_106:N         2.500  3.300 50.00 50.00 1000.000
1:LYX_103:O        1:ALA_107:HN        0.000  2.300 50.00 50.00 1000.000
1:LYX_103:O        1:ALA_107:N         2.500  3.300 50.00 50.00 1000.000
1:ILE_5:O          1:LYX_61:HN         0.000  2.300 50.00 50.00 1000.000
1:ILE_5:O          1:LYX_61:N          2.500  3.300 50.00 50.00 1000.000
1:ILE_58:O         1:VAL_28:HN         0.000  2.300 50.00 50.00 1000.000
1:ILE_58:O         1:VAL_28:N          2.500  3.300 50.00 50.00 1000.000
1:LEU_60:O         1:ASX_30:HN         0.000  2.300 50.00 50.00 1000.000
1:LEU_60:O         1:ASX_30:N          2.500  3.300 50.00 50.00 1000.000
1:ILE_27:O         1:TYR_85:HN         0.000  2.300 50.00 50.00 1000.000
1:ILE_27:O         1:TYR_85:N          2.500  3.300 50.00 50.00 1000.000
1:HIS_83:O         1:VAL_29:HN         0.000  2.300 50.00 50.00 1000.000
1:HIS_83:O         1:VAL_29:N          2.500  3.300 50.00 50.00 1000.000
1:PHE_82:O         1:LEU_94:HN         0.000  2.300 50.00 50.00 1000.000
1:PHE_82:O         1:LEU_94:N          2.500  3.300 50.00 50.00 1000.000
1:LEU_94:O         1:PHE_82:HN         0.000  2.300 50.00 50.00 1000.000
1:LEU_94:O         1:PHE_82:N          2.500  3.300 50.00 50.00 1000.000
1:ASX_92:O         1:VAL_84:HN         0.000  2.300 50.00 50.00 1000.000
1:ASX_92:O         1:VAL_84:N          2.500  3.300 50.00 50.00 1000.000

!1:PHE_59:O        1:ILE_5:HN          0.000  2.300 50.00 50.00 1000.000
!1:PHE_59:O        1:ILE_5:N           2.500  3.300 50.00 50.00 1000.000
1:LYX_61:O         1:ILE_7:HN          0.000  2.300 50.00 50.00 1000.000
1:LYX_61:O         1:ILE_7:N           2.500  3.300 50.00 50.00 1000.000
1:SER_9:O          1:TRP_13:HN         0.000  2.300 50.00 50.00 1000.000
1:SER_9:O          1:TRP_13:N          2.500  3.300 50.00 50.00 1000.000
1:LYX_10:O         1:ASX_14:HN         0.000  2.300 50.00 50.00 1000.000
1:LYX_10:O         1:ASX_14:N          2.500  3.300 50.00 50.00 1000.000
1:ALA_11:O         1:ALA_15:HN         0.000  2.300 50.00 50.00 1000.000
1:ALA_11:O         1:ALA_15:N          2.500  3.300 50.00 50.00 1000.000
1:ALA_12:O         1:GLN_16:HN         0.000  2.300 50.00 50.00 1000.000
1:ALA_12:O         1:GLN_16:N          2.500  3.300 50.00 50.00 1000.000
1:TRP_13:O         1:LEU_17:HN         0.000  2.300 50.00 50.00 1000.000
1:TRP_13:O         1:LEU_17:N          2.500  3.300 50.00 50.00 1000.000
1:ASX_14:O         1:ALA_18:HN         0.000  2.300 50.00 50.00 1000.000
1:ASX_14:O         1:ALA_18:N          2.500  3.300 50.00 50.00 1000.000
1:TYR_85:O         1:ILE_27:HN         0.000  2.300 50.00 50.00 1000.000
1:TYR_85:O         1:ILE_27:N          2.500  3.300 50.00 50.00 1000.000
1:THR_81:O         1:PHE_31:HN         0.000  2.300 50.00 50.00 1000.000
1:THR_81:O         1:PHE_31:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_62:O         1:THR_32:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_62:O         1:THR_32:N          2.500  3.300 50.00 50.00 1000.000
1:CYS_36:O         1:CYS_39:HN         0.000  2.300 50.00 50.00 1000.000
1:CYS_36:O         1:CYS_39:N          2.500  3.300 50.00 50.00 1000.000
1:ILE_42:O         1:PHE_46:HN         0.000  2.300 50.00 50.00 1000.000
1:ILE_42:O         1:PHE_46:N          2.500  3.300 50.00 50.00 1000.000
1:ALA_43:O         1:GLX_47:HN         0.000  2.300 50.00 50.00 1000.000
1:ALA_43:O         1:GLX_47:N          2.500  3.300 50.00 50.00 1000.000
1:PRO_44:O         1:THR_48:HN         0.000  2.300 50.00 50.00 1000.000
1:PRO_44:O         1:THR_48:N          2.500  3.300 50.00 50.00 1000.000
1:LEU_45:O         1:LEU_49:HN         0.000  2.300 50.00 50.00 1000.000
1:LEU_45:O         1:LEU_49:N          2.500  3.300 50.00 50.00 1000.000
1:PHE_46:O         1:SER_50:HN         0.000  2.300 50.00 50.00 1000.000
1:PHE_46:O         1:SER_50:N          2.500  3.300 50.00 50.00 1000.000
1:LEU_49:O         1:TYR_53:HN         0.000  2.300 50.00 50.00 1000.000
1:LEU_49:O         1:TYR_53:N          2.500  3.300 50.00 50.00 1000.000
1:PRO_26:O         1:ILE_58:HN         0.000  2.300 50.00 50.00 1000.000
1:PRO_26:O         1:ILE_58:N          2.500  3.300 50.00 50.00 1000.000
1:SER_3:O          1:PHE_59:HN         0.000  2.300 50.00 50.00 1000.000
1:SER_3:O          1:PHE_59:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_28:O         1:LEU_60:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_28:O         1:LEU_60:N          2.500  3.300 50.00 50.00 1000.000
1:ASX_30:O         1:VAL_62:HN         0.000  2.300 50.00 50.00 1000.000
1:ASX_30:O         1:VAL_62:N          2.500  3.300 50.00 50.00 1000.000
1:THR_32:O         1:VAL_64:HN         0.000  2.300 50.00 50.00 1000.000
1:THR_32:O         1:VAL_64:N          2.500  3.300 50.00 50.00 1000.000
1:ASX_63:O         1:VAL_67:HN         0.000  2.300 50.00 50.00 1000.000
1:ASX_63:O         1:VAL_67:N          2.500  3.300 50.00 50.00 1000.000
1:PHE_31:O         1:THR_81:HN         0.000  2.300 50.00 50.00 1000.000
1:PHE_31:O         1:THR_81:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_29:O         1:HIS_83:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_29:O         1:HIS_83:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_89:O         1:LYX_86:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_89:O         1:LYX_86:N          2.500  3.300 50.00 50.00 1000.000
1:LYX_86:O         1:VAL_89:HN         0.000  2.300 50.00 50.00 1000.000
1:LYX_86:O         1:VAL_89:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_84:O         1:ALA_91:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_84:O         1:ALA_91:N          2.500  3.300 50.00 50.00 1000.000
1:SER_98:O         1:LEU_102:HN        0.000  2.300 50.00 50.00 1000.000
1:SER_98:O         1:LEU_102:N         2.500  3.300 50.00 50.00 1000.000
1:ASX_100:O        1:ALA_104:HN        0.000  2.300 50.00 50.00 1000.000
1:ASX_100:O        1:ALA_104:N         2.500  3.300 50.00 50.00 1000.000
1:LYX_101:O        1:LEU_105:HN        0.000  2.300 50.00 50.00 1000.000
1:LYX_101:O        1:LEU_105:N         2.500  3.300 50.00 50.00 1000.000
1:ALA_104:O        1:LYX_108:HN        0.000  2.300 50.00 50.00 1000.000
1:ALA_104:O        1:LYX_108:N         2.500  3.300 50.00 50.00 1000.000

!
#NOE_distance
1:SER_3:HA         1:VAL_4:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_4:HA         1:ILE_5:HN         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ILE_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:ILE_7:HN         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ILE_7:HA         1:ASX_8:HN         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ASX_8:HA         1:SER_9:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:SER_9:HA         1:LYX_10:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HA        1:ALA_11:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_12:HA        1:TRP_13:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HA        1:ASX_14:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HA        1:ALA_15:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_15:HA        1:GLN_16:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLN_16:HA        1:LEU_17:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HA        1:ALA_18:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_18:HA        1:LYX_19:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_19:HA        1:GLY_20:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_20:HA*       1:LYX_21:HN        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HA        1:GLX_22:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HA        1:GLX_23:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HA        1:HIS_24:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HA        1:LYX_25:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:LYX_25:HA        1:PRO_26:HD1       -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:LYX_25:HA        1:PRO_26:HD2       -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:PRO_26:HA        1:ILE_27:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ILE_27:HA        1:VAL_28:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_28:HA        1:VAL_29:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_29:HA        1:ASX_30:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ASX_30:HA        1:PHE_31:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:PHE_31:HA        1:THR_32:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ALA_33:HA        1:THR_34:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:THR_34:HA        1:TRP_35:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HA        1:CYS_36:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_36:HA        1:GLY_37:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLY_37:HA1       1:PRO_38:HD*       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:GLY_37:HA2       1:PRO_38:HD*       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:PRO_38:HA        1:CYS_39:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:CYS_39:HA        1:LYX_40:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_40:HA        1:MET_41:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:MET_41:HA        1:ILE_42:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_43:HA        1:PRO_44:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_43:HA        1:PRO_44:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_44:HA        1:LEU_45:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_45:HA        1:PHE_46:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HA        1:GLX_47:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HA        1:THR_48:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_48:HA        1:LEU_49:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_49:HA        1:SER_50:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_50:HA        1:ASN_51:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_51:HA        1:ASX_52:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_52:HA        1:TYR_53:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_53:HA        1:ALA_54:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_54:HA        1:GLY_55:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLY_55:HA1       1:LYX_56:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_55:HA2       1:LYX_56:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HA        1:VAL_57:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_57:HA        1:ILE_58:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ILE_58:HA        1:PHE_59:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:PHE_59:HA        1:LEU_60:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:LEU_60:HA        1:LYX_61:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:LYX_61:HA        1:VAL_62:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_62:HA        1:ASX_63:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ASX_63:HA        1:VAL_64:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_64:HA        1:ASX_65:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_65:HA        1:ALA_66:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_67:HA        1:ALA_68:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ALA_68:HA        1:ALA_69:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
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1:GLY_37:HA2       1:LYX_40:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PRO_38:HA        1:MET_41:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_39:HA        1:ILE_42:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_40:HA        1:ALA_43:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HA        1:LEU_45:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HA        1:LEU_45:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_43:HA        1:PHE_46:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_43:HA        1:PHE_46:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HA        1:SER_50:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HA        1:SER_50:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_48:HA        1:ASN_51:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HA        1:ASX_52:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_49:HA        1:ASX_52:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_63:HA        1:ALA_66:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_67:HA        1:VAL_70:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_70:HA        1:ALA_73:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ALA_73:HA        1:ILE_76:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_98:HA        1:LYX_101:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_98:HA        1:LYX_101:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HA       1:LYX_103:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HA       1:LYX_103:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HA       1:HIS_109:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HA       1:HIS_109:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_107:HA       1:ALA_110:HB*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_10:HA        1:ASX_14:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HA        1:LEU_17:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_15:HA        1:LYX_19:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HA        1:GLY_20:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LEU_17:HA        1:LYX_21:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_18:HA        1:GLX_22:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HA        1:LEU_45:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_43:HA        1:GLX_47:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HA        1:ASN_51:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_69:HA        1:ALA_73:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_70:HA        1:ALA_74:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_71:HA        1:GLY_75:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_72:HA        1:ILE_76:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HA        1:LYX_103:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HA       1:VAL_106:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_103:HA       1:ALA_107:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HA       1:ALA_110:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00

1:VAL_4:HA         1:PHE_59:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:LEU_60:HA        -1.000  5.000  3.500 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:LYX_61:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_6:HA         1:LYX_61:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_7:HN         1:LYX_61:HN        -1.000  5.000  3.500 50.00 50.00 1000.000  0.00
1:ILE_27:HA        1:ILE_58:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:ILE_58:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:PHE_59:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_29:HA        1:LEU_60:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:LEU_60:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:LYX_61:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HA        1:VAL_62:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:THR_32:HN        1:ASX_63:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:TYR_85:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_28:HA        1:VAL_84:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:VAL_84:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:HIS_83:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASX_30:HA        1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_81:HA        1:GLY_96:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_81:HA        1:VAL_95:HA        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:PHE_82:HN        1:VAL_95:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:PHE_82:HN        1:LEU_94:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:HIS_83:HA        1:LEU_94:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HA        1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:ASX_92:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HA        1:ASX_92:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:PHE_31:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:PHE_31:HZ        -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:TYR_85:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_13:HH2       1:PHE_31:HE*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:TRP_13:HH2       1:TYR_85:HE*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:TRP_13:HH2       1:TYR_85:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:PHE_31:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:TYR_85:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:TYR_85:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:TYR_85:HE*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:TYR_85:HE*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_59:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_59:HD*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_82:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_82:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_59:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_59:HD*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_82:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_82:HE*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_82:HD*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_59:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_59:HD*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_82:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_82:HE*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_82:HD*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:PHE_59:HZ        -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:PHE_59:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:PHE_59:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:VAL_4:HA         1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_4:HG1*       1:VAL_4:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_4:HG2*       1:VAL_4:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_4:HG1*       1:SER_50:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_4:HG2*       1:SER_50:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_4:HB         1:VAL_4:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_4:HG2*       1:VAL_4:HB         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ILE_5:HA         1:SER_3:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HG2*       1:ILE_5:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_5:HG2*       1:VAL_4:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_5:HB         1:ILE_7:HB         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HG11       1:VAL_4:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HG12       1:ILE_5:HG11       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HG2*       1:ILE_5:HD1*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:ILE_5:HG2*       1:ILE_5:HB         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_5:HG12       1:ILE_5:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_6:HG1*       1:VAL_6:HB         -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:ILE_7:HG2*       1:ASX_8:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_7:HG12       1:SER_9:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_7:HB         1:ILE_7:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_7:HG12       1:ILE_7:HB         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_7:HG2*       1:ILE_7:HB         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_7:HD1*       1:ILE_7:HB         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_7:HD1*       1:ILE_7:HG2*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_7:HD1*       1:ILE_7:HG12       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_7:HG2*       1:ILE_7:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_7:HD1*       1:ILE_7:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_8:HB1        1:ASX_8:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_8:HB2        1:ASX_8:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_9:HA         1:ASX_8:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:PHE_31:HZ        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HE*       1:LYX_10:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_10:HB1       1:LYX_10:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_10:HD1       1:LYX_10:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_10:HB1       1:SER_9:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HB1       1:SER_9:HB*        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_10:HD2       1:LYX_10:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HB1       1:LYX_10:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HB2       1:LYX_10:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HB1       1:TRP_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HG1       1:LYX_10:HB1       -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:LYX_10:HD2       1:LYX_10:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HG2       1:LYX_10:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_11:HB*       1:ALA_11:HA        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:ALA_12:HB*       1:ILE_7:HB         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_12:HB*       1:ALA_12:HA        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:ASX_14:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:LYX_10:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:TRP_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:TRP_13:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:VAL_29:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HE3       1:LEU_60:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:VAL_70:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:VAL_62:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HH2       1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:VAL_70:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HH2       1:VAL_70:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:TRP_13:HZ2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:TRP_13:HZ2       1:TRP_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:ASX_14:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HE3       1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:TRP_13:HE3       1:ALA_71:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:ALA_74:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:TRP_13:HZ3       1:TRP_13:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:VAL_29:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ3       1:VAL_62:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HB2       1:TRP_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:LEU_17:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:VAL_70:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HZ2       1:TRP_13:HZ3       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HB1       1:ASX_14:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HB2       1:ASX_14:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_15:HN        1:ALA_15:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:ALA_15:HB*       1:TRP_13:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_16:HN        1:GLN_16:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HN        1:GLN_16:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HN        1:GLN_16:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HN        1:GLN_16:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_16:HN        1:LEU_60:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_16:HG1       1:GLN_16:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HG1       1:GLY_20:HA*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_16:HB*       1:GLN_16:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_16:HB*       1:GLN_16:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_16:HG2       1:SER_3:HB2        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HB*       1:GLN_16:HG2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HG        1:ASX_14:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HA        1:GLY_20:HA*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HB1       1:LEU_17:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HB2       1:LEU_17:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HG        1:LEU_17:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD2*      1:LEU_17:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HB2       1:ASX_14:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD2*      1:TYR_85:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD2*      1:LEU_17:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD1*      1:LEU_17:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD2*      1:LEU_17:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD1*      1:ILE_27:HD1*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD1*      1:LEU_17:HG        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HD2*      1:LEU_17:HG        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:LEU_17:HB2       1:LEU_60:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HG        1:LEU_17:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HB1       1:ASX_14:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_18:HB*       1:LEU_17:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_18:HB*       1:ALA_18:HA        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
!1:LYX_19:HB2       1:GLY_20:HA*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_19:HG1       1:GLY_20:HA*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_19:HG2       1:LYX_19:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_19:HD*       1:GLN_16:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_19:HB2       1:LYX_19:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_19:HG2       1:LYX_19:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_19:HG2       1:LYX_19:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HE*       1:LYX_21:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HE*       1:LYX_19:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HB1       1:LYX_21:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HD1       1:LYX_21:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HG1       1:LYX_21:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HG2       1:LYX_21:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HG2       1:LYX_21:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LYX_21:HB1       1:ALA_18:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HB2       1:LYX_21:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_21:HG2       1:LYX_21:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LYX_21:HG1       1:ALA_18:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HG1       1:GLX_22:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:GLX_22:HB2       1:GLY_88:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HG2       1:ASX_87:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HG2       1:GLX_22:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HB2       1:GLX_22:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HG1       1:GLX_23:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HB2       1:GLX_23:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HG2       1:GLX_23:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HD2       1:HIS_24:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:HIS_24:HE1       1:HIS_24:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HD2       1:PRO_26:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HD2       1:HIS_24:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HD2       1:HIS_24:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HE1       1:HIS_24:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HA        1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HB1       1:HIS_24:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HB2       1:HIS_24:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HE1       1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HB1       1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HD*       1:LYX_25:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_25:HB2       1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HD*       1:LYX_56:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYX_25:HB1       1:PRO_26:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HB2       1:PRO_26:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_26:HG1       1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_26:HG2       1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_26:HA        1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:PRO_26:HB1       1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_26:HA        1:ILE_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:ILE_27:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:ILE_27:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:VAL_84:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:ILE_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:VAL_84:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:TYR_85:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:ILE_27:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:LYX_86:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HB        1:ILE_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HD1*      1:ILE_27:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HG2*      1:ILE_27:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HD1*      1:TYR_85:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HG2*      1:TYR_85:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HG12      1:TYR_85:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HD1*      1:TYR_85:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HG12      1:GLX_22:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HG2*      1:ILE_27:HD1*      -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:ILE_27:HG2*      1:ILE_27:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HD1*      1:ILE_27:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:ILE_58:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:VAL_28:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:ILE_27:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:VAL_28:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:VAL_28:HN        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:VAL_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:VAL_28:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:LEU_60:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:PHE_82:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:VAL_84:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HB        1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:PHE_59:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG2*      1:PHE_59:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:VAL_28:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HB        1:VAL_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG2*      1:VAL_28:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG2*      1:VAL_106:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:PHE_82:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG2*      1:PRO_26:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG2*      1:VAL_28:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:VAL_28:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG1*      1:VAL_106:HG1*     -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_28:HG2*      1:VAL_106:HG1*     -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_28:HN        1:VAL_84:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:VAL_29:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:VAL_29:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:VAL_29:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HB        1:VAL_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HG1*      1:VAL_29:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HG2*      1:VAL_29:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HB        1:HIS_83:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HG2*      1:HIS_83:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HG2*      1:VAL_29:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_29:HG2*      1:VAL_62:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_29:HB        1:VAL_29:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:VAL_29:HN        1:PHE_31:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_29:HN        1:VAL_84:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:PHE_46:HZ        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:ASX_30:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:ASX_30:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:ASX_30:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:PHE_46:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ASX_30:HB1       1:VAL_29:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HB1       1:ASX_30:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HB2       1:ASX_30:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_31:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:PHE_31:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:PHE_31:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:PHE_82:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:THR_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:THR_81:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:ALA_71:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:HIS_83:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:HIS_83:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:PHE_31:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:PHE_31:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:VAL_29:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:VAL_62:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:ALA_74:HB*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:VAL_29:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:VAL_29:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:ILE_76:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:VAL_62:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:VAL_62:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:VAL_29:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:VAL_70:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:ILE_76:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:ILE_76:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_82:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:THR_81:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:ALA_74:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:ASX_30:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:THR_81:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:ALA_71:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_31:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_31:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:ASX_30:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:VAL_62:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:ILE_76:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:PHE_31:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:PHE_31:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:VAL_70:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HE*       1:VAL_62:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HB1       1:PHE_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HB2       1:PHE_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HB1       1:THR_81:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:PHE_46:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_31:HD*       1:VAL_62:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:THR_32:HA        1:MET_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_32:HB        1:PHE_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_32:HG2*      1:ALA_33:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_32:HG2*      1:THR_32:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_32:HG2*      1:THR_32:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_32:HG2*      1:LYX_40:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_34:HA        1:THR_34:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_34:HG2*      1:LYX_40:HE2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_34:HG2*      1:ASX_63:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_34:HG2*      1:THR_34:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_34:HG2*      1:THR_34:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_35:HD1       1:ASX_65:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HD1       1:TRP_35:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HD1       1:TRP_35:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_35:HZ3       1:CYS_36:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HE3       1:TRP_35:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HE3       1:CYS_36:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HD1       1:THR_34:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_35:HB*       1:TRP_35:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_35:HZ2       1:TRP_35:HE3       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_36:HB2       1:CYS_36:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_36:HB1       1:CYS_36:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_38:HB1       1:PRO_38:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PRO_38:HG*       1:PRO_38:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PRO_38:HG*       1:PRO_38:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PRO_38:HG*       1:PRO_38:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PRO_38:HB2       1:PRO_38:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_39:HB2       1:CYS_39:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_39:HB1       1:CYS_39:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_40:HB*       1:LYX_40:HE1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_40:HB*       1:LYX_40:HE2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_40:HD*       1:LYX_40:HE2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_40:HD*       1:LYX_40:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYX_40:HG2       1:LYX_40:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HG1       1:PRO_38:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HG2       1:PRO_38:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HG1       1:MET_41:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HE*       1:MET_41:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_41:HB*       1:MET_41:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_41:HG2       1:MET_41:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HB*       1:MET_41:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HB        1:ILE_42:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG12      1:ILE_42:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG2*      1:ILE_42:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:ILE_42:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG2*      1:ALA_97:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:ALA_97:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:PRO_80:HD1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG12      1:MET_41:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:ILE_42:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_42:HB        1:ALA_43:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG2*      1:ILE_42:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:ILE_42:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG2*      1:ILE_42:HG11      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG2*      1:ILE_42:HG12      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:ILE_42:HG12      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HD1*      1:ALA_97:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_42:HG2*      1:ALA_43:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_43:HB*       1:PRO_44:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_43:HB*       1:ALA_43:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HB2       1:LEU_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HG        1:LEU_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD1*      1:LEU_45:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD2*      1:LEU_45:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HB1       1:PHE_46:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HB2       1:PHE_46:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD1*      1:GLN_99:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:LEU_45:HB1       1:PRO_44:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HB1       1:LEU_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HB1       1:PHE_46:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HG        1:PRO_44:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD2*      1:LEU_45:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD2*      1:LEU_45:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD2*      1:LEU_45:HG        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HD2*      1:THR_48:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_46:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_59:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:VAL_29:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:ASX_92:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:ALA_43:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_46:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_46:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_59:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:ASX_30:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:ASX_30:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:LYX_61:HB*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:VAL_28:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:VAL_28:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:VAL_28:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:LEU_102:HD1*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:LEU_102:HD2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:LEU_102:HD2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_46:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:ASX_30:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_59:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:VAL_29:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:ASX_30:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:GLX_47:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:GLX_47:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_46:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_59:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:PHE_59:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:ASX_30:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:PHE_59:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:VAL_29:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:LEU_102:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:VAL_28:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:PHE_46:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:ASX_30:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:LYX_61:HD2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HE*       1:LYX_61:HD2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HA        1:LEU_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HB1       1:PHE_46:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HB2       1:PHE_46:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HA        1:THR_48:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HG1       1:GLX_47:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HB2       1:GLX_47:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:GLX_47:HB1       1:PHE_46:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_48:HN        1:THR_48:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_48:HA        1:THR_48:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_48:HG2*      1:THR_48:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_48:HG2*      1:THR_48:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HN        1:LEU_49:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_49:HN        1:LEU_49:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_49:HN        1:LEU_49:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_49:HN        1:LEU_49:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HD1*      1:LYX_103:HE*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_49:HB2       1:LEU_49:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_49:HD1*      1:LEU_49:HG        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HD1*      1:LEU_49:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HD1*      1:VAL_106:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HD1*      1:LEU_49:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_49:HD2*      1:PHE_46:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_50:HB1       1:ASN_51:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_50:HA        1:ASN_51:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_50:HA        1:ALA_54:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_50:HB2       1:VAL_4:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_50:HA        1:SER_50:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_50:HA        1:SER_50:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_51:HB*       1:ASN_51:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_51:HB*       1:ASX_52:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_52:HA        1:ASN_51:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_52:HB1       1:ASX_52:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:TYR_53:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:TYR_53:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:LEU_49:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:LEU_49:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:TYR_53:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:TYR_53:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:TYR_53:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:TYR_53:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:ASX_52:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:ASX_52:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:PRO_26:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:ASX_52:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:PRO_26:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:VAL_57:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:VAL_106:HB       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:LEU_49:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:LEU_49:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:LEU_49:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:LEU_49:HD2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:VAL_57:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:VAL_106:HG2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:PHE_59:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:ASX_52:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:VAL_106:HA       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:LEU_49:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:PRO_26:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:LEU_49:HG        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:LEU_49:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HD*       1:LEU_49:HG        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_53:HB2       1:TYR_53:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_53:HE*       1:PHE_59:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:ALA_54:HB*       1:ALA_54:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:GLY_55:HA2       1:VAL_4:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HN        1:LYX_56:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HE*       1:LYX_56:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HB1       1:LYX_56:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HB2       1:LYX_56:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HB1       1:LYX_56:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HB2       1:LYX_56:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HD1       1:LYX_56:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HB1       1:LYX_25:HE2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HD1       1:LYX_56:HB1       -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:LYX_56:HD2       1:LYX_56:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_56:HG*       1:LYX_56:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HG*       1:LYX_56:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HG*       1:LYX_56:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYX_56:HG*       1:LYX_56:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HG*       1:LYX_56:HD1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_56:HG*       1:LYX_56:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HA        1:ILE_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:TYR_53:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG1*      1:VAL_57:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:VAL_57:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:PRO_26:HD1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:PRO_26:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HB        1:TYR_53:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:TYR_53:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:TYR_53:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HB        1:TYR_53:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG1*      1:PRO_26:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HB        1:VAL_57:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG1*      1:VAL_57:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_57:HG2*      1:VAL_57:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:ILE_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:ILE_58:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:ILE_58:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:ILE_58:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:ILE_58:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:VAL_57:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:PRO_26:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HN        1:ILE_58:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HG2*      1:PHE_59:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_58:HA        1:ILE_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HB        1:ILE_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HG12      1:ILE_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HD1*      1:ILE_58:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ILE_58:HG12      1:GLX_22:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HG2*      1:ILE_58:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_58:HG12      1:ILE_58:HG11      -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:ILE_58:HG2*      1:ILE_58:HG11      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ILE_58:HG12      1:LYX_19:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_58:HG2*      1:ILE_58:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:PHE_59:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HN        1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:PHE_59:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:ILE_58:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:VAL_4:HA         -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:TYR_53:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:PHE_59:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:SER_50:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:TYR_53:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:TYR_53:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:SER_50:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:PHE_59:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:SER_50:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:SER_50:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:SER_50:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:VAL_57:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:VAL_57:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:VAL_57:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:LEU_49:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:VAL_4:HG2*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:VAL_106:HG1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:VAL_57:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:VAL_57:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:VAL_28:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_59:HN        1:PHE_59:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:PHE_59:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:PHE_46:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:GLX_47:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:TYR_53:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:VAL_106:HA       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:VAL_4:HA         -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HN        1:PHE_59:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:LEU_49:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:LEU_49:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:PHE_59:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HE*       1:LEU_49:HG        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:LEU_49:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HD*       1:VAL_28:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_59:HZ        1:VAL_106:HB       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HA        1:LEU_60:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HB1       1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_59:HB2       1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HN        1:PHE_46:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_60:HN        1:LEU_60:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HN        1:LEU_60:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HN        1:LEU_60:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_60:HN        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_60:HN        1:LEU_60:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HB1       1:LEU_60:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HG        1:LEU_60:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HB2       1:LEU_60:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HD1*      1:LEU_60:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_60:HD2*      1:LEU_60:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_60:HG        1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HD1*      1:PHE_59:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_60:HB1       1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LEU_60:HB2       1:PHE_59:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_60:HD2*      1:VAL_29:HG1*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_60:HD2*      1:LEU_60:HG        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_60:HD1*      1:ILE_58:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_61:HN        1:LYX_61:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_61:HN        1:LEU_60:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_61:HN        1:LEU_60:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_61:HD2       1:LYX_61:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_61:HG1       1:LYX_61:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_61:HG2       1:LYX_61:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:LYX_61:HG2       1:VAL_62:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_62:HN        1:VAL_62:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_62:HN        1:VAL_62:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_62:HN        1:VAL_62:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HN        1:VAL_62:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG2*      1:VAL_29:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG2*      1:PHE_31:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HB        1:PHE_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:PHE_31:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:ASX_63:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG2*      1:ASX_8:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_67:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_62:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG2*      1:VAL_62:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:ALA_71:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_64:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_62:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG2*      1:VAL_62:HB        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_67:HG1*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_70:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG2*      1:VAL_29:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_62:HG1*      1:VAL_67:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_63:HB1       1:ASX_63:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_63:HB2       1:ASX_63:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_64:HG*       1:THR_32:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_64:HA        1:ALA_68:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_64:HB        1:VAL_64:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_64:HG*       1:VAL_64:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_64:HG*       1:MET_79:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_65:HB*       1:ASX_65:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_65:HB*       1:ALA_66:HA        -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:ASX_65:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ALA_66:HB*       1:ASX_63:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_67:HG1*      1:VAL_67:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_67:HG2*      1:VAL_67:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_67:HG2*      1:VAL_70:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:VAL_67:HG1*      1:ASX_14:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_67:HB        1:VAL_67:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_67:HG1*      1:VAL_67:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_67:HG1*      1:ALA_66:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_67:HG2*      1:VAL_70:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:VAL_67:HG2*      1:ALA_15:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ALA_68:HB*       1:ASX_65:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_69:HB*       1:VAL_70:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ALA_69:HB*       1:GLX_72:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_70:HB        1:VAL_70:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG1*      1:VAL_70:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG2*      1:VAL_70:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG2*      1:VAL_67:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG2*      1:VAL_70:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG2*      1:VAL_67:HG1*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG2*      1:VAL_67:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_70:HG1*      1:VAL_70:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_71:HB*       1:ALA_71:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLX_72:HG1       1:ALA_73:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_72:HB1       1:GLX_72:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_72:HG2       1:GLX_72:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_73:HA        1:ALA_74:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_73:HB*       1:ALA_74:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_73:HB*       1:ALA_73:HA        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:ALA_74:HB*       1:GLY_75:HA2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_74:HB*       1:ALA_74:HA        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:GLY_75:HA2       1:ALA_74:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_75:HA2       1:ILE_76:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:THR_77:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG11      1:ILE_76:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:ILE_76:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:ILE_76:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:ILE_76:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:THR_81:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:ALA_71:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:ALA_71:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:ALA_71:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:PHE_31:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:PHE_31:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:PHE_31:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG11      1:PHE_31:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:ILE_76:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:THR_81:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:ILE_76:HG11      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:ILE_76:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:ILE_76:HG11      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:VAL_64:HG*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:ILE_76:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_76:HD1*      1:ILE_76:HG12      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HB        1:ILE_76:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:ILE_76:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG12      1:ILE_76:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_76:HG2*      1:ILE_76:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_78:HB*       1:MET_79:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_79:HG2       1:MET_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_79:HB1       1:MET_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_79:HB2       1:MET_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_79:HB1       1:PRO_80:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_79:HG1       1:THR_32:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_79:HB1       1:THR_32:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_79:HB1       1:MET_79:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_80:HB2       1:THR_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_80:HG2       1:THR_32:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_80:HG1       1:ALA_97:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_80:HB1       1:MET_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_80:HG2       1:ALA_97:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_81:HA        1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_81:HG2*      1:PHE_82:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_81:HB        1:THR_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_81:HG2*      1:THR_81:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_81:HB        1:VAL_95:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_81:HG2*      1:THR_81:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_81:HG2*      1:PHE_31:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:THR_81:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:VAL_95:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:ALA_97:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:ASX_30:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:ASX_30:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:PHE_82:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:PHE_82:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:ASX_30:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:PRO_80:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:LEU_94:HG        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:PRO_80:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:LEU_94:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:ILE_42:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:VAL_28:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:LEU_102:HD1*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:LEU_102:HD2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:LEU_102:HD2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_82:HN        1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:PHE_82:HZ        -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:PHE_82:HZ        -1.000  4.700  4.700 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:THR_81:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HZ        1:ALA_97:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HZ        1:ALA_43:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:PHE_46:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HN        1:PHE_82:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HN        1:PHE_82:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HZ        1:ILE_42:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_82:HZ        1:LEU_102:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_82:HD*       1:ASX_30:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:PHE_46:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HE*       1:PHE_82:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_82:HZ        1:PRO_80:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HB1       1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_82:HB2       1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:PHE_82:HB1       1:THR_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:HIS_83:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:PHE_31:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:HIS_83:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:ALA_74:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:HIS_83:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:HIS_83:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:ASX_93:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:THR_81:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:LYX_90:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:LYX_90:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:PHE_82:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:HIS_83:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:PHE_82:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:PHE_31:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:HIS_83:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:ILE_76:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:HIS_83:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:THR_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HD2       1:THR_81:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:HIS_83:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:THR_81:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_83:HN        1:VAL_29:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_83:HE1       1:LYX_90:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HB1       1:HIS_83:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HB2       1:HIS_83:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_83:HB2       1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:HIS_83:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:VAL_84:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:VAL_84:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:HIS_83:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:VAL_84:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:HIS_83:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:VAL_84:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HN        1:ASX_92:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:HIS_83:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:VAL_84:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:VAL_84:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HB        1:VAL_84:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:ASX_93:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:VAL_28:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:TYR_85:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:PRO_26:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:HIS_109:HB1      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:HIS_109:HB1      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:ASX_92:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HB        1:ASX_92:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HB        1:ASX_92:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:ASX_92:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:PRO_26:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:PRO_26:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:VAL_84:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:VAL_84:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG2*      1:ALA_91:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_84:HG1*      1:ASX_92:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:TYR_85:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:VAL_84:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:TYR_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:TYR_85:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:TYR_85:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:VAL_89:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:HIS_83:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:TYR_85:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:TYR_85:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:TYR_85:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:TYR_85:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:ILE_27:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:VAL_29:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:PRO_26:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:VAL_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:TYR_85:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HN        1:ILE_27:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HE2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:TYR_85:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HD*       1:VAL_29:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HE1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HE*       1:LYX_90:HD2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_85:HA        1:VAL_84:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HB1       1:TYR_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_85:HB2       1:TYR_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_86:HB1       1:LYX_86:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_86:HG1       1:LYX_86:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_86:HG1       1:LYX_86:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_87:HA        1:LYX_86:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_87:HB1       1:ASX_87:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_87:HB2       1:ASX_87:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_89:HA        1:TYR_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_89:HB        1:VAL_89:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_89:HG2*      1:VAL_89:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_89:HG1*      1:VAL_89:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_89:HG2*      1:ALA_91:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_89:HG1*      1:ASX_87:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_89:HG1*      1:ASX_87:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_89:HG1*      1:VAL_89:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_90:HA        1:TYR_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HG1       1:ASX_92:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HA        1:VAL_89:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HB1       1:LYX_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HB2       1:LYX_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HE2       1:LYX_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HD1       1:LYX_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HD2       1:LYX_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HG2       1:LYX_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HG2       1:HIS_83:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HB2       1:LYX_90:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HD1       1:LYX_90:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HD2       1:LYX_90:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HG2       1:LYX_90:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HB2       1:LYX_90:HE2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HD1       1:LYX_90:HE2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_90:HG1       1:LYX_90:HE2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_91:HB*       1:TYR_85:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_91:HB*       1:ASX_92:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_91:HB*       1:LYX_90:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_91:HB*       1:ASX_92:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_91:HB*       1:LYX_86:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ALA_91:HB*       1:VAL_84:HB        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:ASX_92:HA        1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_92:HB2       1:ASX_92:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_92:HB1       1:ASX_92:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_93:HB1       1:HIS_83:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_93:HB1       1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_93:HB2       1:LEU_94:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_93:HB2       1:ASX_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_94:HB1       1:LEU_94:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_94:HG        1:LEU_94:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_94:HD2*      1:LEU_94:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_94:HD2*      1:LEU_102:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_94:HG        1:PHE_82:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_94:HD2*      1:LEU_94:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_95:HB        1:THR_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_95:HG2*      1:THR_81:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_95:HB        1:VAL_95:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_95:HG2*      1:VAL_95:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_95:HB        1:GLY_96:HA1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_95:HG2*      1:ALA_78:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ALA_97:HB*       1:GLY_96:HA1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_97:HB*       1:ALA_97:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_97:HB*       1:GLY_96:HA2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_97:HB*       1:PRO_80:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_97:HB*       1:ILE_42:HG12      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_98:HB1       1:SER_98:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HG1       1:GLN_99:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HG2       1:GLN_99:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HB1      1:ASX_100:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HB2      1:ASX_100:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HB1      1:LYX_101:HE*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_101:HB2      1:LYX_101:HE*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_101:HG1      1:LYX_101:HE*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:LYX_101:HB1      1:ASX_100:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HB1      1:LYX_101:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HB1      1:SER_98:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HD*      1:SER_98:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_101:HD*      1:LYX_101:HE*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYX_101:HG2      1:LYX_101:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HG2      1:LYX_101:HB2      -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:PHE_46:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HB2      1:LEU_102:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:LEU_102:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:LEU_102:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:GLN_99:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:GLN_99:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:PHE_46:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:PHE_46:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:PHE_82:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:LEU_105:HB1      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:LEU_102:HG       1:LEU_105:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:LEU_102:HB1      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:LEU_102:HG       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:LEU_102:HB2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:VAL_106:HG1*     -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:VAL_28:HG1*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD2*     1:LEU_94:HD2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
!1:LEU_102:HB1      1:LYX_103:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HG       1:LEU_102:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HB2      1:LEU_102:HG       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:LEU_102:HG       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HD1*     1:LEU_102:HB1      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_103:HG*      1:LYX_103:HE*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYX_103:HD1      1:LYX_103:HE*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_103:HD1      1:ASX_100:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_103:HB1      1:LYX_103:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_105:HN       1:LEU_105:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_105:HN       1:LEU_105:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_105:HN       1:LEU_105:HD1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HN       1:LEU_105:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HN       1:LEU_102:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD1*     1:ASX_93:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD2*     1:LEU_105:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD1*     1:PHE_82:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD2*     1:LEU_105:HG       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HG       1:LEU_105:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD1*     1:LEU_105:HB1      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD1*     1:LEU_105:HB2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD1*     1:LEU_105:HG       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HD1*     1:LEU_105:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_105:HG       1:LYX_101:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HN       1:VAL_106:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HN       1:VAL_106:HB       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HN       1:VAL_106:HG1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HN       1:VAL_106:HG2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HN       1:LEU_102:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HN       1:LEU_105:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG2*     1:ALA_110:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG2*     1:ALA_107:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HB       1:VAL_106:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG1*     1:VAL_106:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG2*     1:VAL_106:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG2*     1:PRO_26:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG2*     1:VAL_106:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG2*     1:ALA_110:HB*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_106:HG1*     1:VAL_106:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_107:HB*      1:ALA_107:HA       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:LYX_108:HG1      1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HG2      1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HE2      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HE1      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HG1      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HG2      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HD2      1:LYX_108:HE2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HG2      1:LYX_108:HE2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HB2      1:LEU_105:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HB1      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HB2      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HD2      1:LYX_108:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HG2      1:LYX_108:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:HIS_109:HD2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:LEU_105:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:HIS_109:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:HIS_109:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:ASX_92:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:ASX_92:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:LYX_108:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:ALA_91:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:LEU_105:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:VAL_84:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:VAL_84:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:HIS_109:HD2      1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:VAL_106:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:VAL_84:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:HIS_109:HE1      1:HIS_109:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:ASX_92:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:LYX_108:HG2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:LYX_108:HG2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:VAL_84:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:LYX_108:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:LYX_108:HD2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HE1      1:LYX_108:HD1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HB1      1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HB2      1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_110:HB*      1:ALA_110:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_111:HB*      1:ALA_111:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ALAC_112:HB*     1:ALA_111:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_3:HN         1:SER_3:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_3:HN         1:SER_3:HB1        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_3:HN         1:SER_3:HB2        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:SER_3:HN         1:GLY_2:HA1        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_4:HN         1:VAL_4:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_4:HN         1:VAL_4:HB         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_4:HN         1:VAL_4:HG1*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_4:HN         1:VAL_4:HG2*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:VAL_4:HN         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:ILE_5:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:ILE_5:HB         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:ILE_5:HG11       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:ILE_5:HG12       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:ILE_5:HD1*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_5:HN         1:ILE_5:HG2*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:VAL_6:HA         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
!1:VAL_6:HN         1:VAL_6:HB         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:VAL_6:HG1*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:VAL_6:HG2*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_7:HN         1:ILE_7:HA         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_7:HN         1:ILE_7:HB         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
!1:ILE_7:HN         1:ILE_7:HG11       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:ILE_7:HN         1:ILE_7:HG12       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_7:HN         1:ILE_7:HG2*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_8:HN         1:ASX_8:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_8:HN         1:ASX_8:HB2        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_8:HN         1:ALA_12:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_8:HN         1:ILE_7:HG2*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_8:HN         1:ASX_8:HB1        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_9:HN         1:SER_9:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_9:HN         1:VAL_67:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_9:HN         1:SER_9:HB*        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_10:HN        1:LYX_10:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HN        1:LYX_10:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HN        1:LYX_10:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HN        1:LYX_10:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HN        1:LYX_10:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_10:HN        1:LYX_10:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LYX_10:HN        1:TRP_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_11:HN        1:ALA_11:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:ALA_11:HN        1:TRP_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_11:HN        1:ALA_11:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_11:HN        1:VAL_67:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_12:HN        1:ALA_12:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_12:HN        1:ALA_12:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:TRP_13:HN        1:TRP_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HE3       1:TRP_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HN        1:TRP_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HN        1:TRP_13:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HE3       1:TRP_13:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_13:HE1       1:VAL_70:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_13:HD1       1:TRP_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HN        1:TRP_13:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HN        1:ASX_14:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HN        1:ASX_14:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_14:HN        1:ASX_14:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_15:HN        1:ALA_15:HB*       -1.000  3.900  3.900 50.00 50.00 1000.000  0.00
1:GLN_16:HE21      1:GLN_16:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_16:HE21      1:ILE_7:HD1*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:LEU_17:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:LEU_17:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:LEU_17:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:LEU_17:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:LEU_17:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:ILE_58:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_17:HN        1:LEU_17:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_18:HN        1:ALA_18:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_18:HN        1:ALA_18:HB*       -1.000  3.900  3.900 50.00 50.00 1000.000  0.00
1:ALA_18:HN        1:LYX_19:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_19:HN        1:LYX_19:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LYX_19:HN        1:LYX_19:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYX_19:HN        1:LYX_19:HG1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYX_19:HN        1:LYX_19:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_20:HN        1:GLY_20:HA*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:GLY_20:HN        1:ILE_58:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_20:HN        1:ALA_18:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HN        1:LYX_21:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HN        1:LYX_21:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HN        1:LYX_21:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HN        1:LYX_21:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:LYX_21:HN        1:LYX_21:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_21:HN        1:LYX_21:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HN        1:GLX_22:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HN        1:GLX_22:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLX_22:HN        1:GLX_22:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HN        1:GLX_22:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_22:HN        1:GLX_22:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
!1:GLX_22:HN        1:ILE_58:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HN        1:GLX_23:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLX_23:HN        1:GLX_23:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HN        1:GLX_23:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HN        1:LYX_25:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLX_23:HN        1:GLX_23:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_23:HN        1:GLX_23:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HN        1:HIS_24:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:HIS_24:HN        1:HIS_24:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HN        1:HIS_24:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_24:HN        1:HIS_24:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HN        1:LYX_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HN        1:LYX_25:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_25:HN        1:LYX_25:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_25:HN        1:LYX_25:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:ILE_27:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_27:HN        1:ILE_27:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:VAL_28:HN        1:ILE_27:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_30:HN        1:LEU_60:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:PHE_31:HZ        1:ILE_76:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_31:HZ        1:ALA_74:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:PHE_31:HN        1:THR_81:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:THR_32:HN        1:THR_32:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_32:HN        1:MET_79:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_32:HN        1:THR_32:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_32:HN        1:THR_32:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_33:HN        1:ALA_33:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:ALA_33:HN        1:CYS_36:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_34:HN        1:THR_34:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_34:HN        1:THR_34:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_34:HN        1:THR_34:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HE3       1:TRP_35:HH2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HD1       1:TRP_35:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HD1       1:THR_34:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_35:HN        1:TRP_35:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_36:HN        1:CYS_36:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_36:HN        1:CYS_36:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_37:HN        1:GLY_37:HA1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_37:HN        1:PRO_38:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLY_37:HN        1:GLY_37:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_39:HN        1:PRO_38:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_39:HN        1:CYS_39:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_39:HN        1:CYS_39:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_39:HN        1:CYS_39:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_40:HN        1:LYX_40:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_40:HN        1:LYX_40:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_40:HN        1:LYX_40:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_40:HN        1:LYX_40:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_40:HN        1:LYX_40:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:MET_41:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:MET_41:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:MET_41:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:MET_41:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:ILE_42:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:LYX_40:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_41:HN        1:MET_41:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HN        1:ILE_42:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HN        1:ILE_42:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_42:HN        1:ILE_42:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_42:HN        1:ILE_42:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_43:HN        1:ALA_43:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_43:HN        1:PRO_44:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_43:HN        1:PRO_44:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_43:HN        1:ALA_43:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:PRO_44:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:PHE_46:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:GLX_47:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:LEU_45:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:PRO_44:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:LEU_45:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:LEU_45:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:LEU_45:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:LEU_45:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_45:HN        1:LEU_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:GLX_47:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HZ        1:VAL_28:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:VAL_28:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_46:HD*       1:LEU_102:HB2      -1.000  7.000  5.500 50.00 50.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_46:HN        1:LEU_45:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLX_47:HN        1:GLX_47:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HN        1:GLX_47:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLX_47:HN        1:GLX_47:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
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1:GLY_96:HN        1:GLY_96:HA1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_96:HN        1:GLY_96:HA2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_97:HN        1:ALA_97:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_97:HN        1:ALA_97:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_97:HN        1:ILE_42:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_98:HN        1:SER_98:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_98:HN        1:SER_98:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_98:HN        1:SER_98:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HN        1:GLN_99:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HN        1:GLN_99:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HE22      1:LEU_45:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HN        1:GLN_99:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_99:HN        1:GLN_99:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASX_100:HN       1:ASX_100:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HN       1:ASX_100:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HN       1:ASX_100:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!1:ASX_100:HN       1:LEU_102:HG       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASX_100:HN       1:SER_98:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HN       1:LYX_101:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HN       1:LYX_101:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HN       1:LYX_101:HG1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_101:HN       1:LYX_101:HD*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
!1:LEU_102:HN       1:LEU_102:HB1      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_102:HN       1:LEU_102:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HN       1:LEU_102:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HN       1:LEU_102:HG       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_102:HN       1:LEU_102:HD1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_102:HN       1:LEU_102:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYX_103:HN       1:LYX_103:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_103:HN       1:LYX_103:HG*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LYX_103:HN       1:LYX_103:HB2      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYX_103:HN       1:LYX_103:HB1      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYX_103:HN       1:LYX_103:HD1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_103:HN       1:LYX_103:HD2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_104:HN       1:ALA_104:HA       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_104:HN       1:ALA_104:HB*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LEU_105:HN       1:LEU_105:HA       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_107:HN       1:ALA_107:HA       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_107:HN       1:ALA_107:HB*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LYX_108:HN       1:LYX_108:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HN       1:LYX_108:HG1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HN       1:LYX_108:HG2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYX_108:HN       1:LYX_108:HB1      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYX_108:HN       1:LYX_108:HB2      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYX_108:HN       1:LYX_108:HD2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:HIS_109:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HN       1:HIS_109:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HN       1:HIS_109:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HD2      1:LYX_108:HG1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:HIS_109:HN       1:HIS_109:HB1      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_110:HN       1:ALA_110:HB*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_110:HN       1:ALA_110:HA       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_111:HN       1:ALA_111:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_111:HN       1:ALA_111:HB*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALAC_112:HN      1:ALAC_112:HB*     -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALAC_112:HN      1:ALAC_112:HA      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!
#mixing_times
-9.990000E+02 
!
#NMR_dihedral
1:GLY_2:C          1:SER_3:N          1:SER_3:CA         1:SER_3:C          -90.000 -40.000 200.00 200.00 1000.000
1:SER_3:C          1:VAL_4:N          1:VAL_4:CA         1:VAL_4:C          -160.000 -80.000 200.00 200.00 1000.000
1:VAL_4:C          1:ILE_5:N          1:ILE_5:CA         1:ILE_5:C          -160.000 -80.000 200.00 200.00 1000.000
1:ILE_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:ILE_7:N          1:ILE_7:CA         1:ILE_7:C          -160.000 -80.000 200.00 200.00 1000.000
1:SER_9:C          1:LYX_10:N         1:LYX_10:CA        1:LYX_10:C         -90.000 -40.000 200.00 200.00 1000.000
1:GLN_16:C         1:LEU_17:N         1:LEU_17:CA        1:LEU_17:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYX_19:C         1:GLY_20:N         1:GLY_20:CA        1:GLY_20:C         -90.000 -40.000 200.00 200.00 1000.000
1:PRO_26:C         1:ILE_27:N         1:ILE_27:CA        1:ILE_27:C         -160.000 -80.000 200.00 200.00 1000.000
1:ILE_27:C         1:VAL_28:N         1:VAL_28:CA        1:VAL_28:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_28:C         1:VAL_29:N         1:VAL_29:CA        1:VAL_29:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_29:C         1:ASX_30:N         1:ASX_30:CA        1:ASX_30:C         -160.000 -80.000 200.00 200.00 1000.000
1:ASX_30:C         1:PHE_31:N         1:PHE_31:CA        1:PHE_31:C         -160.000 -80.000 200.00 200.00 1000.000
1:THR_34:C         1:TRP_35:N         1:TRP_35:CA        1:TRP_35:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYX_40:C         1:MET_41:N         1:MET_41:CA        1:MET_41:C         -90.000 -40.000 200.00 200.00 1000.000
1:ILE_42:C         1:ALA_43:N         1:ALA_43:CA        1:ALA_43:C         -90.000 -40.000 200.00 200.00 1000.000
1:LEU_45:C         1:PHE_46:N         1:PHE_46:CA        1:PHE_46:C         -90.000 -40.000 200.00 200.00 1000.000
1:GLX_47:C         1:THR_48:N         1:THR_48:CA        1:THR_48:C         -90.000 -40.000 200.00 200.00 1000.000
1:THR_48:C         1:LEU_49:N         1:LEU_49:CA        1:LEU_49:C         -90.000 -40.000 200.00 200.00 1000.000
1:ASX_52:C         1:TYR_53:N         1:TYR_53:CA        1:TYR_53:C         -160.000 -80.000 200.00 200.00 1000.000
1:GLY_55:C         1:LYX_56:N         1:LYX_56:CA        1:LYX_56:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYX_56:C         1:VAL_57:N         1:VAL_57:CA        1:VAL_57:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_57:C         1:ILE_58:N         1:ILE_58:CA        1:ILE_58:C         -160.000 -80.000 200.00 200.00 1000.000
1:ILE_58:C         1:PHE_59:N         1:PHE_59:CA        1:PHE_59:C         -160.000 -80.000 200.00 200.00 1000.000
1:PHE_59:C         1:LEU_60:N         1:LEU_60:CA        1:LEU_60:C         -160.000 -80.000 200.00 200.00 1000.000
1:LEU_60:C         1:LYX_61:N         1:LYX_61:CA        1:LYX_61:C         -160.000 -80.000 200.00 200.00 1000.000
1:LYX_61:C         1:VAL_62:N         1:VAL_62:CA        1:VAL_62:C         -160.000 -80.000 200.00 200.00 1000.000
1:ASX_63:C         1:VAL_64:N         1:VAL_64:CA        1:VAL_64:C         -90.000 -40.000 200.00 200.00 1000.000
1:ALA_71:C         1:GLX_72:N         1:GLX_72:CA        1:GLX_72:C         -90.000 -40.000 200.00 200.00 1000.000
1:ILE_76:C         1:THR_77:N         1:THR_77:CA        1:THR_77:C         -160.000 -80.000 200.00 200.00 1000.000
1:THR_77:C         1:ALA_78:N         1:ALA_78:CA        1:ALA_78:C         -90.000 -40.000 200.00 200.00 1000.000
1:THR_81:C         1:PHE_82:N         1:PHE_82:CA        1:PHE_82:C         -160.000 -80.000 200.00 200.00 1000.000
1:PHE_82:C         1:HIS_83:N         1:HIS_83:CA        1:HIS_83:C         -160.000 -80.000 200.00 200.00 1000.000
1:HIS_83:C         1:VAL_84:N         1:VAL_84:CA        1:VAL_84:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_84:C         1:TYR_85:N         1:TYR_85:CA        1:TYR_85:C         -160.000 -80.000 200.00 200.00 1000.000
1:TYR_85:C         1:LYX_86:N         1:LYX_86:CA        1:LYX_86:C         -90.000 -40.000 200.00 200.00 1000.000
1:VAL_89:C         1:LYX_90:N         1:LYX_90:CA        1:LYX_90:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYX_90:C         1:ALA_91:N         1:ALA_91:CA        1:ALA_91:C         -160.000 -80.000 200.00 200.00 1000.000
1:ASX_92:C         1:ASX_93:N         1:ASX_93:CA        1:ASX_93:C         -160.000 -80.000 200.00 200.00 1000.000
1:SER_98:C         1:GLN_99:N         1:GLN_99:CA        1:GLN_99:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYX_101:C        1:LEU_102:N        1:LEU_102:CA       1:LEU_102:C        -90.000 -40.000 200.00 200.00 1000.000
1:LEU_102:C        1:LYX_103:N        1:LYX_103:CA       1:LYX_103:C        -90.000 -40.000 200.00 200.00 1000.000
1:VAL_106:C        1:ALA_107:N        1:ALA_107:CA       1:ALA_107:C        -90.000 -40.000 200.00 200.00 1000.000
1:ALA_107:C        1:LYX_108:N        1:LYX_108:CA       1:LYX_108:C        -90.000 -40.000 200.00 200.00 1000.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          3HN       GLY   1  -0.536 -12.988   1.513
    2   2H    GLY   1          1HN       GLY   1   0.948 -12.889   0.733
    3   3H    GLY   1          2HN       GLY   1   0.560 -14.233   1.581
    4   1HA   GLY   1          1HA       GLY   1   0.646 -13.117   3.642
    5   2HA   GLY   1          2HA       GLY   1   2.127 -12.777   2.732
    6    H    GLY   2           HN       GLY   2  -1.126 -11.559   3.480
    7   1HA   GLY   2          1HA       GLY   2  -0.970  -8.999   2.393
    8   2HA   GLY   2          2HA       GLY   2  -2.025  -9.510   3.710
    9    H    SER   3           HN       SER   3   1.390  -8.477   3.131
   10    HA   SER   3           HA       SER   3   1.765  -7.422   5.775
   11   1HB   SER   3          2HB       SER   3   3.174  -6.515   3.224
   12   2HB   SER   3          1HB       SER   3   3.757  -6.440   4.890
   13    HG   SER   3           HG       SER   3   3.451  -8.848   4.809
   14    H    VAL   4           HN       VAL   4  -0.452  -6.458   5.798
   15    HA   VAL   4           HA       VAL   4  -1.086  -4.083   4.314
   16    HB   VAL   4           HB       VAL   4  -3.026  -4.074   6.002
   17   1HG1  VAL   4          1HG11     VAL   4  -2.443  -6.682   4.546
   18   2HG1  VAL   4          3HG13     VAL   4  -3.982  -6.272   5.305
   19   3HG1  VAL   4          2HG12     VAL   4  -3.369  -5.294   3.962
   20   1HG2  VAL   4          1HG21     VAL   4  -1.654  -4.997   7.894
   21   2HG2  VAL   4          3HG23     VAL   4  -3.248  -5.723   7.652
   22   3HG2  VAL   4          2HG22     VAL   4  -1.797  -6.594   7.143
   23    H    ILE   5           HN       ILE   5   1.362  -3.655   5.580
   24    HA   ILE   5           HA       ILE   5   0.782  -1.662   7.753
   25    HB   ILE   5           HB       ILE   5   3.223  -1.996   8.306
   26   1HG1  ILE   5          2HG12     ILE   5   3.076  -4.589   6.739
   27   2HG1  ILE   5          1HG11     ILE   5   3.604  -3.113   5.929
   28   1HG2  ILE   5          3HG23     ILE   5   1.388  -3.057   9.579
   29   2HG2  ILE   5          2HG22     ILE   5   1.417  -4.454   8.486
   30   3HG2  ILE   5          1HG21     ILE   5   2.813  -4.101   9.521
   31   1HD1  ILE   5          3HD13     ILE   5   4.864  -4.257   8.468
   32   2HD1  ILE   5          2HD12     ILE   5   5.523  -4.396   6.832
   33   3HD1  ILE   5          1HD11     ILE   5   5.398  -2.802   7.596
   34    H    VAL   6           HN       VAL   6   2.498   0.036   7.889
   35    HA   VAL   6           HA       VAL   6   2.825   1.362   5.277
   36    HB   VAL   6           HB       VAL   6   1.529   2.606   6.987
   37   1HG1  VAL   6          3HG23     VAL   6   2.559   1.713   9.059
   38   2HG1  VAL   6          1HG21     VAL   6   4.071   2.561   8.674
   39   3HG1  VAL   6          2HG22     VAL   6   2.596   3.477   9.014
   40   1HG2  VAL   6          2HG12     VAL   6   2.886   3.851   5.339
   41   2HG2  VAL   6          1HG11     VAL   6   2.741   4.713   6.878
   42   3HG2  VAL   6          3HG13     VAL   6   4.251   3.875   6.478
   43    H    ILE   7           HN       ILE   7   4.867   2.047   4.587
   44    HA   ILE   7           HA       ILE   7   7.111   1.319   6.315
   45    HB   ILE   7           HB       ILE   7   6.307  -0.756   4.992
   46   1HG1  ILE   7          1HG11     ILE   7   8.492  -1.509   4.391
   47   2HG1  ILE   7          2HG12     ILE   7   9.174   0.115   4.453
   48   1HG2  ILE   7          3HG23     ILE   7   5.800   0.486   2.871
   49   2HG2  ILE   7          1HG21     ILE   7   7.543   0.740   2.629
   50   3HG2  ILE   7          2HG22     ILE   7   6.875  -0.892   2.619
   51   1HD1  ILE   7          2HD12     ILE   7   7.873  -1.277   6.844
   52   2HD1  ILE   7          1HD11     ILE   7   9.612  -1.321   6.516
   53   3HD1  ILE   7          3HD13     ILE   7   8.848   0.211   6.884
   54    H    ASP   8           HN       ASP   8   9.128   2.101   5.666
   55    HA   ASP   8           HA       ASP   8   9.094   4.263   3.638
   56   1HB   ASP   8          2HB       ASP   8  10.187   5.666   5.346
   57   2HB   ASP   8          1HB       ASP   8   8.670   5.060   6.004
   58    H    SER   9           HN       SER   9  10.267   1.523   3.349
   59    HA   SER   9           HA       SER   9  12.965   2.446   2.672
   60   1HB   SER   9          2HB       SER   9  13.400   1.734   4.906
   61   2HB   SER   9          1HB       SER   9  12.566   0.173   4.623
   62    HG   SER   9           HG       SER   9  14.944   0.190   4.433
   63    H    LYS  10           HN       LYS  10  13.765   1.512   1.026
   64    HA   LYS  10           HA       LYS  10  12.347  -0.033  -0.839
   65   1HB   LYS  10          2HB       LYS  10  14.476  -0.083  -1.971
   66   2HB   LYS  10          1HB       LYS  10  14.129   1.513  -1.248
   67   1HG   LYS  10          2HG       LYS  10  16.311   1.449  -0.742
   68   2HG   LYS  10          1HG       LYS  10  15.730   0.636   0.692
   69   1HD   LYS  10          1HD       LYS  10  17.565  -0.646  -0.053
   70   2HD   LYS  10          2HD       LYS  10  16.188  -1.592  -0.632
   71   1HE   LYS  10          2HE       LYS  10  16.454  -0.583  -2.899
   72   2HE   LYS  10          1HE       LYS  10  17.808   0.390  -2.298
   73   1HZ   LYS  10          3HZ       LYS  10  18.971  -1.634  -1.826
   74   2HZ   LYS  10          1HZ       LYS  10  17.707  -2.541  -2.373
   75   3HZ   LYS  10          2HZ       LYS  10  18.538  -1.569  -3.413
   76    H    ALA  11           HN       ALA  11  14.705  -0.861   1.576
   77    HA   ALA  11           HA       ALA  11  15.164  -3.612   0.884
   78   1HB   ALA  11          2HB       ALA  11  16.653  -2.343   2.397
   79   2HB   ALA  11          3HB       ALA  11  15.362  -2.258   3.617
   80   3HB   ALA  11          1HB       ALA  11  16.065  -3.827   3.174
   81    H    ALA  12           HN       ALA  12  12.904  -2.062   3.170
   82    HA   ALA  12           HA       ALA  12  11.688  -4.547   4.020
   83   1HB   ALA  12          2HB       ALA  12  10.765  -1.670   4.218
   84   2HB   ALA  12          1HB       ALA  12  10.028  -3.075   5.052
   85   3HB   ALA  12          3HB       ALA  12  11.687  -2.571   5.438
   86    H    TRP  13           HN       TRP  13  10.951  -2.107   1.480
   87    HA   TRP  13           HA       TRP  13   8.475  -3.196   0.584
   88   1HB   TRP  13          2HB       TRP  13   8.889  -1.243  -0.500
   89   2HB   TRP  13          1HB       TRP  13  10.618  -1.464  -0.521
   90    HD1  TRP  13           HD1      TRP  13  11.686  -2.939  -2.532
   91    HE1  TRP  13           HE1      TRP  13  10.948  -3.245  -4.964
   92    HE3  TRP  13           HE3      TRP  13   6.847  -1.264  -2.164
   93    HZ2  TRP  13           HZ2      TRP  13   8.651  -2.787  -6.545
   94    HZ3  TRP  13           HZ3      TRP  13   5.470  -1.080  -4.220
   95    HH2  TRP  13           HH2      TRP  13   6.327  -1.883  -6.394
   96    H    ASP  14           HN       ASP  14  11.843  -3.986  -0.380
   97    HA   ASP  14           HA       ASP  14  11.239  -6.068  -2.187
   98   1HB   ASP  14          1HB       ASP  14  13.458  -4.927  -1.848
   99   2HB   ASP  14          2HB       ASP  14  13.693  -5.861  -0.377
  100    H    ALA  15           HN       ALA  15  12.138  -6.221   1.226
  101    HA   ALA  15           HA       ALA  15  11.920  -8.974   1.663
  102   1HB   ALA  15          1HB       ALA  15  12.746  -7.360   3.358
  103   2HB   ALA  15          3HB       ALA  15  11.083  -6.784   3.617
  104   3HB   ALA  15          2HB       ALA  15  11.518  -8.453   4.025
  105    H    GLN  16           HN       GLN  16   9.320  -6.569   2.122
  106    HA   GLN  16           HA       GLN  16   7.217  -8.401   2.694
  107   1HB   GLN  16          2HB       GLN  16   7.246  -5.611   1.505
  108   2HB   GLN  16          1HB       GLN  16   5.747  -6.515   1.800
  109   1HG   GLN  16          1HG       GLN  16   6.124  -6.711   4.123
  110   2HG   GLN  16          2HG       GLN  16   7.793  -6.123   4.010
  111   1HE2  GLN  16          2HE22     GLN  16   6.890  -2.688   3.522
  112   2HE2  GLN  16          1HE21     GLN  16   8.058  -3.926   3.022
  113    H    LEU  17           HN       LEU  17   8.101  -6.905  -0.467
  114    HA   LEU  17           HA       LEU  17   6.307  -8.183  -2.148
  115   1HB   LEU  17          1HB       LEU  17   7.784  -6.580  -3.063
  116   2HB   LEU  17          2HB       LEU  17   9.205  -7.379  -2.426
  117    HG   LEU  17           HG       LEU  17   8.940  -9.235  -4.064
  118   1HD1  LEU  17          1HD21     LEU  17   6.508  -8.977  -4.528
  119   2HD1  LEU  17          3HD23     LEU  17   6.835  -7.390  -5.276
  120   3HD1  LEU  17          2HD22     LEU  17   7.472  -8.874  -6.010
  121   1HD2  LEU  17          3HD13     LEU  17   9.166  -6.414  -5.185
  122   2HD2  LEU  17          2HD12     LEU  17  10.476  -7.367  -4.454
  123   3HD2  LEU  17          1HD11     LEU  17   9.739  -7.900  -5.973
  124    H    ALA  18           HN       ALA  18   9.377  -9.560  -0.862
  125    HA   ALA  18           HA       ALA  18   9.009 -12.084  -2.217
  126   1HB   ALA  18          2HB       ALA  18  11.203 -11.202  -1.579
  127   2HB   ALA  18          1HB       ALA  18  10.790 -11.331   0.141
  128   3HB   ALA  18          3HB       ALA  18  10.913 -12.798  -0.854
  129    H    LYS  19           HN       LYS  19   8.841 -11.374   1.364
  130    HA   LYS  19           HA       LYS  19   7.792 -13.993   1.942
  131   1HB   LYS  19          1HB       LYS  19   7.198 -13.116   4.134
  132   2HB   LYS  19          2HB       LYS  19   8.861 -12.716   3.702
  133   1HG   LYS  19          1HG       LYS  19   8.388 -10.445   3.438
  134   2HG   LYS  19          2HG       LYS  19   6.649 -10.683   3.230
  135   1HD   LYS  19          2HD       LYS  19   6.493 -11.360   5.627
  136   2HD   LYS  19          1HD       LYS  19   8.248 -11.142   5.796
  137   1HE   LYS  19          1HE       LYS  19   7.995  -8.731   5.188
  138   2HE   LYS  19          2HE       LYS  19   6.240  -8.966   5.045
  139   1HZ   LYS  19          3HZ       LYS  19   6.194  -9.556   7.354
  140   2HZ   LYS  19          1HZ       LYS  19   7.823  -9.343   7.488
  141   3HZ   LYS  19          2HZ       LYS  19   6.848  -8.057   7.154
  142    H    GLY  20           HN       GLY  20   6.230 -11.123   0.752
  143   1HA   GLY  20          1HA       GLY  20   3.582 -11.485   1.457
  144   2HA   GLY  20          2HA       GLY  20   4.164 -10.783  -0.062
  145    H    LYS  21           HN       LYS  21   5.598 -13.367  -0.771
  146    HA   LYS  21           HA       LYS  21   5.270 -15.188  -2.023
  147   1HB   LYS  21          2HB       LYS  21   4.230 -15.894   0.206
  148   2HB   LYS  21          1HB       LYS  21   2.640 -15.664  -0.540
  149   1HG   LYS  21          2HG       LYS  21   3.213 -17.304  -2.286
  150   2HG   LYS  21          1HG       LYS  21   4.835 -17.497  -1.616
  151   1HD   LYS  21          1HD       LYS  21   2.243 -18.137  -0.130
  152   2HD   LYS  21          2HD       LYS  21   3.217 -19.325  -0.999
  153   1HE   LYS  21          1HE       LYS  21   4.155 -17.721   1.437
  154   2HE   LYS  21          2HE       LYS  21   3.667 -19.415   1.413
  155   1HZ   LYS  21          3HZ       LYS  21   5.475 -19.860  -0.090
  156   2HZ   LYS  21          2HZ       LYS  21   5.957 -18.284  -0.021
  157   3HZ   LYS  21          1HZ       LYS  21   6.009 -19.219   1.332
  158    H    GLU  22           HN       GLU  22   4.900 -13.039  -3.230
  159    HA   GLU  22           HA       GLU  22   2.487 -12.033  -4.105
  160   1HB   GLU  22          1HB       GLU  22   3.769 -10.985  -5.844
  161   2HB   GLU  22          2HB       GLU  22   4.598 -10.857  -4.287
  162   1HG   GLU  22          1HG       GLU  22   5.407 -13.026  -6.277
  163   2HG   GLU  22          2HG       GLU  22   5.887 -11.359  -6.508
  164    H    GLU  23           HN       GLU  23   4.180 -14.793  -5.407
  165    HA   GLU  23           HA       GLU  23   3.830 -15.366  -7.840
  166   1HB   GLU  23          2HB       GLU  23   2.626 -17.123  -5.644
  167   2HB   GLU  23          1HB       GLU  23   2.833 -17.630  -7.324
  168   1HG   GLU  23          2HG       GLU  23   4.735 -18.486  -6.377
  169   2HG   GLU  23          1HG       GLU  23   5.339 -16.972  -7.048
  170    H    HIS  24           HN       HIS  24   0.790 -15.564  -5.947
  171    HA   HIS  24           HA       HIS  24  -0.676 -14.619  -8.337
  172   1HB   HIS  24          2HB       HIS  24  -0.911 -17.017  -8.558
  173   2HB   HIS  24          1HB       HIS  24  -1.378 -17.174  -6.858
  174    HD2  HIS  24           HD2      HIS  24  -3.022 -14.285  -8.919
  175    HE1  HIS  24           HE1      HIS  24  -5.951 -17.225  -8.143
  176    HE2  HIS  24           HE2      HIS  24  -5.567 -14.861  -9.032
  177    H    LYS  25           HN       LYS  25  -0.638 -12.656  -7.034
  178    HA   LYS  25           HA       LYS  25  -3.125 -12.277  -5.796
  179   1HB   LYS  25          1HB       LYS  25  -2.196 -11.607  -3.467
  180   2HB   LYS  25          2HB       LYS  25  -2.481 -13.295  -3.821
  181   1HG   LYS  25          2HG       LYS  25   0.073 -13.432  -4.382
  182   2HG   LYS  25          1HG       LYS  25   0.156 -11.823  -3.689
  183   1HD   LYS  25          2HD       LYS  25   0.741 -13.466  -2.018
  184   2HD   LYS  25          1HD       LYS  25  -0.792 -12.755  -1.552
  185   1HE   LYS  25          2HE       LYS  25  -0.700 -15.217  -1.200
  186   2HE   LYS  25          1HE       LYS  25  -2.016 -14.757  -2.265
  187   1HZ   LYS  25          1HZ       LYS  25   0.595 -15.663  -3.232
  188   2HZ   LYS  25          2HZ       LYS  25  -0.717 -16.652  -3.034
  189   3HZ   LYS  25          3HZ       LYS  25  -0.785 -15.416  -4.118
  190    HA   PRO  26           HA       PRO  26  -1.922  -8.128  -6.805
  191   1HB   PRO  26          1HB       PRO  26  -3.782  -6.636  -5.525
  192   2HB   PRO  26          2HB       PRO  26  -4.173  -7.760  -6.856
  193   1HG   PRO  26          1HG       PRO  26  -4.234  -8.364  -3.907
  194   2HG   PRO  26          2HG       PRO  26  -5.631  -8.483  -5.007
  195   1HD   PRO  26          2HD       PRO  26  -4.079 -10.614  -4.382
  196   2HD   PRO  26          1HD       PRO  26  -4.494 -10.384  -6.106
  197    H    ILE  27           HN       ILE  27  -0.045  -7.229  -6.225
  198    HA   ILE  27           HA       ILE  27   0.434  -6.478  -3.400
  199    HB   ILE  27           HB       ILE  27   2.130  -5.968  -5.859
  200   1HG1  ILE  27          1HG11     ILE  27   2.486  -8.178  -3.806
  201   2HG1  ILE  27          2HG12     ILE  27   1.964  -8.406  -5.487
  202   1HG2  ILE  27          1HG21     ILE  27   2.420  -4.443  -3.826
  203   2HG2  ILE  27          3HG23     ILE  27   2.853  -5.884  -2.892
  204   3HG2  ILE  27          2HG22     ILE  27   3.863  -5.342  -4.250
  205   1HD1  ILE  27          1HD11     ILE  27   4.128  -7.250  -6.202
  206   2HD1  ILE  27          3HD13     ILE  27   4.645  -7.403  -4.503
  207   3HD1  ILE  27          2HD12     ILE  27   4.300  -8.843  -5.464
  208    H    VAL  28           HN       VAL  28  -0.947  -4.748  -2.950
  209    HA   VAL  28           HA       VAL  28  -1.438  -2.735  -5.100
  210    HB   VAL  28           HB       VAL  28  -2.925  -2.982  -2.460
  211   1HG1  VAL  28          2HG12     VAL  28  -2.943  -0.785  -3.657
  212   2HG1  VAL  28          3HG13     VAL  28  -3.478  -1.596  -5.136
  213   3HG1  VAL  28          1HG11     VAL  28  -4.538  -1.567  -3.719
  214   1HG2  VAL  28          2HG22     VAL  28  -3.694  -4.124  -5.178
  215   2HG2  VAL  28          3HG23     VAL  28  -3.332  -5.062  -3.710
  216   3HG2  VAL  28          1HG21     VAL  28  -4.754  -4.016  -3.759
  217    H    VAL  29           HN       VAL  29   0.204  -1.271  -4.985
  218    HA   VAL  29           HA       VAL  29   1.207  -0.551  -2.244
  219    HB   VAL  29           HB       VAL  29   3.013  -1.356  -3.571
  220   1HG1  VAL  29          1HG11     VAL  29   2.141  -0.974  -5.843
  221   2HG1  VAL  29          2HG12     VAL  29   2.329   0.783  -5.604
  222   3HG1  VAL  29          3HG13     VAL  29   3.750  -0.279  -5.623
  223   1HG2  VAL  29          2HG22     VAL  29   3.008   1.695  -3.294
  224   2HG2  VAL  29          1HG21     VAL  29   3.399   0.516  -2.032
  225   3HG2  VAL  29          3HG23     VAL  29   4.443   0.691  -3.441
  226    H    ASP  30           HN       ASP  30   0.847   1.365  -1.485
  227    HA   ASP  30           HA       ASP  30  -0.483   3.459  -3.158
  228   1HB   ASP  30          2HB       ASP  30  -1.866   2.783  -1.291
  229   2HB   ASP  30          1HB       ASP  30  -0.538   2.943  -0.155
  230    H    PHE  31           HN       PHE  31   1.314   4.492  -3.979
  231    HA   PHE  31           HA       PHE  31   3.657   5.074  -2.252
  232   1HB   PHE  31          1HB       PHE  31   2.943   5.775  -5.115
  233   2HB   PHE  31          2HB       PHE  31   4.405   6.279  -4.309
  234    HD1  PHE  31           HD2      PHE  31   6.124   4.584  -3.570
  235    HD2  PHE  31           HD1      PHE  31   2.773   3.553  -6.084
  236    HE1  PHE  31           HE2      PHE  31   7.410   2.686  -4.512
  237    HE2  PHE  31           HE1      PHE  31   4.118   1.754  -7.117
  238    HZ   PHE  31           HZ       PHE  31   6.432   1.308  -6.353
  239    H    THR  32           HN       THR  32   2.969   6.505  -0.682
  240    HA   THR  32           HA       THR  32   1.598   9.019  -1.530
  241    HB   THR  32           HB       THR  32   0.041   7.367  -0.405
  242    HG1  THR  32           HG1      THR  32  -0.800   8.973   0.907
  243   1HG2  THR  32          2HG22     THR  32   1.661   6.436   1.298
  244   2HG2  THR  32          3HG23     THR  32   1.644   8.015   2.122
  245   3HG2  THR  32          1HG21     THR  32   0.161   7.059   2.007
  246    H    ALA  33           HN       ALA  33   1.878  10.609   0.559
  247    HA   ALA  33           HA       ALA  33   4.593  10.265   1.684
  248   1HB   ALA  33          1HB       ALA  33   4.961  11.488  -0.483
  249   2HB   ALA  33          2HB       ALA  33   3.924  12.790   0.107
  250   3HB   ALA  33          3HB       ALA  33   5.421  12.411   0.952
  251    H    THR  34           HN       THR  34   5.066  12.112   3.234
  252    HA   THR  34           HA       THR  34   2.981  12.165   5.194
  253    HB   THR  34           HB       THR  34   4.856  13.613   6.289
  254    HG1  THR  34           HG1      THR  34   6.887  13.198   4.916
  255   1HG2  THR  34          1HG21     THR  34   5.620  10.855   5.207
  256   2HG2  THR  34          2HG22     THR  34   6.366  11.684   6.584
  257   3HG2  THR  34          3HG23     THR  34   4.674  11.165   6.676
  258    H    TRP  35           HN       TRP  35   4.859  14.774   3.839
  259    HA   TRP  35           HA       TRP  35   3.407  16.966   4.637
  260   1HB   TRP  35          2HB       TRP  35   4.565  18.058   2.543
  261   2HB   TRP  35          1HB       TRP  35   5.494  17.442   3.898
  262    HD1  TRP  35           HD1      TRP  35   7.263  15.637   3.491
  263    HE1  TRP  35           HE1      TRP  35   8.185  14.402   1.469
  264    HE3  TRP  35           HE3      TRP  35   3.756  17.051   0.024
  265    HZ2  TRP  35           HZ2      TRP  35   7.462  13.992  -1.285
  266    HZ3  TRP  35           HZ3      TRP  35   3.921  16.219  -2.300
  267    HH2  TRP  35           HH2      TRP  35   5.760  14.687  -2.964
  268    H    CYS  36           HN       CYS  36   2.495  15.009   1.817
  269    HA   CYS  36           HA       CYS  36   0.877  17.139   0.639
  270   1HB   CYS  36          2HB       CYS  36   0.083  15.324  -0.892
  271   2HB   CYS  36          1HB       CYS  36   1.806  15.636  -0.861
  272    H    GLY  37           HN       GLY  37  -0.060  17.349   2.968
  273   1HA   GLY  37          1HA       GLY  37  -1.738  16.735   4.562
  274   2HA   GLY  37          2HA       GLY  37  -2.515  17.705   3.320
  275    HA   PRO  38           HA       PRO  38  -5.735  14.747   2.611
  276   1HB   PRO  38          2HB       PRO  38  -4.614  14.554  -0.205
  277   2HB   PRO  38          1HB       PRO  38  -6.332  14.582   0.298
  278   1HG   PRO  38          2HG       PRO  38  -5.170  16.876  -0.535
  279   2HG   PRO  38          1HG       PRO  38  -6.152  16.894   0.960
  280   1HD   PRO  38          1HD       PRO  38  -3.148  16.840   0.695
  281   2HD   PRO  38          2HD       PRO  38  -4.176  17.747   1.842
  282    H    CYS  39           HN       CYS  39  -2.592  13.815   1.282
  283    HA   CYS  39           HA       CYS  39  -2.699  11.072   0.964
  284   1HB   CYS  39          1HB       CYS  39  -0.560  12.885   2.142
  285   2HB   CYS  39          2HB       CYS  39  -0.301  11.191   1.809
  286    H    LYS  40           HN       LYS  40  -2.370  12.917   4.003
  287    HA   LYS  40           HA       LYS  40  -1.838  10.710   5.723
  288   1HB   LYS  40          1HB       LYS  40  -3.130  13.423   6.315
  289   2HB   LYS  40          2HB       LYS  40  -2.478  12.309   7.516
  290   1HG   LYS  40          2HG       LYS  40  -0.199  12.585   6.486
  291   2HG   LYS  40          1HG       LYS  40  -0.878  13.804   5.391
  292   1HD   LYS  40          2HD       LYS  40  -1.707  15.086   7.409
  293   2HD   LYS  40          1HD       LYS  40  -0.927  13.886   8.447
  294   1HE   LYS  40          1HE       LYS  40   0.513  15.798   8.333
  295   2HE   LYS  40          2HE       LYS  40   1.292  14.498   7.413
  296   1HZ   LYS  40          2HZ       LYS  40  -0.308  16.669   6.233
  297   2HZ   LYS  40          3HZ       LYS  40   1.338  16.643   6.315
  298   3HZ   LYS  40          1HZ       LYS  40   0.553  15.511   5.421
  299    H    MET  41           HN       MET  41  -4.826  11.915   4.322
  300    HA   MET  41           HA       MET  41  -6.558  10.420   6.211
  301   1HB   MET  41          2HB       MET  41  -7.258  12.214   3.839
  302   2HB   MET  41          1HB       MET  41  -8.388  11.425   4.941
  303   1HG   MET  41          1HG       MET  41  -8.246  13.630   5.690
  304   2HG   MET  41          2HG       MET  41  -7.296  12.694   6.847
  305   1HE   MET  41          3HE       MET  41  -6.369  14.956   7.824
  306   2HE   MET  41          2HE       MET  41  -5.599  16.223   6.838
  307   3HE   MET  41          1HE       MET  41  -7.334  15.875   6.639
  308    H    ILE  42           HN       ILE  42  -5.530  10.549   2.832
  309    HA   ILE  42           HA       ILE  42  -7.114   8.423   1.812
  310    HB   ILE  42           HB       ILE  42  -4.435   9.556   0.967
  311   1HG1  ILE  42          2HG12     ILE  42  -7.207   9.892  -0.276
  312   2HG1  ILE  42          1HG11     ILE  42  -6.640  10.966   0.995
  313   1HG2  ILE  42          2HG22     ILE  42  -6.261   7.562  -0.448
  314   2HG2  ILE  42          1HG21     ILE  42  -4.958   8.453  -1.255
  315   3HG2  ILE  42          3HG23     ILE  42  -4.567   7.328   0.047
  316   1HD1  ILE  42          1HD11     ILE  42  -4.629  11.526  -0.421
  317   2HD1  ILE  42          3HD13     ILE  42  -5.439  10.669  -1.755
  318   3HD1  ILE  42          2HD12     ILE  42  -6.197  12.088  -1.015
  319    H    ALA  43           HN       ALA  43  -3.887   8.361   3.403
  320    HA   ALA  43           HA       ALA  43  -3.376   5.612   3.117
  321   1HB   ALA  43          2HB       ALA  43  -2.592   7.565   5.320
  322   2HB   ALA  43          1HB       ALA  43  -1.987   5.896   5.199
  323   3HB   ALA  43          3HB       ALA  43  -1.675   7.064   3.902
  324    HA   PRO  44           HA       PRO  44  -5.717   4.466   7.146
  325   1HB   PRO  44          1HB       PRO  44  -7.558   6.241   8.223
  326   2HB   PRO  44          2HB       PRO  44  -5.880   5.997   8.782
  327   1HG   PRO  44          1HG       PRO  44  -6.939   8.114   6.941
  328   2HG   PRO  44          2HG       PRO  44  -5.768   8.308   8.267
  329   1HD   PRO  44          2HD       PRO  44  -4.887   8.121   5.703
  330   2HD   PRO  44          1HD       PRO  44  -4.021   7.313   7.036
  331    H    LEU  45           HN       LEU  45  -7.343   6.513   4.731
  332    HA   LEU  45           HA       LEU  45  -9.826   5.054   4.736
  333   1HB   LEU  45          1HB       LEU  45  -8.343   6.720   2.709
  334   2HB   LEU  45          2HB       LEU  45  -9.647   5.700   2.135
  335    HG   LEU  45           HG       LEU  45 -10.007   7.618   4.469
  336   1HD1  LEU  45          3HD13     LEU  45 -10.423   8.211   1.511
  337   2HD1  LEU  45          2HD12     LEU  45 -10.964   9.242   2.852
  338   3HD1  LEU  45          1HD11     LEU  45  -9.236   8.975   2.592
  339   1HD2  LEU  45          3HD23     LEU  45 -11.979   6.408   2.466
  340   2HD2  LEU  45          1HD21     LEU  45 -11.795   5.895   4.155
  341   3HD2  LEU  45          2HD22     LEU  45 -12.395   7.516   3.788
  342    H    PHE  46           HN       PHE  46  -6.926   4.669   2.664
  343    HA   PHE  46           HA       PHE  46  -7.661   2.185   1.469
  344   1HB   PHE  46          2HB       PHE  46  -5.986   3.623   0.538
  345   2HB   PHE  46          1HB       PHE  46  -5.045   3.590   2.007
  346    HD1  PHE  46           HD2      PHE  46  -6.265   1.291  -0.771
  347    HD2  PHE  46           HD1      PHE  46  -3.228   2.140   2.141
  348    HE1  PHE  46           HE2      PHE  46  -4.615   0.051  -2.128
  349    HE2  PHE  46           HE1      PHE  46  -1.592   0.765   0.827
  350    HZ   PHE  46           HZ       PHE  46  -2.213  -0.169  -1.325
  351    H    GLU  47           HN       GLU  47  -6.085   2.905   4.600
  352    HA   GLU  47           HA       GLU  47  -5.285   0.339   5.332
  353   1HB   GLU  47          1HB       GLU  47  -4.937   2.478   6.634
  354   2HB   GLU  47          2HB       GLU  47  -6.612   2.312   7.198
  355   1HG   GLU  47          2HG       GLU  47  -5.307   1.518   8.943
  356   2HG   GLU  47          1HG       GLU  47  -6.077   0.110   8.225
  357    H    THR  48           HN       THR  48  -8.603   1.715   5.249
  358    HA   THR  48           HA       THR  48  -9.902  -0.326   6.732
  359    HB   THR  48           HB       THR  48 -11.126   1.048   4.300
  360    HG1  THR  48           HG1      THR  48 -10.185   2.694   5.380
  361   1HG2  THR  48          2HG22     THR  48 -12.500  -0.633   5.528
  362   2HG2  THR  48          3HG23     THR  48 -12.233   0.269   7.037
  363   3HG2  THR  48          1HG21     THR  48 -13.144   1.012   5.707
  364    H    LEU  49           HN       LEU  49  -9.288  -0.012   3.200
  365    HA   LEU  49           HA       LEU  49 -10.372  -2.570   2.479
  366   1HB   LEU  49          2HB       LEU  49  -8.269  -0.810   1.159
  367   2HB   LEU  49          1HB       LEU  49  -8.955  -2.256   0.409
  368    HG   LEU  49           HG       LEU  49 -10.761  -0.008   1.339
  369   1HD1  LEU  49          2HD22     LEU  49  -9.062   0.986  -0.169
  370   2HD1  LEU  49          1HD21     LEU  49  -9.402  -0.266  -1.380
  371   3HD1  LEU  49          3HD23     LEU  49 -10.650   0.918  -0.941
  372   1HD2  LEU  49          2HD12     LEU  49 -11.757  -2.241   0.739
  373   2HD2  LEU  49          1HD11     LEU  49 -12.277  -0.937  -0.326
  374   3HD2  LEU  49          3HD13     LEU  49 -11.036  -2.078  -0.879
  375    H    SER  50           HN       SER  50  -7.153  -1.439   3.477
  376    HA   SER  50           HA       SER  50  -5.725  -3.838   3.077
  377   1HB   SER  50          2HB       SER  50  -5.224  -1.968   5.408
  378   2HB   SER  50          1HB       SER  50  -4.082  -2.970   4.533
  379    HG   SER  50           HG       SER  50  -5.444  -0.839   3.262
  380    H    ASN  51           HN       ASN  51  -7.471  -2.771   6.002
  381    HA   ASN  51           HA       ASN  51  -7.036  -5.074   7.599
  382   1HB   ASN  51          2HB       ASN  51  -7.949  -3.126   8.618
  383   2HB   ASN  51          1HB       ASN  51  -9.260  -2.994   7.450
  384   1HD2  ASN  51          1HD21     ASN  51 -11.408  -5.286   9.109
  385   2HD2  ASN  51          2HD22     ASN  51 -11.165  -4.431   7.600
  386    H    ASP  52           HN       ASP  52  -9.679  -4.275   5.322
  387    HA   ASP  52           HA       ASP  52 -11.187  -6.637   5.784
  388   1HB   ASP  52          2HB       ASP  52 -11.085  -4.878   3.290
  389   2HB   ASP  52          1HB       ASP  52 -12.376  -6.006   3.725
  390    H    TYR  53           HN       TYR  53  -9.062  -5.894   2.980
  391    HA   TYR  53           HA       TYR  53  -9.180  -8.674   1.963
  392   1HB   TYR  53          1HB       TYR  53  -7.986  -6.089   1.074
  393   2HB   TYR  53          2HB       TYR  53  -7.713  -7.613   0.222
  394    HD1  TYR  53           HD2      TYR  53  -9.559  -8.764  -0.938
  395    HD2  TYR  53           HD1      TYR  53  -9.968  -4.810   0.730
  396    HE1  TYR  53           HE2      TYR  53 -11.374  -8.270  -2.543
  397    HE2  TYR  53           HE1      TYR  53 -11.752  -4.314  -0.890
  398    HH   TYR  53           HH       TYR  53 -13.196  -5.180  -2.459
  399    H    ALA  54           HN       ALA  54  -8.192  -8.982   4.407
  400    HA   ALA  54           HA       ALA  54  -5.293  -8.626   4.504
  401   1HB   ALA  54          1HB       ALA  54  -6.700  -8.658   6.530
  402   2HB   ALA  54          3HB       ALA  54  -7.157 -10.344   6.201
  403   3HB   ALA  54          2HB       ALA  54  -5.473  -9.933   6.596
  404    H    GLY  55           HN       GLY  55  -3.918 -10.631   5.039
  405   1HA   GLY  55          1HA       GLY  55  -3.039 -12.692   4.597
  406   2HA   GLY  55          2HA       GLY  55  -4.637 -13.206   4.039
  407    H    LYS  56           HN       LYS  56  -5.220 -12.168   1.776
  408    HA   LYS  56           HA       LYS  56  -3.150 -13.213  -0.042
  409   1HB   LYS  56          1HB       LYS  56  -5.469 -13.881  -0.287
  410   2HB   LYS  56          2HB       LYS  56  -5.981 -12.196  -0.517
  411   1HG   LYS  56          1HG       LYS  56  -4.549 -12.126  -2.603
  412   2HG   LYS  56          2HG       LYS  56  -4.179 -13.844  -2.340
  413   1HD   LYS  56          2HD       LYS  56  -6.578 -14.393  -2.529
  414   2HD   LYS  56          1HD       LYS  56  -6.971 -12.680  -2.712
  415   1HE   LYS  56          2HE       LYS  56  -7.006 -13.703  -4.903
  416   2HE   LYS  56          1HE       LYS  56  -5.658 -12.572  -4.827
  417   1HZ   LYS  56          1HZ       LYS  56  -5.454 -15.487  -4.489
  418   2HZ   LYS  56          2HZ       LYS  56  -5.127 -14.660  -5.871
  419   3HZ   LYS  56          3HZ       LYS  56  -4.184 -14.435  -4.546
  420    H    VAL  57           HN       VAL  57  -5.035 -10.136   0.180
  421    HA   VAL  57           HA       VAL  57  -3.434  -8.962  -1.944
  422    HB   VAL  57           HB       VAL  57  -5.523  -7.844  -0.087
  423   1HG1  VAL  57          2HG22     VAL  57  -4.309  -6.059  -1.324
  424   2HG1  VAL  57          1HG21     VAL  57  -4.933  -6.732  -2.837
  425   3HG1  VAL  57          3HG23     VAL  57  -6.058  -6.145  -1.632
  426   1HG2  VAL  57          2HG12     VAL  57  -5.900  -9.319  -2.697
  427   2HG2  VAL  57          1HG11     VAL  57  -6.619  -9.663  -1.119
  428   3HG2  VAL  57          3HG13     VAL  57  -7.131  -8.240  -2.022
  429    H    ILE  58           HN       ILE  58  -1.663  -7.622  -1.732
  430    HA   ILE  58           HA       ILE  58  -0.709  -7.134   1.091
  431    HB   ILE  58           HB       ILE  58   0.940  -7.167  -1.458
  432   1HG1  ILE  58          2HG12     ILE  58   1.780  -9.341  -0.092
  433   2HG1  ILE  58          1HG11     ILE  58   0.079  -9.386   0.376
  434   1HG2  ILE  58          1HG21     ILE  58   1.822  -5.859   0.509
  435   2HG2  ILE  58          2HG22     ILE  58   1.789  -7.358   1.445
  436   3HG2  ILE  58          3HG23     ILE  58   2.831  -7.224   0.020
  437   1HD1  ILE  58          3HD13     ILE  58   1.201  -9.386  -2.458
  438   2HD1  ILE  58          2HD12     ILE  58   0.541 -10.767  -1.579
  439   3HD1  ILE  58          1HD11     ILE  58  -0.527  -9.439  -2.069
  440    H    PHE  59           HN       PHE  59  -1.452  -5.176   1.729
  441    HA   PHE  59           HA       PHE  59  -1.626  -2.910  -0.157
  442   1HB   PHE  59          1HB       PHE  59  -2.505  -3.210   2.705
  443   2HB   PHE  59          2HB       PHE  59  -2.589  -1.730   1.786
  444    HD1  PHE  59           HD2      PHE  59  -3.659  -5.350   1.536
  445    HD2  PHE  59           HD1      PHE  59  -4.589  -1.216   0.751
  446    HE1  PHE  59           HE2      PHE  59  -5.895  -5.959   0.877
  447    HE2  PHE  59           HE1      PHE  59  -6.707  -1.894  -0.325
  448    HZ   PHE  59           HZ       PHE  59  -7.455  -4.268  -0.126
  449    H    LEU  60           HN       LEU  60   0.572  -2.438  -0.509
  450    HA   LEU  60           HA       LEU  60   2.356  -1.911   1.814
  451   1HB   LEU  60          1HB       LEU  60   2.746  -1.746  -1.198
  452   2HB   LEU  60          2HB       LEU  60   4.013  -1.425   0.008
  453    HG   LEU  60           HG       LEU  60   2.576  -4.040  -0.571
  454   1HD1  LEU  60          2HD22     LEU  60   4.307  -3.349  -2.205
  455   2HD1  LEU  60          1HD21     LEU  60   5.492  -3.212  -0.889
  456   3HD1  LEU  60          3HD23     LEU  60   4.797  -4.792  -1.300
  457   1HD2  LEU  60          2HD12     LEU  60   4.683  -3.406   1.553
  458   2HD2  LEU  60          1HD11     LEU  60   3.033  -4.005   1.846
  459   3HD2  LEU  60          3HD13     LEU  60   4.212  -5.042   1.051
  460    H    LYS  61           HN       LYS  61   1.657  -0.042   2.900
  461    HA   LYS  61           HA       LYS  61   1.091   2.406   1.292
  462   1HB   LYS  61          2HB       LYS  61   1.152   1.829   4.255
  463   2HB   LYS  61          1HB       LYS  61   0.926   3.449   3.584
  464   1HG   LYS  61          2HG       LYS  61  -1.086   2.790   2.506
  465   2HG   LYS  61          1HG       LYS  61  -0.810   1.066   2.847
  466   1HD   LYS  61          1HD       LYS  61  -1.161   3.116   5.057
  467   2HD   LYS  61          2HD       LYS  61  -2.533   2.268   4.347
  468   1HE   LYS  61          2HE       LYS  61  -0.184   0.889   5.732
  469   2HE   LYS  61          1HE       LYS  61  -1.770   1.201   6.417
  470   1HZ   LYS  61          1HZ       LYS  61  -2.713  -0.175   4.659
  471   2HZ   LYS  61          2HZ       LYS  61  -1.193  -0.544   4.129
  472   3HZ   LYS  61          3HZ       LYS  61  -1.674  -0.992   5.638
  473    H    VAL  62           HN       VAL  62   2.969   2.914   0.187
  474    HA   VAL  62           HA       VAL  62   5.570   2.796   1.633
  475    HB   VAL  62           HB       VAL  62   4.808   2.940  -1.292
  476   1HG1  VAL  62          2HG12     VAL  62   7.551   3.465  -0.049
  477   2HG1  VAL  62          3HG13     VAL  62   7.280   3.060  -1.753
  478   3HG1  VAL  62          1HG11     VAL  62   6.638   4.569  -1.101
  479   1HG2  VAL  62          3HG23     VAL  62   4.996   0.743  -0.067
  480   2HG2  VAL  62          1HG21     VAL  62   6.201   0.930  -1.362
  481   3HG2  VAL  62          2HG22     VAL  62   6.677   1.150   0.331
  482    H    ASP  63           HN       ASP  63   6.361   4.506   2.550
  483    HA   ASP  63           HA       ASP  63   5.261   7.167   2.104
  484   1HB   ASP  63          1HB       ASP  63   5.913   6.455   4.345
  485   2HB   ASP  63          2HB       ASP  63   7.580   6.184   3.806
  486    H    VAL  64           HN       VAL  64   5.713   7.673   0.006
  487    HA   VAL  64           HA       VAL  64   8.056   7.534  -1.515
  488    HB   VAL  64           HB       VAL  64   5.840   9.623  -1.385
  489   1HG1  VAL  64          1HG11     VAL  64   7.968   9.280  -3.520
  490   2HG1  VAL  64          3HG13     VAL  64   6.463  10.200  -3.734
  491   3HG1  VAL  64          2HG12     VAL  64   7.647  10.724  -2.535
  492   1HG2  VAL  64          1HG21     VAL  64   5.178   7.249  -1.965
  493   2HG2  VAL  64          3HG23     VAL  64   4.856   8.438  -3.234
  494   3HG2  VAL  64          2HG22     VAL  64   6.261   7.354  -3.358
  495    H    ASP  65           HN       ASP  65   7.143   9.837   1.041
  496    HA   ASP  65           HA       ASP  65   9.036  11.865   0.662
  497   1HB   ASP  65          2HB       ASP  65   7.150  11.738   2.395
  498   2HB   ASP  65          1HB       ASP  65   8.221  10.705   3.357
  499    H    ALA  66           HN       ALA  66   9.362   8.615   2.066
  500    HA   ALA  66           HA       ALA  66  12.221   9.031   2.746
  501   1HB   ALA  66          1HB       ALA  66  10.308   6.713   3.241
  502   2HB   ALA  66          3HB       ALA  66  11.991   6.819   3.799
  503   3HB   ALA  66          2HB       ALA  66  10.776   7.961   4.413
  504    H    VAL  67           HN       VAL  67  10.191   6.590   0.967
  505    HA   VAL  67           HA       VAL  67  12.650   5.641  -0.365
  506    HB   VAL  67           HB       VAL  67   9.863   4.571  -0.900
  507   1HG1  VAL  67          1HG21     VAL  67  11.960   3.907  -2.238
  508   2HG1  VAL  67          2HG22     VAL  67  12.620   3.253  -0.742
  509   3HG1  VAL  67          3HG23     VAL  67  11.132   2.558  -1.419
  510   1HG2  VAL  67          1HG11     VAL  67  11.738   3.911   1.399
  511   2HG2  VAL  67          3HG13     VAL  67  10.046   4.458   1.525
  512   3HG2  VAL  67          2HG12     VAL  67  10.410   2.854   0.867
  513    H    ALA  68           HN       ALA  68  12.584   8.067  -1.142
  514    HA   ALA  68           HA       ALA  68  11.006   8.857  -3.336
  515   1HB   ALA  68          1HB       ALA  68  12.488  10.368  -2.083
  516   2HB   ALA  68          3HB       ALA  68  13.921   9.532  -2.725
  517   3HB   ALA  68          2HB       ALA  68  12.849  10.432  -3.821
  518    H    ALA  69           HN       ALA  69  14.073   7.018  -3.295
  519    HA   ALA  69           HA       ALA  69  14.614   6.914  -6.038
  520   1HB   ALA  69          3HB       ALA  69  15.150   4.803  -3.899
  521   2HB   ALA  69          1HB       ALA  69  15.930   4.897  -5.493
  522   3HB   ALA  69          2HB       ALA  69  16.186   6.189  -4.306
  523    H    VAL  70           HN       VAL  70  12.855   4.390  -4.129
  524    HA   VAL  70           HA       VAL  70  12.216   2.801  -6.419
  525    HB   VAL  70           HB       VAL  70  10.709   2.980  -3.780
  526   1HG1  VAL  70          1HG21     VAL  70  10.800   0.759  -5.853
  527   2HG1  VAL  70          2HG22     VAL  70  10.000   0.682  -4.270
  528   3HG1  VAL  70          3HG23     VAL  70   9.407   1.800  -5.502
  529   1HG2  VAL  70          3HG13     VAL  70  13.159   2.420  -3.485
  530   2HG2  VAL  70          1HG11     VAL  70  12.112   1.034  -3.135
  531   3HG2  VAL  70          2HG12     VAL  70  12.975   1.134  -4.687
  532    H    ALA  71           HN       ALA  71  10.465   5.400  -4.697
  533    HA   ALA  71           HA       ALA  71   8.066   5.301  -6.185
  534   1HB   ALA  71          3HB       ALA  71   8.440   6.648  -4.135
  535   2HB   ALA  71          2HB       ALA  71   9.438   7.785  -5.062
  536   3HB   ALA  71          1HB       ALA  71   7.719   7.602  -5.442
  537    H    GLU  72           HN       GLU  72  10.967   7.423  -6.924
  538    HA   GLU  72           HA       GLU  72   9.755   8.328  -9.370
  539   1HB   GLU  72          2HB       GLU  72  11.850   9.355  -9.886
  540   2HB   GLU  72          1HB       GLU  72  11.433   9.607  -8.199
  541   1HG   GLU  72          2HG       GLU  72  13.729   9.235  -8.163
  542   2HG   GLU  72          1HG       GLU  72  13.045   7.719  -7.613
  543    H    ALA  73           HN       ALA  73  12.005   5.599  -8.663
  544    HA   ALA  73           HA       ALA  73  12.474   4.860 -11.357
  545   1HB   ALA  73          2HB       ALA  73  13.720   3.946  -9.432
  546   2HB   ALA  73          3HB       ALA  73  12.264   3.089  -8.879
  547   3HB   ALA  73          1HB       ALA  73  13.024   2.646 -10.420
  548    H    ALA  74           HN       ALA  74   9.860   3.891  -9.104
  549    HA   ALA  74           HA       ALA  74   8.476   2.135 -10.896
  550   1HB   ALA  74          1HB       ALA  74   7.625   3.637  -8.398
  551   2HB   ALA  74          2HB       ALA  74   6.603   2.463  -9.259
  552   3HB   ALA  74          3HB       ALA  74   8.140   1.954  -8.542
  553    H    GLY  75           HN       GLY  75   8.438   5.630 -10.384
  554   1HA   GLY  75          1HA       GLY  75   7.997   7.100 -12.230
  555   2HA   GLY  75          2HA       GLY  75   6.795   5.964 -12.863
  556    H    ILE  76           HN       ILE  76   7.189   7.141  -9.501
  557    HA   ILE  76           HA       ILE  76   4.351   7.914  -9.402
  558    HB   ILE  76           HB       ILE  76   6.654   7.816  -7.441
  559   1HG1  ILE  76          2HG12     ILE  76   5.554   6.039  -6.437
  560   2HG1  ILE  76          1HG11     ILE  76   3.971   6.486  -7.082
  561   1HG2  ILE  76          1HG21     ILE  76   3.855   8.919  -6.951
  562   2HG2  ILE  76          2HG22     ILE  76   4.982   8.432  -5.671
  563   3HG2  ILE  76          3HG23     ILE  76   5.401   9.770  -6.738
  564   1HD1  ILE  76          1HD11     ILE  76   6.171   5.223  -8.721
  565   2HD1  ILE  76          2HD12     ILE  76   4.786   4.386  -8.030
  566   3HD1  ILE  76          3HD13     ILE  76   4.523   5.605  -9.270
  567    H    THR  77           HN       THR  77   3.566   9.964  -9.395
  568    HA   THR  77           HA       THR  77   5.440  12.279  -9.460
  569    HB   THR  77           HB       THR  77   4.013  13.193 -11.342
  570    HG1  THR  77           HG1      THR  77   3.306  10.476 -11.756
  571   1HG2  THR  77          3HG23     THR  77   6.276  12.247 -11.772
  572   2HG2  THR  77          1HG21     THR  77   5.560  10.644 -12.034
  573   3HG2  THR  77          2HG22     THR  77   5.166  11.982 -13.130
  574    H    ALA  78           HN       ALA  78   1.998  12.067 -10.161
  575    HA   ALA  78           HA       ALA  78   1.349  13.997  -8.067
  576   1HB   ALA  78          2HB       ALA  78  -0.404  12.363  -9.938
  577   2HB   ALA  78          3HB       ALA  78  -0.970  13.671  -8.878
  578   3HB   ALA  78          1HB       ALA  78   0.167  14.022 -10.196
  579    H    MET  79           HN       MET  79   2.318  12.673  -6.327
  580    HA   MET  79           HA       MET  79   1.132  10.303  -5.401
  581   1HB   MET  79          1HB       MET  79   2.131  10.751  -3.249
  582   2HB   MET  79          2HB       MET  79   3.256  11.164  -4.540
  583   1HG   MET  79          1HG       MET  79   1.585  13.211  -3.011
  584   2HG   MET  79          2HG       MET  79   3.217  12.719  -2.592
  585   1HE   MET  79          3HE       MET  79   1.634  15.611  -3.480
  586   2HE   MET  79          2HE       MET  79   2.269  16.243  -5.016
  587   3HE   MET  79          1HE       MET  79   1.062  14.941  -5.029
  588    HA   PRO  80           HA       PRO  80   0.265   9.299  -3.520
  589   1HB   PRO  80          2HB       PRO  80  -1.996   7.895  -2.970
  590   2HB   PRO  80          1HB       PRO  80  -1.239   9.033  -1.822
  591   1HG   PRO  80          1HG       PRO  80  -3.636   9.504  -3.572
  592   2HG   PRO  80          2HG       PRO  80  -3.315  10.011  -1.879
  593   1HD   PRO  80          1HD       PRO  80  -2.963  11.627  -4.164
  594   2HD   PRO  80          2HD       PRO  80  -2.213  11.920  -2.580
  595    H    THR  81           HN       THR  81   0.544   7.518  -4.804
  596    HA   THR  81           HA       THR  81  -1.063   7.271  -7.328
  597    HB   THR  81           HB       THR  81   1.932   7.291  -6.907
  598    HG1  THR  81           HG1      THR  81   0.407   9.230  -7.467
  599   1HG2  THR  81          1HG21     THR  81   0.332   6.394  -9.343
  600   2HG2  THR  81          2HG22     THR  81   2.061   6.800  -9.378
  601   3HG2  THR  81          3HG23     THR  81   1.498   5.435  -8.400
  602    H    PHE  82           HN       PHE  82  -2.014   5.318  -7.321
  603    HA   PHE  82           HA       PHE  82  -0.995   3.191  -5.551
  604   1HB   PHE  82          1HB       PHE  82  -3.644   3.639  -6.927
  605   2HB   PHE  82          2HB       PHE  82  -3.272   2.208  -6.017
  606    HD1  PHE  82           HD1      PHE  82  -3.846   5.891  -5.769
  607    HD2  PHE  82           HD2      PHE  82  -3.228   2.213  -3.584
  608    HE1  PHE  82           HE1      PHE  82  -4.533   7.011  -3.679
  609    HE2  PHE  82           HE2      PHE  82  -4.017   3.340  -1.514
  610    HZ   PHE  82           HZ       PHE  82  -4.517   5.732  -1.521
  611    H    HIS  83           HN       HIS  83  -0.101   1.357  -6.450
  612    HA   HIS  83           HA       HIS  83  -0.503   0.805  -9.383
  613   1HB   HIS  83          2HB       HIS  83   1.978   0.497  -7.747
  614   2HB   HIS  83          1HB       HIS  83   1.745  -0.252  -9.323
  615    HD2  HIS  83           HD2      HIS  83   0.618   3.340  -9.706
  616    HE1  HIS  83           HE1      HIS  83   4.726   3.215 -10.670
  617    HE2  HIS  83           HE2      HIS  83   2.606   4.617 -10.822
  618    H    VAL  84           HN       VAL  84  -0.816  -1.413  -9.838
  619    HA   VAL  84           HA       VAL  84  -1.116  -3.219  -7.468
  620    HB   VAL  84           HB       VAL  84  -2.558  -3.444 -10.130
  621   1HG1  VAL  84          2HG22     VAL  84  -2.321  -5.509  -8.763
  622   2HG1  VAL  84          1HG21     VAL  84  -3.012  -4.664  -7.368
  623   3HG1  VAL  84          3HG23     VAL  84  -4.001  -4.954  -8.811
  624   1HG2  VAL  84          3HG13     VAL  84  -3.528  -2.145  -7.554
  625   2HG2  VAL  84          2HG12     VAL  84  -3.332  -1.352  -9.135
  626   3HG2  VAL  84          1HG11     VAL  84  -4.561  -2.603  -8.925
  627    H    TYR  85           HN       TYR  85   1.012  -4.126  -7.489
  628    HA   TYR  85           HA       TYR  85   2.037  -5.144 -10.093
  629   1HB   TYR  85          2HB       TYR  85   3.370  -5.105  -7.385
  630   2HB   TYR  85          1HB       TYR  85   4.018  -5.859  -8.820
  631    HD1  TYR  85           HD2      TYR  85   2.828  -2.582  -7.446
  632    HD2  TYR  85           HD1      TYR  85   5.521  -4.602 -10.129
  633    HE1  TYR  85           HE2      TYR  85   3.941  -0.430  -7.989
  634    HE2  TYR  85           HE1      TYR  85   6.527  -2.420 -10.759
  635    HH   TYR  85           HH       TYR  85   4.985   0.634  -9.782
  636    H    LYS  86           HN       LYS  86  -0.074  -6.412 -10.053
  637    HA   LYS  86           HA       LYS  86  -0.395  -8.566  -8.199
  638   1HB   LYS  86          1HB       LYS  86  -2.181  -7.613  -9.721
  639   2HB   LYS  86          2HB       LYS  86  -1.396  -8.432 -11.081
  640   1HG   LYS  86          2HG       LYS  86  -1.836 -10.622 -10.041
  641   2HG   LYS  86          1HG       LYS  86  -2.497  -9.829  -8.598
  642   1HD   LYS  86          2HD       LYS  86  -4.246  -8.763 -10.040
  643   2HD   LYS  86          1HD       LYS  86  -3.649  -9.684 -11.422
  644   1HE   LYS  86          2HE       LYS  86  -4.739 -10.898  -8.822
  645   2HE   LYS  86          1HE       LYS  86  -5.661 -10.678 -10.310
  646   1HZ   LYS  86          1HZ       LYS  86  -4.117 -12.122 -11.421
  647   2HZ   LYS  86          3HZ       LYS  86  -3.300 -12.385 -10.014
  648   3HZ   LYS  86          2HZ       LYS  86  -4.883 -12.861 -10.164
  649    H    ASP  87           HN       ASP  87   0.333 -10.601  -8.149
  650    HA   ASP  87           HA       ASP  87   1.451 -12.512  -8.596
  651   1HB   ASP  87          2HB       ASP  87   1.947 -11.555 -11.450
  652   2HB   ASP  87          1HB       ASP  87   2.148 -13.177 -10.799
  653    H    GLY  88           HN       GLY  88   3.034  -9.855 -10.274
  654   1HA   GLY  88          1HA       GLY  88   5.044  -9.264  -8.454
  655   2HA   GLY  88          2HA       GLY  88   5.730 -10.530  -9.498
  656    H    VAL  89           HN       VAL  89   3.329  -8.213 -10.872
  657    HA   VAL  89           HA       VAL  89   5.420  -6.450 -11.872
  658    HB   VAL  89           HB       VAL  89   5.661  -8.373 -13.376
  659   1HG1  VAL  89          2HG12     VAL  89   3.370  -9.344 -13.195
  660   2HG1  VAL  89          3HG13     VAL  89   2.736  -7.992 -14.157
  661   3HG1  VAL  89          1HG11     VAL  89   3.896  -9.123 -14.869
  662   1HG2  VAL  89          2HG22     VAL  89   5.959  -6.072 -14.254
  663   2HG2  VAL  89          1HG21     VAL  89   5.428  -7.225 -15.491
  664   3HG2  VAL  89          3HG23     VAL  89   4.268  -6.073 -14.806
  665    H    LYS  90           HN       LYS  90   4.587  -4.517 -12.301
  666    HA   LYS  90           HA       LYS  90   2.206  -3.480 -11.506
  667   1HB   LYS  90          1HB       LYS  90   4.376  -2.375 -12.345
  668   2HB   LYS  90          2HB       LYS  90   3.678  -2.475 -13.956
  669   1HG   LYS  90          1HG       LYS  90   1.693  -1.136 -13.069
  670   2HG   LYS  90          2HG       LYS  90   2.489  -1.087 -11.500
  671   1HD   LYS  90          1HD       LYS  90   2.914   0.997 -12.643
  672   2HD   LYS  90          2HD       LYS  90   4.426   0.118 -12.449
  673   1HE   LYS  90          1HE       LYS  90   4.128   1.230 -14.683
  674   2HE   LYS  90          2HE       LYS  90   4.443  -0.504 -14.806
  675   1HZ   LYS  90          2HZ       LYS  90   1.765   0.713 -14.913
  676   2HZ   LYS  90          3HZ       LYS  90   2.653   0.266 -16.235
  677   3HZ   LYS  90          1HZ       LYS  90   2.140  -0.872 -15.162
  678    H    ALA  91           HN       ALA  91   0.424  -4.808 -12.007
  679    HA   ALA  91           HA       ALA  91  -0.287  -5.413 -14.782
  680   1HB   ALA  91          1HB       ALA  91  -0.600  -7.046 -12.957
  681   2HB   ALA  91          3HB       ALA  91  -1.725  -5.932 -12.143
  682   3HB   ALA  91          2HB       ALA  91  -2.148  -6.625 -13.723
  683    H    ASP  92           HN       ASP  92  -1.179  -3.052 -12.308
  684    HA   ASP  92           HA       ASP  92  -2.840  -1.602 -14.219
  685   1HB   ASP  92          2HB       ASP  92  -4.192  -3.478 -12.953
  686   2HB   ASP  92          1HB       ASP  92  -4.142  -2.374 -11.577
  687    H    ASP  93           HN       ASP  93  -3.621   0.489 -13.083
  688    HA   ASP  93           HA       ASP  93  -1.993   1.347 -10.802
  689   1HB   ASP  93          1HB       ASP  93  -1.740   2.778 -13.476
  690   2HB   ASP  93          2HB       ASP  93  -1.013   3.275 -11.948
  691    H    LEU  94           HN       LEU  94  -2.646   3.504 -10.115
  692    HA   LEU  94           HA       LEU  94  -5.048   4.762 -11.208
  693   1HB   LEU  94          2HB       LEU  94  -6.024   2.922 -10.079
  694   2HB   LEU  94          1HB       LEU  94  -5.008   3.083  -8.655
  695    HG   LEU  94           HG       LEU  94  -7.417   3.693  -8.508
  696   1HD1  LEU  94          1HD21     LEU  94  -5.751   4.419  -6.816
  697   2HD1  LEU  94          3HD23     LEU  94  -5.691   6.013  -7.605
  698   3HD1  LEU  94          2HD22     LEU  94  -7.197   5.400  -6.915
  699   1HD2  LEU  94          3HD13     LEU  94  -7.423   4.965 -10.722
  700   2HD2  LEU  94          1HD11     LEU  94  -8.225   5.793  -9.377
  701   3HD2  LEU  94          2HD12     LEU  94  -6.614   6.302  -9.882
  702    H    VAL  95           HN       VAL  95  -4.473   6.917 -11.024
  703    HA   VAL  95           HA       VAL  95  -2.577   7.681  -8.890
  704    HB   VAL  95           HB       VAL  95  -3.556   9.283 -11.246
  705   1HG1  VAL  95          3HG23     VAL  95  -1.226   9.704  -9.348
  706   2HG1  VAL  95          1HG21     VAL  95  -1.429  10.555 -10.891
  707   3HG1  VAL  95          2HG22     VAL  95  -2.614  10.789  -9.613
  708   1HG2  VAL  95          2HG12     VAL  95  -1.015   7.632 -10.862
  709   2HG2  VAL  95          3HG13     VAL  95  -2.312   7.258 -12.023
  710   3HG2  VAL  95          1HG11     VAL  95  -1.319   8.707 -12.244
  711    H    GLY  96           HN       GLY  96  -2.934   9.489  -7.617
  712   1HA   GLY  96          1HA       GLY  96  -4.085  11.149  -6.547
  713   2HA   GLY  96          2HA       GLY  96  -5.485  10.913  -7.612
  714    H    ALA  97           HN       ALA  97  -6.461  11.259  -5.326
  715    HA   ALA  97           HA       ALA  97  -6.462   9.146  -3.399
  716   1HB   ALA  97          1HB       ALA  97  -7.279  11.480  -3.001
  717   2HB   ALA  97          2HB       ALA  97  -8.657  11.179  -4.059
  718   3HB   ALA  97          3HB       ALA  97  -8.481  10.255  -2.552
  719    H    SER  98           HN       SER  98  -8.773  10.020  -5.917
  720    HA   SER  98           HA       SER  98 -10.604   8.886  -6.817
  721   1HB   SER  98          2HB       SER  98  -8.173   7.227  -7.539
  722   2HB   SER  98          1HB       SER  98  -9.593   7.539  -8.569
  723    HG   SER  98           HG       SER  98  -7.439   8.890  -8.651
  724    H    GLN  99           HN       GLN  99 -10.810   8.130  -4.280
  725    HA   GLN  99           HA       GLN  99 -10.420   5.623  -3.357
  726   1HB   GLN  99          2HB       GLN  99 -12.983   7.230  -2.954
  727   2HB   GLN  99          1HB       GLN  99 -12.387   5.945  -1.904
  728   1HG   GLN  99          2HG       GLN  99 -11.105   8.678  -2.373
  729   2HG   GLN  99          1HG       GLN  99 -11.898   8.101  -0.914
  730   1HE2  GLN  99          2HE22     GLN  99  -9.089   5.831  -0.139
  731   2HE2  GLN  99          1HE21     GLN  99 -10.820   5.651  -0.364
  732    H    ASP 100           HN       ASP 100 -13.369   6.472  -5.277
  733    HA   ASP 100           HA       ASP 100 -14.532   3.886  -5.098
  734   1HB   ASP 100          2HB       ASP 100 -15.769   5.882  -5.843
  735   2HB   ASP 100          1HB       ASP 100 -14.800   5.944  -7.330
  736    H    LYS 101           HN       LYS 101 -12.330   5.261  -7.559
  737    HA   LYS 101           HA       LYS 101 -12.359   2.937  -9.249
  738   1HB   LYS 101          1HB       LYS 101 -11.755   5.208 -10.009
  739   2HB   LYS 101          2HB       LYS 101 -10.346   5.197  -8.949
  740   1HG   LYS 101          1HG       LYS 101  -9.767   4.770 -11.291
  741   2HG   LYS 101          2HG       LYS 101  -9.318   3.397 -10.259
  742   1HD   LYS 101          2HD       LYS 101 -11.151   2.069 -11.077
  743   2HD   LYS 101          1HD       LYS 101 -11.940   3.478 -11.812
  744   1HE   LYS 101          2HE       LYS 101 -10.829   2.033 -13.498
  745   2HE   LYS 101          1HE       LYS 101 -10.177   3.678 -13.487
  746   1HZ   LYS 101          1HZ       LYS 101  -8.949   1.366 -12.159
  747   2HZ   LYS 101          2HZ       LYS 101  -8.467   2.005 -13.598
  748   3HZ   LYS 101          3HZ       LYS 101  -8.327   2.888 -12.217
  749    H    LEU 102           HN       LEU 102 -10.271   4.069  -6.563
  750    HA   LEU 102           HA       LEU 102  -8.346   2.004  -6.656
  751   1HB   LEU 102          1HB       LEU 102  -8.140   4.026  -5.271
  752   2HB   LEU 102          2HB       LEU 102  -9.477   3.510  -4.247
  753    HG   LEU 102           HG       LEU 102  -8.237   1.614  -3.401
  754   1HD1  LEU 102          1HD21     LEU 102  -5.986   2.622  -5.195
  755   2HD1  LEU 102          3HD23     LEU 102  -5.792   1.434  -3.889
  756   3HD1  LEU 102          2HD22     LEU 102  -6.785   1.038  -5.293
  757   1HD2  LEU 102          2HD12     LEU 102  -6.804   4.305  -3.329
  758   2HD2  LEU 102          1HD11     LEU 102  -8.140   3.789  -2.280
  759   3HD2  LEU 102          3HD13     LEU 102  -6.562   2.999  -2.159
  760    H    LYS 103           HN       LYS 103 -11.408   2.182  -4.741
  761    HA   LYS 103           HA       LYS 103 -11.397  -0.381  -3.601
  762   1HB   LYS 103          2HB       LYS 103 -13.630   1.420  -4.613
  763   2HB   LYS 103          1HB       LYS 103 -13.932  -0.094  -3.749
  764   1HG   LYS 103          2HG       LYS 103 -12.973   0.697  -1.752
  765   2HG   LYS 103          1HG       LYS 103 -12.160   2.045  -2.549
  766   1HD   LYS 103          2HD       LYS 103 -14.071   2.763  -1.192
  767   2HD   LYS 103          1HD       LYS 103 -14.239   3.234  -2.880
  768   1HE   LYS 103          1HE       LYS 103 -15.562   0.712  -1.778
  769   2HE   LYS 103          2HE       LYS 103 -16.310   2.308  -1.624
  770   1HZ   LYS 103          2HZ       LYS 103 -16.257   2.537  -3.994
  771   2HZ   LYS 103          1HZ       LYS 103 -15.610   1.034  -4.166
  772   3HZ   LYS 103          3HZ       LYS 103 -17.116   1.211  -3.535
  773    H    ALA 104           HN       ALA 104 -12.820   0.676  -6.741
  774    HA   ALA 104           HA       ALA 104 -13.755  -1.818  -7.605
  775   1HB   ALA 104          3HB       ALA 104 -14.269   0.345  -8.699
  776   2HB   ALA 104          1HB       ALA 104 -12.608   0.433  -9.320
  777   3HB   ALA 104          2HB       ALA 104 -13.688  -0.864  -9.861
  778    H    LEU 105           HN       LEU 105 -10.474  -0.361  -8.211
  779    HA   LEU 105           HA       LEU 105  -9.543  -2.643  -9.680
  780   1HB   LEU 105          1HB       LEU 105  -8.024  -0.528  -8.084
  781   2HB   LEU 105          2HB       LEU 105  -7.253  -1.817  -9.010
  782    HG   LEU 105           HG       LEU 105  -8.870   0.500 -10.101
  783   1HD1  LEU 105          2HD12     LEU 105  -6.445   0.766  -9.538
  784   2HD1  LEU 105          3HD13     LEU 105  -6.056  -0.562 -10.642
  785   3HD1  LEU 105          1HD11     LEU 105  -6.757   0.934 -11.281
  786   1HD2  LEU 105          2HD22     LEU 105  -8.050  -2.085 -11.480
  787   2HD2  LEU 105          1HD21     LEU 105  -9.649  -1.302 -11.472
  788   3HD2  LEU 105          3HD23     LEU 105  -8.315  -0.582 -12.380
  789    H    VAL 106           HN       VAL 106  -9.245  -1.847  -6.162
  790    HA   VAL 106           HA       VAL 106  -7.685  -4.126  -5.514
  791    HB   VAL 106           HB       VAL 106  -9.815  -2.690  -3.864
  792   1HG1  VAL 106          1HG21     VAL 106  -7.661  -4.674  -2.981
  793   2HG1  VAL 106          3HG23     VAL 106  -8.729  -3.734  -1.914
  794   3HG1  VAL 106          2HG22     VAL 106  -9.404  -4.986  -2.957
  795   1HG2  VAL 106          2HG12     VAL 106  -7.793  -1.329  -4.554
  796   2HG2  VAL 106          1HG11     VAL 106  -7.895  -1.602  -2.807
  797   3HG2  VAL 106          3HG13     VAL 106  -6.771  -2.556  -3.799
  798    H    ALA 107           HN       ALA 107 -11.220  -3.744  -5.528
  799    HA   ALA 107           HA       ALA 107 -11.907  -6.424  -4.915
  800   1HB   ALA 107          3HB       ALA 107 -13.539  -4.564  -4.981
  801   2HB   ALA 107          1HB       ALA 107 -13.391  -4.476  -6.747
  802   3HB   ALA 107          2HB       ALA 107 -14.074  -5.926  -5.984
  803    H    LYS 108           HN       LYS 108 -11.583  -4.968  -8.183
  804    HA   LYS 108           HA       LYS 108 -12.043  -7.212  -9.760
  805   1HB   LYS 108          2HB       LYS 108 -11.819  -4.931 -10.595
  806   2HB   LYS 108          1HB       LYS 108 -10.110  -4.886 -10.144
  807   1HG   LYS 108          2HG       LYS 108  -9.691  -6.774 -11.795
  808   2HG   LYS 108          1HG       LYS 108 -11.366  -6.578 -12.334
  809   1HD   LYS 108          2HD       LYS 108  -9.142  -4.474 -12.373
  810   2HD   LYS 108          1HD       LYS 108  -9.730  -5.393 -13.764
  811   1HE   LYS 108          1HE       LYS 108 -11.986  -4.334 -13.478
  812   2HE   LYS 108          2HE       LYS 108 -11.331  -3.348 -12.153
  813   1HZ   LYS 108          3HZ       LYS 108  -9.761  -2.425 -13.687
  814   2HZ   LYS 108          1HZ       LYS 108 -10.375  -3.323 -14.923
  815   3HZ   LYS 108          2HZ       LYS 108 -11.305  -2.170 -14.203
  816    H    HIS 109           HN       HIS 109  -8.834  -6.046  -8.612
  817    HA   HIS 109           HA       HIS 109  -7.479  -8.360  -9.742
  818   1HB   HIS 109          1HB       HIS 109  -6.579  -6.041  -7.994
  819   2HB   HIS 109          2HB       HIS 109  -5.512  -7.324  -8.575
  820    HD2  HIS 109           HD2      HIS 109  -7.496  -4.284 -10.115
  821    HE1  HIS 109           HE1      HIS 109  -4.909  -5.886 -13.032
  822    HE2  HIS 109           HE2      HIS 109  -6.487  -3.953 -12.503
  823    H    ALA 110           HN       ALA 110  -8.879  -7.667  -6.558
  824    HA   ALA 110           HA       ALA 110  -7.435  -9.779  -5.181
  825   1HB   ALA 110          1HB       ALA 110 -10.070  -8.396  -4.543
  826   2HB   ALA 110          2HB       ALA 110  -9.154  -9.461  -3.453
  827   3HB   ALA 110          3HB       ALA 110  -8.460  -7.910  -3.962
  828    H    ALA 111           HN       ALA 111 -10.686  -9.502  -6.717
  829    HA   ALA 111           HA       ALA 111 -11.253 -12.357  -6.258
  830   1HB   ALA 111          2HB       ALA 111 -13.032 -10.642  -6.125
  831   2HB   ALA 111          3HB       ALA 111 -12.742 -10.205  -7.823
  832   3HB   ALA 111          1HB       ALA 111 -13.357 -11.822  -7.412
  833    H    ALA 112           HN       ALA 112  -8.924 -12.554  -7.480
  834    HA   ALA 112           HA       ALA 112  -9.370 -13.761  -9.998
  835   1HB   ALA 112          1HB       ALA 112  -7.979 -11.038 -10.005
  836   2HB   ALA 112          3HB       ALA 112  -7.964 -12.191 -11.359
  837   3HB   ALA 112          2HB       ALA 112  -9.483 -11.434 -10.858
   
  No H/Q in entry =         837
  Start of MODEL    2
    1   1H    GLY   1          2HN       GLY   1   0.351 -11.667   0.461
    2   2H    GLY   1          1HN       GLY   1   0.645 -13.272   0.153
    3   3H    GLY   1          3HN       GLY   1  -0.843 -12.554  -0.168
    4   1HA   GLY   1          1HA       GLY   1  -1.245 -13.597   1.874
    5   2HA   GLY   1          2HA       GLY   1   0.328 -13.040   2.489
    6    H    GLY   2           HN       GLY   2  -2.342 -12.387   3.617
    7   1HA   GLY   2          1HA       GLY   2  -3.193  -9.782   3.052
    8   2HA   GLY   2          2HA       GLY   2  -3.454 -10.676   4.550
    9    H    SER   3           HN       SER   3  -0.474  -9.291   3.076
   10    HA   SER   3           HA       SER   3   0.440  -8.353   5.661
   11   1HB   SER   3          1HB       SER   3   1.574  -7.939   2.884
   12   2HB   SER   3          2HB       SER   3   2.410  -7.770   4.437
   13    HG   SER   3           HG       SER   3   2.822  -9.787   3.461
   14    H    VAL   4           HN       VAL   4  -1.274  -6.913   6.154
   15    HA   VAL   4           HA       VAL   4  -1.631  -4.429   4.624
   16    HB   VAL   4           HB       VAL   4  -2.642  -5.361   7.351
   17   1HG1  VAL   4          2HG22     VAL   4  -3.185  -2.847   5.745
   18   2HG1  VAL   4          1HG21     VAL   4  -4.332  -3.467   6.958
   19   3HG1  VAL   4          3HG23     VAL   4  -2.700  -2.993   7.435
   20   1HG2  VAL   4          2HG12     VAL   4  -3.947  -5.353   4.600
   21   2HG2  VAL   4          1HG11     VAL   4  -3.565  -6.753   5.604
   22   3HG2  VAL   4          3HG13     VAL   4  -4.808  -5.623   6.130
   23    H    ILE   5           HN       ILE   5   0.395  -3.282   4.581
   24    HA   ILE   5           HA       ILE   5   1.309  -2.386   7.277
   25    HB   ILE   5           HB       ILE   5   3.641  -2.822   6.714
   26   1HG1  ILE   5          1HG11     ILE   5   2.737  -4.436   4.292
   27   2HG1  ILE   5          2HG12     ILE   5   3.270  -2.755   4.163
   28   1HG2  ILE   5          2HG22     ILE   5   2.297  -4.540   7.947
   29   2HG2  ILE   5          1HG21     ILE   5   2.060  -5.410   6.415
   30   3HG2  ILE   5          3HG23     ILE   5   3.685  -5.203   7.087
   31   1HD1  ILE   5          1HD11     ILE   5   5.425  -3.322   5.243
   32   2HD1  ILE   5          2HD12     ILE   5   4.958  -5.033   5.233
   33   3HD1  ILE   5          3HD13     ILE   5   5.164  -4.155   3.705
   34    H    VAL   6           HN       VAL   6   3.058  -0.789   7.100
   35    HA   VAL   6           HA       VAL   6   2.773   1.069   4.852
   36    HB   VAL   6           HB       VAL   6   1.568   2.088   6.701
   37   1HG1  VAL   6          3HG13     VAL   6   2.437   0.784   8.606
   38   2HG1  VAL   6          1HG11     VAL   6   4.009   1.601   8.463
   39   3HG1  VAL   6          2HG12     VAL   6   2.561   2.522   8.898
   40   1HG2  VAL   6          2HG22     VAL   6   3.136   3.529   5.369
   41   2HG2  VAL   6          1HG21     VAL   6   2.823   4.133   7.006
   42   3HG2  VAL   6          3HG23     VAL   6   4.356   3.322   6.639
   43    H    ILE   7           HN       ILE   7   4.865   1.737   4.085
   44    HA   ILE   7           HA       ILE   7   7.159   0.977   5.734
   45    HB   ILE   7           HB       ILE   7   6.213  -1.105   4.404
   46   1HG1  ILE   7          1HG11     ILE   7   8.510  -1.892   3.844
   47   2HG1  ILE   7          2HG12     ILE   7   9.143  -0.318   4.346
   48   1HG2  ILE   7          2HG22     ILE   7   5.935   0.088   2.260
   49   2HG2  ILE   7          3HG23     ILE   7   7.706   0.260   2.123
   50   3HG2  ILE   7          1HG21     ILE   7   6.961  -1.345   2.123
   51   1HD1  ILE   7          2HD12     ILE   7   8.096  -0.727   6.638
   52   2HD1  ILE   7          1HD11     ILE   7   7.551  -2.306   6.047
   53   3HD1  ILE   7          3HD13     ILE   7   9.278  -1.951   6.200
   54    H    ASP   8           HN       ASP   8   9.142   1.771   5.089
   55    HA   ASP   8           HA       ASP   8   9.094   3.964   3.071
   56   1HB   ASP   8          2HB       ASP   8  10.263   5.295   4.727
   57   2HB   ASP   8          1HB       ASP   8   8.785   4.681   5.469
   58    H    SER   9           HN       SER   9  10.275   1.084   2.908
   59    HA   SER   9           HA       SER   9  12.953   1.977   2.061
   60   1HB   SER   9          2HB       SER   9  13.408   1.382   4.353
   61   2HB   SER   9          1HB       SER   9  12.540  -0.163   4.180
   62    HG   SER   9           HG       SER   9  14.920  -0.201   3.953
   63    H    LYS  10           HN       LYS  10  13.786   0.823   0.485
   64    HA   LYS  10           HA       LYS  10  12.130  -0.855  -1.145
   65   1HB   LYS  10          2HB       LYS  10  14.002   0.823  -1.701
   66   2HB   LYS  10          1HB       LYS  10  15.093  -0.482  -1.299
   67   1HG   LYS  10          2HG       LYS  10  12.884  -0.930  -3.334
   68   2HG   LYS  10          1HG       LYS  10  14.332  -0.030  -3.808
   69   1HD   LYS  10          1HD       LYS  10  15.774  -1.927  -3.149
   70   2HD   LYS  10          2HD       LYS  10  14.352  -2.884  -2.727
   71   1HE   LYS  10          2HE       LYS  10  14.927  -1.766  -5.502
   72   2HE   LYS  10          1HE       LYS  10  15.228  -3.430  -4.965
   73   1HZ   LYS  10          3HZ       LYS  10  12.919  -3.699  -4.557
   74   2HZ   LYS  10          2HZ       LYS  10  12.588  -2.153  -5.038
   75   3HZ   LYS  10          1HZ       LYS  10  13.169  -3.251  -6.122
   76    H    ALA  11           HN       ALA  11  14.797  -1.292   1.132
   77    HA   ALA  11           HA       ALA  11  15.381  -4.066   0.628
   78   1HB   ALA  11          2HB       ALA  11  16.803  -2.648   2.074
   79   2HB   ALA  11          3HB       ALA  11  15.501  -2.546   3.281
   80   3HB   ALA  11          1HB       ALA  11  16.270  -4.108   2.931
   81    H    ALA  12           HN       ALA  12  13.122  -2.459   2.861
   82    HA   ALA  12           HA       ALA  12  11.852  -4.862   3.805
   83   1HB   ALA  12          1HB       ALA  12  11.792  -2.757   5.061
   84   2HB   ALA  12          2HB       ALA  12  10.854  -1.992   3.759
   85   3HB   ALA  12          3HB       ALA  12  10.165  -3.356   4.682
   86    H    TRP  13           HN       TRP  13  11.090  -2.536   1.151
   87    HA   TRP  13           HA       TRP  13   8.682  -3.532   0.214
   88   1HB   TRP  13          1HB       TRP  13  10.066  -1.585  -0.773
   89   2HB   TRP  13          2HB       TRP  13  11.065  -2.788  -1.514
   90    HD1  TRP  13           HD1      TRP  13  10.266  -4.372  -3.377
   91    HE1  TRP  13           HE1      TRP  13   8.769  -3.848  -5.391
   92    HE3  TRP  13           HE3      TRP  13   7.904  -0.173  -1.597
   93    HZ2  TRP  13           HZ2      TRP  13   6.960  -1.844  -6.188
   94    HZ3  TRP  13           HZ3      TRP  13   6.451   1.134  -3.156
   95    HH2  TRP  13           HH2      TRP  13   5.877   0.234  -5.371
   96    H    ASP  14           HN       ASP  14  11.952  -4.646  -0.806
   97    HA   ASP  14           HA       ASP  14  11.092  -6.855  -2.352
   98   1HB   ASP  14          2HB       ASP  14  13.715  -6.480  -0.849
   99   2HB   ASP  14          1HB       ASP  14  13.378  -7.704  -2.090
  100    H    ALA  15           HN       ALA  15  12.161  -6.706   1.042
  101    HA   ALA  15           HA       ALA  15  11.948  -9.439   1.655
  102   1HB   ALA  15          2HB       ALA  15  12.914  -7.681   3.155
  103   2HB   ALA  15          3HB       ALA  15  11.264  -7.126   3.520
  104   3HB   ALA  15          1HB       ALA  15  11.777  -8.757   3.985
  105    H    GLN  16           HN       GLN  16   9.406  -6.931   1.803
  106    HA   GLN  16           HA       GLN  16   7.370  -8.681   2.752
  107   1HB   GLN  16          1HB       GLN  16   7.199  -6.242   2.948
  108   2HB   GLN  16          2HB       GLN  16   7.097  -6.080   1.187
  109   1HG   GLN  16          1HG       GLN  16   4.853  -6.011   2.334
  110   2HG   GLN  16          2HG       GLN  16   4.984  -7.287   1.125
  111   1HE2  GLN  16          2HE22     GLN  16   4.956  -8.349   5.134
  112   2HE2  GLN  16          1HE21     GLN  16   5.730  -6.848   4.654
  113    H    LEU  17           HN       LEU  17   8.223  -7.510  -0.541
  114    HA   LEU  17           HA       LEU  17   6.328  -8.834  -2.091
  115   1HB   LEU  17          1HB       LEU  17   9.069  -7.769  -2.463
  116   2HB   LEU  17          2HB       LEU  17   8.754  -9.139  -3.505
  117    HG   LEU  17           HG       LEU  17   6.683  -8.008  -4.306
  118   1HD1  LEU  17          3HD13     LEU  17   6.306  -6.478  -2.340
  119   2HD1  LEU  17          2HD12     LEU  17   7.763  -5.585  -2.795
  120   3HD1  LEU  17          1HD11     LEU  17   6.366  -5.601  -3.879
  121   1HD2  LEU  17          2HD22     LEU  17   9.279  -6.453  -4.638
  122   2HD2  LEU  17          3HD23     LEU  17   8.769  -7.872  -5.578
  123   3HD2  LEU  17          1HD21     LEU  17   7.866  -6.353  -5.715
  124    H    ALA  18           HN       ALA  18   9.413 -10.172  -0.876
  125    HA   ALA  18           HA       ALA  18   9.049 -12.772  -1.975
  126   1HB   ALA  18          1HB       ALA  18  11.201 -11.907  -1.189
  127   2HB   ALA  18          3HB       ALA  18  10.619 -11.888   0.487
  128   3HB   ALA  18          2HB       ALA  18  10.797 -13.432  -0.372
  129    H    LYS  19           HN       LYS  19   8.597 -11.822   1.523
  130    HA   LYS  19           HA       LYS  19   7.480 -14.373   2.163
  131   1HB   LYS  19          1HB       LYS  19   6.883 -13.446   4.295
  132   2HB   LYS  19          2HB       LYS  19   8.490 -12.884   3.811
  133   1HG   LYS  19          2HG       LYS  19   7.503 -10.731   3.142
  134   2HG   LYS  19          1HG       LYS  19   5.889 -11.280   3.574
  135   1HD   LYS  19          1HD       LYS  19   6.761  -9.872   5.348
  136   2HD   LYS  19          2HD       LYS  19   6.512 -11.523   5.922
  137   1HE   LYS  19          2HE       LYS  19   8.608 -10.537   6.787
  138   2HE   LYS  19          1HE       LYS  19   8.934 -11.969   5.810
  139   1HZ   LYS  19          1HZ       LYS  19   9.167  -9.175   4.920
  140   2HZ   LYS  19          3HZ       LYS  19  10.415 -10.190   5.285
  141   3HZ   LYS  19          2HZ       LYS  19   9.461 -10.493   3.974
  142    H    GLY  20           HN       GLY  20   5.935 -11.531   0.783
  143   1HA   GLY  20          1HA       GLY  20   3.243 -12.089   1.415
  144   2HA   GLY  20          2HA       GLY  20   3.847 -11.189   0.011
  145    H    LYS  21           HN       LYS  21   5.443 -13.746  -0.774
  146    HA   LYS  21           HA       LYS  21   5.226 -15.436  -2.247
  147   1HB   LYS  21          1HB       LYS  21   2.451 -15.970  -1.105
  148   2HB   LYS  21          2HB       LYS  21   3.501 -17.086  -1.975
  149   1HG   LYS  21          2HG       LYS  21   3.993 -15.881   0.763
  150   2HG   LYS  21          1HG       LYS  21   3.505 -17.545   0.425
  151   1HD   LYS  21          2HD       LYS  21   5.673 -17.904  -0.789
  152   2HD   LYS  21          1HD       LYS  21   6.167 -16.253  -0.348
  153   1HE   LYS  21          1HE       LYS  21   5.922 -16.811   2.057
  154   2HE   LYS  21          2HE       LYS  21   5.507 -18.480   1.621
  155   1HZ   LYS  21          3HZ       LYS  21   8.034 -17.120   0.994
  156   2HZ   LYS  21          1HZ       LYS  21   7.808 -18.247   2.176
  157   3HZ   LYS  21          2HZ       LYS  21   7.654 -18.673   0.591
  158    H    GLU  22           HN       GLU  22   5.151 -13.384  -3.486
  159    HA   GLU  22           HA       GLU  22   2.723 -12.640  -4.875
  160   1HB   GLU  22          1HB       GLU  22   4.687 -11.113  -4.327
  161   2HB   GLU  22          2HB       GLU  22   5.590 -11.931  -5.615
  162   1HG   GLU  22          2HG       GLU  22   3.755 -11.316  -7.221
  163   2HG   GLU  22          1HG       GLU  22   2.924 -10.451  -5.928
  164    H    GLU  23           HN       GLU  23   2.581 -15.151  -5.295
  165    HA   GLU  23           HA       GLU  23   3.895 -16.140  -7.696
  166   1HB   GLU  23          2HB       GLU  23   1.155 -16.925  -6.589
  167   2HB   GLU  23          1HB       GLU  23   2.117 -17.812  -7.771
  168   1HG   GLU  23          2HG       GLU  23   3.915 -18.123  -6.076
  169   2HG   GLU  23          1HG       GLU  23   2.932 -17.277  -4.871
  170    H    HIS  24           HN       HIS  24   0.608 -14.884  -7.095
  171    HA   HIS  24           HA       HIS  24   0.722 -13.073  -9.382
  172   1HB   HIS  24          2HB       HIS  24  -1.226 -13.972 -10.449
  173   2HB   HIS  24          1HB       HIS  24  -0.173 -15.365 -10.190
  174    HD2  HIS  24           HD2      HIS  24  -3.723 -14.260  -9.570
  175    HE1  HIS  24           HE1      HIS  24  -3.061 -17.282  -6.699
  176    HE2  HIS  24           HE2      HIS  24  -4.840 -15.795  -7.777
  177    H    LYS  25           HN       LYS  25   0.617 -12.985  -6.408
  178    HA   LYS  25           HA       LYS  25  -2.166 -12.377  -5.699
  179   1HB   LYS  25          2HB       LYS  25   0.332 -12.092  -3.995
  180   2HB   LYS  25          1HB       LYS  25  -1.342 -12.102  -3.433
  181   1HG   LYS  25          2HG       LYS  25   0.184 -14.432  -4.675
  182   2HG   LYS  25          1HG       LYS  25  -0.265 -14.247  -2.984
  183   1HD   LYS  25          1HD       LYS  25  -2.697 -14.276  -3.662
  184   2HD   LYS  25          2HD       LYS  25  -2.200 -14.612  -5.329
  185   1HE   LYS  25          2HE       LYS  25  -1.602 -16.380  -2.915
  186   2HE   LYS  25          1HE       LYS  25  -2.832 -16.676  -4.154
  187   1HZ   LYS  25          2HZ       LYS  25  -1.061 -16.766  -5.782
  188   2HZ   LYS  25          1HZ       LYS  25   0.065 -16.564  -4.593
  189   3HZ   LYS  25          3HZ       LYS  25  -0.867 -17.912  -4.611
  190    HA   PRO  26           HA       PRO  26  -1.580  -8.138  -6.811
  191   1HB   PRO  26          1HB       PRO  26  -3.669  -6.909  -5.524
  192   2HB   PRO  26          2HB       PRO  26  -3.867  -7.968  -6.950
  193   1HG   PRO  26          1HG       PRO  26  -4.072  -8.793  -4.058
  194   2HG   PRO  26          2HG       PRO  26  -5.333  -9.000  -5.291
  195   1HD   PRO  26          2HD       PRO  26  -3.556 -10.960  -4.636
  196   2HD   PRO  26          1HD       PRO  26  -3.868 -10.694  -6.378
  197    H    ILE  27           HN       ILE  27   0.112  -7.059  -6.105
  198    HA   ILE  27           HA       ILE  27   0.315  -6.268  -3.251
  199    HB   ILE  27           HB       ILE  27   2.316  -5.916  -5.510
  200   1HG1  ILE  27          1HG11     ILE  27   1.949  -8.124  -3.480
  201   2HG1  ILE  27          2HG12     ILE  27   2.237  -8.230  -5.211
  202   1HG2  ILE  27          2HG22     ILE  27   2.403  -4.240  -3.640
  203   2HG2  ILE  27          3HG23     ILE  27   2.613  -5.578  -2.499
  204   3HG2  ILE  27          1HG21     ILE  27   3.843  -5.234  -3.736
  205   1HD1  ILE  27          2HD12     ILE  27   4.547  -7.325  -4.808
  206   2HD1  ILE  27          1HD11     ILE  27   4.225  -7.408  -3.051
  207   3HD1  ILE  27          3HD13     ILE  27   4.233  -8.885  -4.005
  208    H    VAL  28           HN       VAL  28  -1.006  -4.595  -2.923
  209    HA   VAL  28           HA       VAL  28  -1.416  -2.594  -5.096
  210    HB   VAL  28           HB       VAL  28  -2.960  -2.889  -2.496
  211   1HG1  VAL  28          1HG11     VAL  28  -3.042  -0.688  -3.754
  212   2HG1  VAL  28          3HG13     VAL  28  -3.653  -1.564  -5.165
  213   3HG1  VAL  28          2HG12     VAL  28  -4.610  -1.514  -3.671
  214   1HG2  VAL  28          1HG21     VAL  28  -3.620  -4.077  -5.226
  215   2HG2  VAL  28          3HG23     VAL  28  -3.255  -4.989  -3.744
  216   3HG2  VAL  28          2HG22     VAL  28  -4.716  -4.009  -3.830
  217    H    VAL  29           HN       VAL  29  -0.084  -0.837  -4.920
  218    HA   VAL  29           HA       VAL  29   0.920  -0.151  -2.186
  219    HB   VAL  29           HB       VAL  29   2.743  -0.910  -3.506
  220   1HG1  VAL  29          2HG12     VAL  29   1.989   1.179  -5.559
  221   2HG1  VAL  29          3HG13     VAL  29   3.465   0.195  -5.556
  222   3HG1  VAL  29          1HG11     VAL  29   1.898  -0.592  -5.782
  223   1HG2  VAL  29          2HG22     VAL  29   3.080   1.031  -2.006
  224   2HG2  VAL  29          1HG21     VAL  29   4.172   1.066  -3.398
  225   3HG2  VAL  29          3HG23     VAL  29   2.775   2.144  -3.353
  226    H    ASP  30           HN       ASP  30   0.433   1.704  -1.375
  227    HA   ASP  30           HA       ASP  30  -1.065   3.739  -2.985
  228   1HB   ASP  30          1HB       ASP  30  -2.305   2.910  -1.088
  229   2HB   ASP  30          2HB       ASP  30  -0.940   3.148  -0.007
  230    H    PHE  31           HN       PHE  31   0.581   4.886  -3.887
  231    HA   PHE  31           HA       PHE  31   2.940   5.765  -2.325
  232   1HB   PHE  31          2HB       PHE  31   2.075   6.070  -5.221
  233   2HB   PHE  31          1HB       PHE  31   3.474   6.840  -4.553
  234    HD1  PHE  31           HD1      PHE  31   5.295   5.304  -3.429
  235    HD2  PHE  31           HD2      PHE  31   2.256   3.845  -6.113
  236    HE1  PHE  31           HE1      PHE  31   6.931   3.725  -4.419
  237    HE2  PHE  31           HE2      PHE  31   3.901   2.267  -7.098
  238    HZ   PHE  31           HZ       PHE  31   6.255   2.273  -6.321
  239    H    THR  32           HN       THR  32   2.050   7.214  -0.830
  240    HA   THR  32           HA       THR  32   0.868   9.762  -1.906
  241    HB   THR  32           HB       THR  32  -0.108   8.156   0.462
  242    HG1  THR  32           HG1      THR  32  -1.208   7.555  -1.315
  243   1HG2  THR  32          3HG23     THR  32  -0.710  11.030  -0.378
  244   2HG2  THR  32          1HG21     THR  32  -1.696  10.088   0.759
  245   3HG2  THR  32          2HG22     THR  32  -0.026  10.502   1.175
  246    H    ALA  33           HN       ALA  33   2.410  11.304  -1.406
  247    HA   ALA  33           HA       ALA  33   4.617  10.726   0.277
  248   1HB   ALA  33          1HB       ALA  33   4.623  12.426  -1.596
  249   2HB   ALA  33          3HB       ALA  33   3.659  13.492  -0.567
  250   3HB   ALA  33          2HB       ALA  33   5.284  13.004  -0.060
  251    H    THR  34           HN       THR  34   5.120  11.299   2.407
  252    HA   THR  34           HA       THR  34   3.142  11.487   4.384
  253    HB   THR  34           HB       THR  34   5.255  12.661   5.601
  254    HG1  THR  34           HG1      THR  34   6.917  11.354   3.959
  255   1HG2  THR  34          2HG22     THR  34   5.094   9.784   4.637
  256   2HG2  THR  34          1HG21     THR  34   6.250  10.373   5.861
  257   3HG2  THR  34          3HG23     THR  34   4.504  10.457   6.165
  258    H    TRP  35           HN       TRP  35   5.073  14.059   2.900
  259    HA   TRP  35           HA       TRP  35   3.863  16.220   4.342
  260   1HB   TRP  35          2HB       TRP  35   5.034  17.597   2.565
  261   2HB   TRP  35          1HB       TRP  35   6.020  16.529   3.548
  262    HD1  TRP  35           HD1      TRP  35   7.542  14.840   2.374
  263    HE1  TRP  35           HE1      TRP  35   8.199  14.427  -0.058
  264    HE3  TRP  35           HE3      TRP  35   3.647  17.258   0.047
  265    HZ2  TRP  35           HZ2      TRP  35   7.086  14.897  -2.673
  266    HZ3  TRP  35           HZ3      TRP  35   3.435  17.165  -2.414
  267    HH2  TRP  35           HH2      TRP  35   5.164  16.028  -3.784
  268    H    CYS  36           HN       CYS  36   2.351  14.339   1.928
  269    HA   CYS  36           HA       CYS  36   0.897  16.564   0.654
  270   1HB   CYS  36          2HB       CYS  36   1.616  14.311  -0.349
  271   2HB   CYS  36          1HB       CYS  36   0.259  13.604   0.501
  272    H    GLY  37           HN       GLY  37   0.569  17.238   2.998
  273   1HA   GLY  37          1HA       GLY  37  -0.577  16.418   5.137
  274   2HA   GLY  37          2HA       GLY  37  -1.161  17.922   4.416
  275    HA   PRO  38           HA       PRO  38  -5.231  16.305   4.397
  276   1HB   PRO  38          1HB       PRO  38  -6.361  17.110   2.020
  277   2HB   PRO  38          2HB       PRO  38  -5.965  18.227   3.356
  278   1HG   PRO  38          2HG       PRO  38  -4.299  17.634   0.895
  279   2HG   PRO  38          1HG       PRO  38  -4.729  19.232   1.570
  280   1HD   PRO  38          2HD       PRO  38  -2.334  18.071   2.106
  281   2HD   PRO  38          1HD       PRO  38  -3.206  18.968   3.383
  282    H    CYS  39           HN       CYS  39  -3.302  15.584   1.546
  283    HA   CYS  39           HA       CYS  39  -4.908  13.532   0.383
  284   1HB   CYS  39          2HB       CYS  39  -1.956  13.224   0.247
  285   2HB   CYS  39          1HB       CYS  39  -3.154  13.119  -1.024
  286    H    LYS  40           HN       LYS  40  -2.415  13.568   2.931
  287    HA   LYS  40           HA       LYS  40  -2.015  10.847   3.278
  288   1HB   LYS  40          2HB       LYS  40  -0.883  12.877   4.398
  289   2HB   LYS  40          1HB       LYS  40  -2.186  12.801   5.602
  290   1HG   LYS  40          2HG       LYS  40  -1.531  10.461   6.128
  291   2HG   LYS  40          1HG       LYS  40  -0.263  10.539   4.884
  292   1HD   LYS  40          1HD       LYS  40   0.781  12.461   6.106
  293   2HD   LYS  40          2HD       LYS  40  -0.422  12.281   7.390
  294   1HE   LYS  40          1HE       LYS  40   1.614  10.166   6.517
  295   2HE   LYS  40          2HE       LYS  40   1.730  11.184   7.962
  296   1HZ   LYS  40          2HZ       LYS  40  -0.288  10.174   8.760
  297   2HZ   LYS  40          3HZ       LYS  40  -0.371   9.201   7.432
  298   3HZ   LYS  40          1HZ       LYS  40   0.878   9.041   8.492
  299    H    MET  41           HN       MET  41  -4.941  12.645   4.093
  300    HA   MET  41           HA       MET  41  -6.007  10.801   6.051
  301   1HB   MET  41          1HB       MET  41  -7.434  12.689   4.112
  302   2HB   MET  41          2HB       MET  41  -8.145  11.902   5.529
  303   1HG   MET  41          1HG       MET  41  -6.468  12.998   6.973
  304   2HG   MET  41          2HG       MET  41  -5.845  13.904   5.598
  305   1HE   MET  41          1HE       MET  41  -6.070  16.118   6.953
  306   2HE   MET  41          3HE       MET  41  -7.587  16.665   7.706
  307   3HE   MET  41          2HE       MET  41  -6.756  15.223   8.335
  308    H    ILE  42           HN       ILE  42  -5.522  10.514   2.654
  309    HA   ILE  42           HA       ILE  42  -7.587   8.535   2.158
  310    HB   ILE  42           HB       ILE  42  -5.014   9.298   0.715
  311   1HG1  ILE  42          2HG12     ILE  42  -7.916   9.792  -0.106
  312   2HG1  ILE  42          1HG11     ILE  42  -7.071  10.933   0.944
  313   1HG2  ILE  42          1HG21     ILE  42  -7.187   7.349  -0.054
  314   2HG2  ILE  42          2HG22     ILE  42  -6.034   8.045  -1.216
  315   3HG2  ILE  42          3HG23     ILE  42  -5.447   7.044   0.116
  316   1HD1  ILE  42          1HD11     ILE  42  -5.274  11.186  -0.745
  317   2HD1  ILE  42          3HD13     ILE  42  -6.240  10.201  -1.868
  318   3HD1  ILE  42          2HD12     ILE  42  -6.869  11.750  -1.256
  319    H    ALA  43           HN       ALA  43  -4.376   8.492   3.632
  320    HA   ALA  43           HA       ALA  43  -3.685   5.818   3.124
  321   1HB   ALA  43          2HB       ALA  43  -2.158   7.507   4.093
  322   2HB   ALA  43          3HB       ALA  43  -3.033   7.462   5.626
  323   3HB   ALA  43          1HB       ALA  43  -2.194   6.014   5.052
  324    HA   PRO  44           HA       PRO  44  -5.934   4.431   7.172
  325   1HB   PRO  44          2HB       PRO  44  -8.102   5.937   8.044
  326   2HB   PRO  44          1HB       PRO  44  -6.450   5.998   8.721
  327   1HG   PRO  44          2HG       PRO  44  -7.659   7.787   6.620
  328   2HG   PRO  44          1HG       PRO  44  -6.745   8.286   8.069
  329   1HD   PRO  44          2HD       PRO  44  -5.450   8.171   5.744
  330   2HD   PRO  44          1HD       PRO  44  -4.692   7.428   7.170
  331    H    LEU  45           HN       LEU  45  -7.815   6.271   4.758
  332    HA   LEU  45           HA       LEU  45 -10.041   4.472   4.577
  333   1HB   LEU  45          2HB       LEU  45  -8.690   6.216   2.462
  334   2HB   LEU  45          1HB       LEU  45 -10.105   5.265   2.146
  335    HG   LEU  45           HG       LEU  45  -9.802   7.556   4.161
  336   1HD1  LEU  45          1HD11     LEU  45  -9.877   8.219   1.757
  337   2HD1  LEU  45          3HD13     LEU  45 -11.420   7.363   1.581
  338   3HD1  LEU  45          2HD12     LEU  45 -11.301   8.778   2.647
  339   1HD2  LEU  45          3HD23     LEU  45 -12.254   5.853   3.520
  340   2HD2  LEU  45          1HD21     LEU  45 -11.472   6.055   5.107
  341   3HD2  LEU  45          2HD22     LEU  45 -12.320   7.412   4.367
  342    H    PHE  46           HN       PHE  46  -7.066   4.604   2.610
  343    HA   PHE  46           HA       PHE  46  -7.488   2.168   1.170
  344   1HB   PHE  46          2HB       PHE  46  -5.923   3.708   0.349
  345   2HB   PHE  46          1HB       PHE  46  -5.154   3.900   1.898
  346    HD1  PHE  46           HD2      PHE  46  -5.653   1.534  -0.955
  347    HD2  PHE  46           HD1      PHE  46  -3.263   2.471   2.501
  348    HE1  PHE  46           HE2      PHE  46  -3.923  -0.059  -1.721
  349    HE2  PHE  46           HE1      PHE  46  -1.557   0.815   1.764
  350    HZ   PHE  46           HZ       PHE  46  -1.833  -0.358  -0.418
  351    H    GLU  47           HN       GLU  47  -5.873   2.759   4.362
  352    HA   GLU  47           HA       GLU  47  -5.067   0.074   4.789
  353   1HB   GLU  47          1HB       GLU  47  -5.742   2.321   6.690
  354   2HB   GLU  47          2HB       GLU  47  -5.091   0.772   7.204
  355   1HG   GLU  47          1HG       GLU  47  -3.047   1.061   6.002
  356   2HG   GLU  47          2HG       GLU  47  -3.656   2.450   5.107
  357    H    THR  48           HN       THR  48  -8.212   1.730   5.327
  358    HA   THR  48           HA       THR  48  -9.409  -0.400   6.826
  359    HB   THR  48           HB       THR  48 -10.820   1.547   4.944
  360    HG1  THR  48           HG1      THR  48  -9.471   2.556   6.577
  361   1HG2  THR  48          2HG22     THR  48 -11.771   0.014   7.397
  362   2HG2  THR  48          3HG23     THR  48 -12.708   1.217   6.491
  363   3HG2  THR  48          1HG21     THR  48 -12.254  -0.311   5.716
  364    H    LEU  49           HN       LEU  49  -9.287   0.304   3.271
  365    HA   LEU  49           HA       LEU  49 -10.652  -2.114   2.504
  366   1HB   LEU  49          2HB       LEU  49  -8.641  -0.327   1.064
  367   2HB   LEU  49          1HB       LEU  49  -9.187  -1.843   0.369
  368    HG   LEU  49           HG       LEU  49 -10.418  -0.117  -0.597
  369   1HD1  LEU  49          2HD12     LEU  49 -11.578  -2.306   0.028
  370   2HD1  LEU  49          3HD13     LEU  49 -12.379  -1.415   1.338
  371   3HD1  LEU  49          1HD11     LEU  49 -12.640  -0.943  -0.342
  372   1HD2  LEU  49          1HD21     LEU  49 -10.211   1.592   1.156
  373   2HD2  LEU  49          3HD23     LEU  49 -11.875   1.426   0.579
  374   3HD2  LEU  49          2HD22     LEU  49 -11.419   0.732   2.147
  375    H    SER  50           HN       SER  50  -7.251  -1.352   3.123
  376    HA   SER  50           HA       SER  50  -6.132  -3.766   2.369
  377   1HB   SER  50          1HB       SER  50  -5.204  -2.188   4.778
  378   2HB   SER  50          2HB       SER  50  -4.281  -3.311   3.794
  379    HG   SER  50           HG       SER  50  -5.437  -0.982   2.669
  380    H    ASN  51           HN       ASN  51  -7.399  -2.903   5.578
  381    HA   ASN  51           HA       ASN  51  -7.146  -5.469   6.799
  382   1HB   ASN  51          1HB       ASN  51  -7.533  -3.469   8.103
  383   2HB   ASN  51          2HB       ASN  51  -9.063  -3.145   7.282
  384   1HD2  ASN  51          2HD22     ASN  51 -10.934  -5.496   9.193
  385   2HD2  ASN  51          1HD21     ASN  51 -10.937  -4.490   7.755
  386    H    ASP  52           HN       ASP  52  -9.855  -3.958   4.982
  387    HA   ASP  52           HA       ASP  52 -11.799  -5.904   5.339
  388   1HB   ASP  52          1HB       ASP  52 -12.122  -3.693   4.154
  389   2HB   ASP  52          2HB       ASP  52 -11.256  -4.354   2.757
  390    H    TYR  53           HN       TYR  53  -9.422  -5.795   2.643
  391    HA   TYR  53           HA       TYR  53 -10.334  -8.407   1.656
  392   1HB   TYR  53          1HB       TYR  53  -8.132  -6.479   0.978
  393   2HB   TYR  53          2HB       TYR  53  -8.171  -8.077   0.254
  394    HD1  TYR  53           HD2      TYR  53  -9.783  -4.759   0.337
  395    HD2  TYR  53           HD1      TYR  53  -9.780  -8.681  -1.451
  396    HE1  TYR  53           HE2      TYR  53 -11.060  -3.893  -1.588
  397    HE2  TYR  53           HE1      TYR  53 -11.128  -7.827  -3.326
  398    HH   TYR  53           HH       TYR  53 -12.512  -6.051  -4.017
  399    H    ALA  54           HN       ALA  54  -7.360  -7.140   3.208
  400    HA   ALA  54           HA       ALA  54  -5.358  -8.261   3.626
  401   1HB   ALA  54          2HB       ALA  54  -6.652  -7.974   5.699
  402   2HB   ALA  54          3HB       ALA  54  -7.411  -9.560   5.479
  403   3HB   ALA  54          1HB       ALA  54  -5.655  -9.429   5.782
  404    H    GLY  55           HN       GLY  55  -6.177 -11.192   4.819
  405   1HA   GLY  55          1HA       GLY  55  -5.673 -13.325   4.245
  406   2HA   GLY  55          2HA       GLY  55  -6.852 -12.996   2.967
  407    H    LYS  56           HN       LYS  56  -6.033 -12.249   0.914
  408    HA   LYS  56           HA       LYS  56  -3.584 -13.737   0.110
  409   1HB   LYS  56          2HB       LYS  56  -5.912 -12.575  -1.472
  410   2HB   LYS  56          1HB       LYS  56  -4.520 -13.422  -2.167
  411   1HG   LYS  56          2HG       LYS  56  -5.111 -15.488  -1.015
  412   2HG   LYS  56          1HG       LYS  56  -6.397 -14.675  -0.114
  413   1HD   LYS  56          2HD       LYS  56  -7.369 -15.951  -1.918
  414   2HD   LYS  56          1HD       LYS  56  -7.639 -14.224  -2.194
  415   1HE   LYS  56          1HE       LYS  56  -5.836 -14.180  -3.883
  416   2HE   LYS  56          2HE       LYS  56  -5.436 -15.874  -3.531
  417   1HZ   LYS  56          3HZ       LYS  56  -7.979 -14.892  -4.613
  418   2HZ   LYS  56          2HZ       LYS  56  -6.790 -15.636  -5.472
  419   3HZ   LYS  56          1HZ       LYS  56  -7.610 -16.470  -4.310
  420    H    VAL  57           HN       VAL  57  -4.986 -10.466   0.137
  421    HA   VAL  57           HA       VAL  57  -3.223  -9.448  -1.944
  422    HB   VAL  57           HB       VAL  57  -5.213  -8.084  -0.110
  423   1HG1  VAL  57          1HG11     VAL  57  -4.043  -7.147  -2.773
  424   2HG1  VAL  57          2HG12     VAL  57  -5.380  -6.377  -1.934
  425   3HG1  VAL  57          3HG13     VAL  57  -3.773  -6.424  -1.198
  426   1HG2  VAL  57          3HG23     VAL  57  -5.719  -9.444  -2.763
  427   2HG2  VAL  57          1HG21     VAL  57  -6.486  -9.745  -1.199
  428   3HG2  VAL  57          2HG22     VAL  57  -6.806  -8.237  -2.051
  429    H    ILE  58           HN       ILE  58  -1.438  -8.152  -1.742
  430    HA   ILE  58           HA       ILE  58  -0.382  -7.679   1.029
  431    HB   ILE  58           HB       ILE  58   0.944  -7.481  -1.695
  432   1HG1  ILE  58          1HG11     ILE  58   2.507  -9.206  -0.766
  433   2HG1  ILE  58          2HG12     ILE  58   1.356  -9.503   0.534
  434   1HG2  ILE  58          1HG21     ILE  58   1.818  -5.760  -0.162
  435   2HG2  ILE  58          2HG22     ILE  58   2.153  -7.000   1.049
  436   3HG2  ILE  58          3HG23     ILE  58   3.021  -7.001  -0.491
  437   1HD1  ILE  58          2HD12     ILE  58   0.711  -9.728  -2.463
  438   2HD1  ILE  58          3HD13     ILE  58   1.283 -11.079  -1.479
  439   3HD1  ILE  58          1HD11     ILE  58  -0.278 -10.321  -1.123
  440    H    PHE  59           HN       PHE  59  -0.500  -5.552   1.816
  441    HA   PHE  59           HA       PHE  59  -1.299  -3.404  -0.129
  442   1HB   PHE  59          1HB       PHE  59  -2.308  -3.960   2.645
  443   2HB   PHE  59          2HB       PHE  59  -2.489  -2.413   1.832
  444    HD1  PHE  59           HD1      PHE  59  -3.938  -2.148  -0.116
  445    HD2  PHE  59           HD2      PHE  59  -3.638  -5.932   1.925
  446    HE1  PHE  59           HE1      PHE  59  -6.174  -2.768  -0.961
  447    HE2  PHE  59           HE2      PHE  59  -5.923  -6.489   1.209
  448    HZ   PHE  59           HZ       PHE  59  -7.222  -4.892  -0.227
  449    H    LEU  60           HN       LEU  60   0.348  -2.111  -0.355
  450    HA   LEU  60           HA       LEU  60   2.286  -1.646   1.883
  451   1HB   LEU  60          1HB       LEU  60   2.471  -1.378  -1.135
  452   2HB   LEU  60          2HB       LEU  60   3.759  -0.908  -0.008
  453    HG   LEU  60           HG       LEU  60   2.693  -3.707  -0.507
  454   1HD1  LEU  60          1HD21     LEU  60   4.018  -2.741  -2.369
  455   2HD1  LEU  60          2HD22     LEU  60   5.339  -2.377  -1.242
  456   3HD1  LEU  60          3HD23     LEU  60   4.889  -4.062  -1.573
  457   1HD2  LEU  60          3HD13     LEU  60   4.943  -2.714   1.310
  458   2HD2  LEU  60          2HD12     LEU  60   3.499  -3.644   1.788
  459   3HD2  LEU  60          1HD11     LEU  60   4.752  -4.394   0.786
  460    H    LYS  61           HN       LYS  61   1.403   0.178   3.014
  461    HA   LYS  61           HA       LYS  61   0.648   2.541   1.389
  462   1HB   LYS  61          2HB       LYS  61  -0.552   2.322   3.449
  463   2HB   LYS  61          1HB       LYS  61   0.924   2.093   4.375
  464   1HG   LYS  61          1HG       LYS  61   0.133   4.321   4.761
  465   2HG   LYS  61          2HG       LYS  61   1.628   4.425   3.840
  466   1HD   LYS  61          2HD       LYS  61   0.089   4.631   1.719
  467   2HD   LYS  61          1HD       LYS  61  -1.228   4.829   2.873
  468   1HE   LYS  61          1HE       LYS  61  -0.526   7.002   2.280
  469   2HE   LYS  61          2HE       LYS  61   0.176   6.758   3.885
  470   1HZ   LYS  61          3HZ       LYS  61   1.631   6.333   1.352
  471   2HZ   LYS  61          1HZ       LYS  61   1.729   7.703   2.248
  472   3HZ   LYS  61          2HZ       LYS  61   2.260   6.271   2.868
  473    H    VAL  62           HN       VAL  62   2.246   3.810   0.460
  474    HA   VAL  62           HA       VAL  62   4.991   3.663   1.648
  475    HB   VAL  62           HB       VAL  62   4.100   3.445  -1.248
  476   1HG1  VAL  62          3HG13     VAL  62   6.916   3.715  -0.109
  477   2HG1  VAL  62          1HG11     VAL  62   6.511   3.295  -1.789
  478   3HG1  VAL  62          2HG12     VAL  62   6.128   4.901  -1.174
  479   1HG2  VAL  62          1HG21     VAL  62   4.083   1.348   0.139
  480   2HG2  VAL  62          2HG22     VAL  62   5.336   1.295  -1.106
  481   3HG2  VAL  62          3HG23     VAL  62   5.774   1.646   0.571
  482    H    ASP  63           HN       ASP  63   6.129   5.399   1.792
  483    HA   ASP  63           HA       ASP  63   4.950   8.031   1.074
  484   1HB   ASP  63          2HB       ASP  63   5.609   7.764   3.409
  485   2HB   ASP  63          1HB       ASP  63   7.234   7.248   2.929
  486    H    VAL  64           HN       VAL  64   5.493   8.423  -1.017
  487    HA   VAL  64           HA       VAL  64   7.769   7.518  -2.417
  488    HB   VAL  64           HB       VAL  64   7.291   9.383  -3.995
  489   1HG1  VAL  64          3HG23     VAL  64   4.893   7.798  -2.989
  490   2HG1  VAL  64          1HG21     VAL  64   4.947   8.676  -4.524
  491   3HG1  VAL  64          2HG22     VAL  64   6.066   7.329  -4.247
  492   1HG2  VAL  64          3HG13     VAL  64   6.579  11.140  -2.372
  493   2HG2  VAL  64          2HG12     VAL  64   5.397  10.873  -3.657
  494   3HG2  VAL  64          1HG11     VAL  64   5.102  10.197  -2.050
  495    H    ASP  65           HN       ASP  65   7.462  10.175  -0.092
  496    HA   ASP  65           HA       ASP  65   9.755  11.671  -0.875
  497   1HB   ASP  65          2HB       ASP  65   7.923  12.292   0.821
  498   2HB   ASP  65          1HB       ASP  65   8.806  11.290   1.983
  499    H    ALA  66           HN       ALA  66   9.304   8.685   1.010
  500    HA   ALA  66           HA       ALA  66  12.098   8.629   1.942
  501   1HB   ALA  66          2HB       ALA  66  10.312   7.839   3.427
  502   2HB   ALA  66          3HB       ALA  66   9.822   6.613   2.239
  503   3HB   ALA  66          1HB       ALA  66  11.426   6.525   2.998
  504    H    VAL  67           HN       VAL  67  10.004   6.351   0.022
  505    HA   VAL  67           HA       VAL  67  12.489   5.156  -1.064
  506    HB   VAL  67           HB       VAL  67  11.108   3.492  -2.073
  507   1HG1  VAL  67          2HG12     VAL  67  11.891   3.257   0.253
  508   2HG1  VAL  67          1HG11     VAL  67  10.363   3.955   0.832
  509   3HG1  VAL  67          3HG13     VAL  67  10.365   2.405  -0.035
  510   1HG2  VAL  67          1HG21     VAL  67   9.015   4.756  -2.586
  511   2HG2  VAL  67          2HG22     VAL  67   8.746   3.302  -1.630
  512   3HG2  VAL  67          3HG23     VAL  67   8.717   4.909  -0.848
  513    H    ALA  68           HN       ALA  68  12.597   7.649  -1.867
  514    HA   ALA  68           HA       ALA  68  11.337   8.553  -4.160
  515   1HB   ALA  68          2HB       ALA  68  13.005   9.840  -2.888
  516   2HB   ALA  68          3HB       ALA  68  14.303   8.770  -3.465
  517   3HB   ALA  68          1HB       ALA  68  13.424   9.802  -4.613
  518    H    ALA  69           HN       ALA  69  14.051   6.264  -3.968
  519    HA   ALA  69           HA       ALA  69  14.604   5.923  -6.713
  520   1HB   ALA  69          2HB       ALA  69  16.048   5.088  -4.910
  521   2HB   ALA  69          3HB       ALA  69  14.804   3.911  -4.429
  522   3HB   ALA  69          1HB       ALA  69  15.596   3.775  -6.014
  523    H    VAL  70           HN       VAL  70  12.244   4.168  -4.604
  524    HA   VAL  70           HA       VAL  70  11.471   2.355  -6.749
  525    HB   VAL  70           HB       VAL  70   9.976   2.992  -4.169
  526   1HG1  VAL  70          3HG13     VAL  70   9.777   0.769  -6.263
  527   2HG1  VAL  70          2HG12     VAL  70   9.068   0.674  -4.653
  528   3HG1  VAL  70          1HG11     VAL  70   8.506   1.914  -5.785
  529   1HG2  VAL  70          3HG23     VAL  70  11.870   0.712  -4.850
  530   2HG2  VAL  70          2HG22     VAL  70  12.242   2.041  -3.718
  531   3HG2  VAL  70          1HG21     VAL  70  10.940   0.895  -3.342
  532    H    ALA  71           HN       ALA  71  10.216   5.338  -5.270
  533    HA   ALA  71           HA       ALA  71   7.802   5.565  -6.690
  534   1HB   ALA  71          2HB       ALA  71   8.515   7.017  -4.801
  535   2HB   ALA  71          3HB       ALA  71   9.660   7.847  -5.871
  536   3HB   ALA  71          1HB       ALA  71   7.922   7.955  -6.186
  537    H    GLU  72           HN       GLU  72  11.016   6.999  -7.633
  538    HA   GLU  72           HA       GLU  72  10.010   7.899 -10.168
  539   1HB   GLU  72          2HB       GLU  72  12.259   8.463 -10.718
  540   2HB   GLU  72          1HB       GLU  72  11.954   8.887  -9.031
  541   1HG   GLU  72          2HG       GLU  72  13.127   6.726  -8.389
  542   2HG   GLU  72          1HG       GLU  72  13.595   6.539 -10.083
  543    H    ALA  73           HN       ALA  73  11.788   4.873  -9.233
  544    HA   ALA  73           HA       ALA  73  12.082   3.878 -11.872
  545   1HB   ALA  73          2HB       ALA  73  13.221   2.915  -9.912
  546   2HB   ALA  73          3HB       ALA  73  11.664   2.355  -9.260
  547   3HB   ALA  73          1HB       ALA  73  12.292   1.674 -10.774
  548    H    ALA  74           HN       ALA  74   9.414   3.495  -9.538
  549    HA   ALA  74           HA       ALA  74   7.743   1.796 -11.107
  550   1HB   ALA  74          3HB       ALA  74   7.111   3.742  -8.859
  551   2HB   ALA  74          1HB       ALA  74   6.005   2.507  -9.487
  552   3HB   ALA  74          2HB       ALA  74   7.507   2.020  -8.694
  553    H    GLY  75           HN       GLY  75   8.078   5.310 -10.807
  554   1HA   GLY  75          1HA       GLY  75   7.868   6.689 -12.774
  555   2HA   GLY  75          2HA       GLY  75   6.543   5.669 -13.355
  556    H    ILE  76           HN       ILE  76   7.079   7.103 -10.089
  557    HA   ILE  76           HA       ILE  76   4.342   8.156 -10.065
  558    HB   ILE  76           HB       ILE  76   6.668   8.059  -8.150
  559   1HG1  ILE  76          2HG12     ILE  76   4.983   7.116  -6.663
  560   2HG1  ILE  76          1HG11     ILE  76   3.683   7.557  -7.777
  561   1HG2  ILE  76          1HG21     ILE  76   4.298   9.951  -7.846
  562   2HG2  ILE  76          2HG22     ILE  76   5.415   9.492  -6.550
  563   3HG2  ILE  76          3HG23     ILE  76   6.017  10.407  -7.918
  564   1HD1  ILE  76          3HD13     ILE  76   5.863   5.516  -8.331
  565   2HD1  ILE  76          2HD12     ILE  76   4.194   5.154  -7.856
  566   3HD1  ILE  76          1HD11     ILE  76   4.503   5.893  -9.418
  567    H    THR  77           HN       THR  77   3.696  10.098 -10.706
  568    HA   THR  77           HA       THR  77   5.681  12.251 -11.307
  569    HB   THR  77           HB       THR  77   3.821  13.025 -12.851
  570    HG1  THR  77           HG1      THR  77   2.347  11.249 -13.411
  571   1HG2  THR  77          2HG22     THR  77   5.801  11.756 -13.693
  572   2HG2  THR  77          3HG23     THR  77   4.928  10.232 -13.435
  573   3HG2  THR  77          1HG21     THR  77   4.339  11.403 -14.632
  574    H    ALA  78           HN       ALA  78   2.205  11.992 -10.809
  575    HA   ALA  78           HA       ALA  78   2.223  14.086  -8.693
  576   1HB   ALA  78          2HB       ALA  78   0.567  14.247 -10.531
  577   2HB   ALA  78          1HB       ALA  78  -0.071  12.645 -10.098
  578   3HB   ALA  78          3HB       ALA  78  -0.228  14.003  -8.964
  579    H    MET  79           HN       MET  79   0.898  13.636  -6.728
  580    HA   MET  79           HA       MET  79   0.731  10.817  -5.910
  581   1HB   MET  79          1HB       MET  79   1.720  11.290  -3.760
  582   2HB   MET  79          2HB       MET  79   2.874  11.532  -5.063
  583   1HG   MET  79          1HG       MET  79   1.407  13.730  -3.538
  584   2HG   MET  79          2HG       MET  79   3.068  13.226  -3.291
  585   1HE   MET  79          1HE       MET  79   4.998  13.521  -5.061
  586   2HE   MET  79          2HE       MET  79   4.056  12.977  -6.472
  587   3HE   MET  79          3HE       MET  79   4.863  14.554  -6.503
  588    HA   PRO  80           HA       PRO  80  -0.549   9.834  -3.876
  589   1HB   PRO  80          1HB       PRO  80  -3.484   9.601  -4.600
  590   2HB   PRO  80          2HB       PRO  80  -2.604   8.747  -3.310
  591   1HG   PRO  80          2HG       PRO  80  -4.045  10.906  -2.669
  592   2HG   PRO  80          1HG       PRO  80  -2.380  10.836  -2.069
  593   1HD   PRO  80          2HD       PRO  80  -3.392  12.284  -4.555
  594   2HD   PRO  80          1HD       PRO  80  -2.358  12.927  -3.251
  595    H    THR  81           HN       THR  81  -0.361   7.855  -4.957
  596    HA   THR  81           HA       THR  81  -1.489   7.473  -7.642
  597    HB   THR  81           HB       THR  81   1.472   7.599  -6.971
  598    HG1  THR  81           HG1      THR  81   0.901   9.402  -8.048
  599   1HG2  THR  81          1HG21     THR  81   0.184   6.114  -9.298
  600   2HG2  THR  81          2HG22     THR  81   1.898   6.557  -9.197
  601   3HG2  THR  81          3HG23     THR  81   1.225   5.413  -8.027
  602    H    PHE  82           HN       PHE  82  -2.041   5.351  -7.945
  603    HA   PHE  82           HA       PHE  82  -1.428   3.440  -5.730
  604   1HB   PHE  82          1HB       PHE  82  -4.015   3.923  -7.231
  605   2HB   PHE  82          2HB       PHE  82  -3.693   2.484  -6.295
  606    HD1  PHE  82           HD2      PHE  82  -4.235   6.174  -6.050
  607    HD2  PHE  82           HD1      PHE  82  -3.579   2.514  -3.852
  608    HE1  PHE  82           HE2      PHE  82  -4.889   7.308  -3.956
  609    HE2  PHE  82           HE1      PHE  82  -4.335   3.648  -1.778
  610    HZ   PHE  82           HZ       PHE  82  -4.856   6.042  -1.793
  611    H    HIS  83           HN       HIS  83  -0.315   1.700  -6.502
  612    HA   HIS  83           HA       HIS  83  -0.600   0.971  -9.414
  613   1HB   HIS  83          2HB       HIS  83   1.869   0.910  -7.697
  614   2HB   HIS  83          1HB       HIS  83   1.698   0.051  -9.227
  615    HD2  HIS  83           HD2      HIS  83   0.316   3.560  -9.706
  616    HE1  HIS  83           HE1      HIS  83   4.393   3.641 -10.785
  617    HE2  HIS  83           HE2      HIS  83   2.193   4.906 -10.932
  618    H    VAL  84           HN       VAL  84  -0.504  -1.260  -9.870
  619    HA   VAL  84           HA       VAL  84  -0.780  -3.077  -7.521
  620    HB   VAL  84           HB       VAL  84  -2.224  -3.431 -10.168
  621   1HG1  VAL  84          1HG21     VAL  84  -2.470  -4.706  -7.399
  622   2HG1  VAL  84          2HG22     VAL  84  -3.527  -5.038  -8.776
  623   3HG1  VAL  84          3HG23     VAL  84  -1.820  -5.481  -8.860
  624   1HG2  VAL  84          2HG12     VAL  84  -3.327  -2.236  -7.596
  625   2HG2  VAL  84          1HG11     VAL  84  -3.192  -1.420  -9.175
  626   3HG2  VAL  84          3HG13     VAL  84  -4.295  -2.786  -8.981
  627    H    TYR  85           HN       TYR  85   0.828  -4.571  -7.528
  628    HA   TYR  85           HA       TYR  85   2.122  -5.380 -10.130
  629   1HB   TYR  85          1HB       TYR  85   3.318  -5.382  -7.345
  630   2HB   TYR  85          2HB       TYR  85   4.065  -5.962  -8.825
  631    HD1  TYR  85           HD1      TYR  85   2.699  -2.859  -7.179
  632    HD2  TYR  85           HD2      TYR  85   5.380  -4.492 -10.125
  633    HE1  TYR  85           HE1      TYR  85   3.511  -0.584  -7.733
  634    HE2  TYR  85           HE2      TYR  85   6.177  -2.213 -10.666
  635    HH   TYR  85           HH       TYR  85   4.456   0.689  -9.550
  636    H    LYS  86           HN       LYS  86   1.446  -7.428 -10.688
  637    HA   LYS  86           HA       LYS  86   0.003  -9.073  -8.668
  638   1HB   LYS  86          1HB       LYS  86   0.214  -9.105 -11.693
  639   2HB   LYS  86          2HB       LYS  86  -0.455 -10.472 -10.807
  640   1HG   LYS  86          1HG       LYS  86  -1.498  -7.669 -10.316
  641   2HG   LYS  86          2HG       LYS  86  -2.090  -8.616 -11.682
  642   1HD   LYS  86          1HD       LYS  86  -2.137  -9.756  -8.853
  643   2HD   LYS  86          2HD       LYS  86  -3.426  -8.723  -9.476
  644   1HE   LYS  86          2HE       LYS  86  -3.926 -10.261 -11.275
  645   2HE   LYS  86          1HE       LYS  86  -2.563 -11.309 -10.828
  646   1HZ   LYS  86          1HZ       LYS  86  -4.839 -10.726  -9.071
  647   2HZ   LYS  86          3HZ       LYS  86  -4.667 -12.091  -9.977
  648   3HZ   LYS  86          2HZ       LYS  86  -3.586 -11.761  -8.781
  649    H    ASP  87           HN       ASP  87   2.517  -9.611 -11.157
  650    HA   ASP  87           HA       ASP  87   3.384 -12.124  -9.850
  651   1HB   ASP  87          1HB       ASP  87   4.621 -12.449 -11.896
  652   2HB   ASP  87          2HB       ASP  87   2.957 -11.984 -12.305
  653    H    GLY  88           HN       GLY  88   4.490  -9.050 -10.880
  654   1HA   GLY  88          1HA       GLY  88   6.303  -8.304  -8.834
  655   2HA   GLY  88          2HA       GLY  88   7.242  -9.172 -10.066
  656    H    VAL  89           HN       VAL  89   5.236  -8.221 -12.201
  657    HA   VAL  89           HA       VAL  89   6.487  -5.623 -12.732
  658    HB   VAL  89           HB       VAL  89   4.668  -7.380 -14.451
  659   1HG1  VAL  89          3HG23     VAL  89   6.614  -5.149 -15.187
  660   2HG1  VAL  89          1HG21     VAL  89   5.753  -6.180 -16.346
  661   3HG1  VAL  89          2HG22     VAL  89   4.839  -5.088 -15.305
  662   1HG2  VAL  89          1HG11     VAL  89   7.712  -7.379 -14.353
  663   2HG2  VAL  89          3HG13     VAL  89   6.655  -8.715 -13.861
  664   3HG2  VAL  89          2HG12     VAL  89   6.706  -8.230 -15.550
  665    H    LYS  90           HN       LYS  90   5.262  -3.790 -13.193
  666    HA   LYS  90           HA       LYS  90   2.949  -3.303 -11.625
  667   1HB   LYS  90          1HB       LYS  90   4.637  -1.615 -12.473
  668   2HB   LYS  90          2HB       LYS  90   3.924  -1.785 -14.080
  669   1HG   LYS  90          1HG       LYS  90   1.742  -0.966 -13.184
  670   2HG   LYS  90          2HG       LYS  90   2.421  -0.933 -11.557
  671   1HD   LYS  90          2HD       LYS  90   2.403   1.320 -12.496
  672   2HD   LYS  90          1HD       LYS  90   4.054   0.785 -12.191
  673   1HE   LYS  90          1HE       LYS  90   3.774   2.017 -14.341
  674   2HE   LYS  90          2HE       LYS  90   4.444   0.399 -14.560
  675   1HZ   LYS  90          1HZ       LYS  90   1.616   1.133 -14.949
  676   2HZ   LYS  90          3HZ       LYS  90   2.727   0.905 -16.147
  677   3HZ   LYS  90          2HZ       LYS  90   2.274  -0.359 -15.195
  678    H    ALA  91           HN       ALA  91   1.148  -4.486 -11.984
  679    HA   ALA  91           HA       ALA  91   0.371  -5.420 -14.649
  680   1HB   ALA  91          3HB       ALA  91   0.114  -6.847 -12.649
  681   2HB   ALA  91          1HB       ALA  91  -0.991  -5.654 -11.927
  682   3HB   ALA  91          2HB       ALA  91  -1.456  -6.516 -13.409
  683    H    ASP  92           HN       ASP  92  -0.538  -2.887 -12.333
  684    HA   ASP  92           HA       ASP  92  -2.069  -1.515 -14.399
  685   1HB   ASP  92          2HB       ASP  92  -3.544  -3.355 -13.255
  686   2HB   ASP  92          1HB       ASP  92  -3.586  -2.262 -11.866
  687    H    ASP  93           HN       ASP  93  -3.015   0.584 -13.412
  688    HA   ASP  93           HA       ASP  93  -1.905   1.523 -10.959
  689   1HB   ASP  93          2HB       ASP  93  -0.464   3.332 -11.915
  690   2HB   ASP  93          1HB       ASP  93   0.175   1.719 -12.180
  691    H    LEU  94           HN       LEU  94  -2.281   3.775 -10.587
  692    HA   LEU  94           HA       LEU  94  -4.349   5.187 -12.125
  693   1HB   LEU  94          2HB       LEU  94  -5.655   3.558 -11.024
  694   2HB   LEU  94          1HB       LEU  94  -4.763   3.673  -9.511
  695    HG   LEU  94           HG       LEU  94  -7.047   4.475  -9.462
  696   1HD1  LEU  94          3HD23     LEU  94  -4.773   5.810  -8.329
  697   2HD1  LEU  94          2HD22     LEU  94  -6.064   6.976  -8.595
  698   3HD1  LEU  94          1HD21     LEU  94  -6.368   5.510  -7.656
  699   1HD2  LEU  94          2HD12     LEU  94  -6.912   5.510 -11.822
  700   2HD2  LEU  94          3HD13     LEU  94  -7.898   6.324 -10.606
  701   3HD2  LEU  94          1HD11     LEU  94  -6.318   6.966 -11.018
  702    H    VAL  95           HN       VAL  95  -4.512   7.396 -11.379
  703    HA   VAL  95           HA       VAL  95  -2.517   8.259  -9.368
  704    HB   VAL  95           HB       VAL  95  -2.257  10.305 -10.710
  705   1HG1  VAL  95          1HG11     VAL  95  -0.654   8.432 -10.890
  706   2HG1  VAL  95          2HG12     VAL  95  -1.579   7.767 -12.252
  707   3HG1  VAL  95          3HG13     VAL  95  -0.790   9.350 -12.398
  708   1HG2  VAL  95          3HG23     VAL  95  -4.392  10.246 -11.994
  709   2HG2  VAL  95          1HG21     VAL  95  -2.976  10.392 -13.044
  710   3HG2  VAL  95          2HG22     VAL  95  -3.803   8.834 -12.898
  711    H    GLY  96           HN       GLY  96  -3.046  10.093  -8.133
  712   1HA   GLY  96          1HA       GLY  96  -4.376  11.716  -7.193
  713   2HA   GLY  96          2HA       GLY  96  -5.651  11.388  -8.385
  714    H    ALA  97           HN       ALA  97  -6.636  11.834  -6.053
  715    HA   ALA  97           HA       ALA  97  -6.770   9.591  -4.214
  716   1HB   ALA  97          1HB       ALA  97  -6.948  11.995  -3.561
  717   2HB   ALA  97          3HB       ALA  97  -8.471  12.117  -4.459
  718   3HB   ALA  97          2HB       ALA  97  -8.367  11.048  -3.046
  719    H    SER  98           HN       SER  98  -7.448   8.559  -6.716
  720    HA   SER  98           HA       SER  98 -10.332   8.681  -7.181
  721   1HB   SER  98          2HB       SER  98  -8.287   6.819  -8.398
  722   2HB   SER  98          1HB       SER  98  -9.848   7.302  -9.068
  723    HG   SER  98           HG       SER  98  -7.431   8.629  -9.215
  724    H    GLN  99           HN       GLN  99 -10.561   8.005  -4.803
  725    HA   GLN  99           HA       GLN  99 -10.056   5.501  -3.737
  726   1HB   GLN  99          1HB       GLN  99 -12.668   7.063  -3.408
  727   2HB   GLN  99          2HB       GLN  99 -12.024   5.844  -2.301
  728   1HG   GLN  99          2HG       GLN  99 -10.868   8.607  -2.881
  729   2HG   GLN  99          1HG       GLN  99 -11.585   8.035  -1.382
  730   1HE2  GLN  99          2HE22     GLN  99  -8.714   6.004  -0.479
  731   2HE2  GLN  99          1HE21     GLN  99 -10.467   5.985  -0.423
  732    H    ASP 100           HN       ASP 100 -12.759   6.338  -5.893
  733    HA   ASP 100           HA       ASP 100 -14.189   3.872  -5.772
  734   1HB   ASP 100          1HB       ASP 100 -15.230   4.646  -7.829
  735   2HB   ASP 100          2HB       ASP 100 -15.105   5.993  -6.693
  736    H    LYS 101           HN       LYS 101 -11.629   5.087  -7.959
  737    HA   LYS 101           HA       LYS 101 -11.562   2.694  -9.526
  738   1HB   LYS 101          2HB       LYS 101 -10.781   4.998 -10.251
  739   2HB   LYS 101          1HB       LYS 101  -9.380   4.787  -9.203
  740   1HG   LYS 101          2HG       LYS 101  -8.884   4.275 -11.572
  741   2HG   LYS 101          1HG       LYS 101  -8.594   2.890 -10.518
  742   1HD   LYS 101          2HD       LYS 101  -9.630   2.299 -12.674
  743   2HD   LYS 101          1HD       LYS 101 -10.612   1.789 -11.305
  744   1HE   LYS 101          2HE       LYS 101 -12.120   3.750 -11.645
  745   2HE   LYS 101          1HE       LYS 101 -11.073   4.330 -12.955
  746   1HZ   LYS 101          2HZ       LYS 101 -12.561   1.798 -12.926
  747   2HZ   LYS 101          3HZ       LYS 101 -12.974   3.157 -13.762
  748   3HZ   LYS 101          1HZ       LYS 101 -11.601   2.334 -14.156
  749    H    LEU 102           HN       LEU 102  -9.726   3.832  -6.667
  750    HA   LEU 102           HA       LEU 102  -7.844   1.713  -6.555
  751   1HB   LEU 102          1HB       LEU 102  -7.687   3.711  -5.198
  752   2HB   LEU 102          2HB       LEU 102  -9.146   3.321  -4.303
  753    HG   LEU 102           HG       LEU 102  -6.911   2.979  -3.191
  754   1HD1  LEU 102          1HD11     LEU 102  -9.010   2.155  -2.243
  755   2HD1  LEU 102          3HD13     LEU 102  -8.813   0.614  -3.107
  756   3HD1  LEU 102          2HD12     LEU 102  -7.650   1.092  -1.874
  757   1HD2  LEU 102          3HD23     LEU 102  -5.798   1.774  -5.071
  758   2HD2  LEU 102          1HD21     LEU 102  -5.692   0.937  -3.510
  759   3HD2  LEU 102          2HD22     LEU 102  -6.825   0.364  -4.741
  760    H    LYS 103           HN       LYS 103 -11.116   1.954  -4.983
  761    HA   LYS 103           HA       LYS 103 -11.239  -0.650  -3.936
  762   1HB   LYS 103          1HB       LYS 103 -13.372   1.191  -5.099
  763   2HB   LYS 103          2HB       LYS 103 -13.742  -0.333  -4.292
  764   1HG   LYS 103          1HG       LYS 103 -12.811   0.411  -2.217
  765   2HG   LYS 103          2HG       LYS 103 -12.146   1.882  -2.943
  766   1HD   LYS 103          2HD       LYS 103 -14.366   2.727  -3.463
  767   2HD   LYS 103          1HD       LYS 103 -15.135   1.238  -2.894
  768   1HE   LYS 103          2HE       LYS 103 -13.477   3.099  -1.123
  769   2HE   LYS 103          1HE       LYS 103 -15.240   3.175  -1.277
  770   1HZ   LYS 103          2HZ       LYS 103 -15.374   0.941  -0.476
  771   2HZ   LYS 103          1HZ       LYS 103 -13.737   0.850  -0.317
  772   3HZ   LYS 103          3HZ       LYS 103 -14.597   1.901   0.613
  773    H    ALA 104           HN       ALA 104 -12.395   0.488  -7.158
  774    HA   ALA 104           HA       ALA 104 -13.221  -2.001  -8.163
  775   1HB   ALA 104          2HB       ALA 104 -13.679   0.187  -9.235
  776   2HB   ALA 104          3HB       ALA 104 -11.968   0.318  -9.698
  777   3HB   ALA 104          1HB       ALA 104 -12.974  -0.973 -10.380
  778    H    LEU 105           HN       LEU 105  -9.946  -0.515  -8.280
  779    HA   LEU 105           HA       LEU 105  -8.748  -2.550  -9.870
  780   1HB   LEU 105          1HB       LEU 105  -7.643  -0.535  -7.879
  781   2HB   LEU 105          2HB       LEU 105  -6.598  -1.697  -8.686
  782    HG   LEU 105           HG       LEU 105  -8.403   0.189 -10.250
  783   1HD1  LEU 105          3HD13     LEU 105  -5.492   0.532  -9.391
  784   2HD1  LEU 105          1HD11     LEU 105  -6.349   1.535 -10.576
  785   3HD1  LEU 105          2HD12     LEU 105  -6.869   1.539  -8.880
  786   1HD2  LEU 105          1HD21     LEU 105  -5.923  -1.416 -10.996
  787   2HD2  LEU 105          3HD23     LEU 105  -7.580  -1.752 -11.545
  788   3HD2  LEU 105          2HD22     LEU 105  -6.771  -0.270 -12.054
  789    H    VAL 106           HN       VAL 106  -8.924  -2.177  -6.242
  790    HA   VAL 106           HA       VAL 106  -7.430  -4.586  -5.839
  791    HB   VAL 106           HB       VAL 106  -9.611  -3.590  -3.958
  792   1HG1  VAL 106          1HG21     VAL 106  -8.646  -5.879  -3.521
  793   2HG1  VAL 106          3HG23     VAL 106  -7.020  -5.181  -3.547
  794   3HG1  VAL 106          2HG22     VAL 106  -8.164  -4.710  -2.284
  795   1HG2  VAL 106          1HG11     VAL 106  -6.684  -2.752  -4.174
  796   2HG2  VAL 106          2HG12     VAL 106  -8.102  -1.703  -4.301
  797   3HG2  VAL 106          3HG13     VAL 106  -7.720  -2.443  -2.760
  798    H    ALA 107           HN       ALA 107 -10.947  -4.036  -6.110
  799    HA   ALA 107           HA       ALA 107 -11.807  -6.709  -5.793
  800   1HB   ALA 107          3HB       ALA 107 -13.337  -4.752  -5.966
  801   2HB   ALA 107          2HB       ALA 107 -12.972  -4.620  -7.696
  802   3HB   ALA 107          1HB       ALA 107 -13.797  -6.059  -7.075
  803    H    LYS 108           HN       LYS 108 -10.903  -5.091  -8.867
  804    HA   LYS 108           HA       LYS 108 -11.152  -7.322 -10.586
  805   1HB   LYS 108          2HB       LYS 108 -10.932  -5.155 -11.491
  806   2HB   LYS 108          1HB       LYS 108  -9.475  -4.791 -10.568
  807   1HG   LYS 108          1HG       LYS 108  -8.135  -6.334 -11.919
  808   2HG   LYS 108          2HG       LYS 108  -9.540  -6.770 -12.881
  809   1HD   LYS 108          2HD       LYS 108  -8.366  -3.960 -12.607
  810   2HD   LYS 108          1HD       LYS 108  -8.005  -5.092 -13.919
  811   1HE   LYS 108          2HE       LYS 108 -10.434  -5.100 -14.548
  812   2HE   LYS 108          1HE       LYS 108 -10.734  -3.864 -13.309
  813   1HZ   LYS 108          3HZ       LYS 108  -9.195  -2.439 -14.439
  814   2HZ   LYS 108          1HZ       LYS 108  -8.931  -3.577 -15.601
  815   3HZ   LYS 108          2HZ       LYS 108 -10.422  -2.895 -15.441
  816    H    HIS 109           HN       HIS 109  -8.153  -6.032  -9.111
  817    HA   HIS 109           HA       HIS 109  -6.591  -8.238 -10.095
  818   1HB   HIS 109          1HB       HIS 109  -5.999  -5.936  -8.198
  819   2HB   HIS 109          2HB       HIS 109  -4.794  -7.092  -8.771
  820    HD2  HIS 109           HD2      HIS 109  -6.525  -3.903 -10.061
  821    HE1  HIS 109           HE1      HIS 109  -4.633  -5.694 -13.367
  822    HE2  HIS 109           HE2      HIS 109  -5.828  -3.606 -12.567
  823    H    ALA 110           HN       ALA 110  -8.499  -7.977  -7.193
  824    HA   ALA 110           HA       ALA 110  -7.102 -10.368  -6.058
  825   1HB   ALA 110          1HB       ALA 110  -7.533  -8.331  -4.603
  826   2HB   ALA 110          3HB       ALA 110  -9.271  -8.636  -4.821
  827   3HB   ALA 110          2HB       ALA 110  -8.254  -9.845  -4.019
  828    H    ALA 111           HN       ALA 111  -9.198 -10.089  -8.489
  829    HA   ALA 111           HA       ALA 111 -11.545 -11.391  -7.631
  830   1HB   ALA 111          1HB       ALA 111 -10.124 -11.489 -10.327
  831   2HB   ALA 111          2HB       ALA 111 -11.801 -11.994 -10.029
  832   3HB   ALA 111          3HB       ALA 111 -11.343 -10.295  -9.812
  833    H    ALA 112           HN       ALA 112  -8.328 -12.742  -8.319
  834    HA   ALA 112           HA       ALA 112  -8.984 -15.259  -7.154
  835   1HB   ALA 112          3HB       ALA 112  -8.322 -15.131 -10.139
  836   2HB   ALA 112          2HB       ALA 112  -8.344 -16.602  -9.145
  837   3HB   ALA 112          1HB       ALA 112  -9.852 -15.714  -9.440
   
  No H/Q in entry =         837
  Start of MODEL    3
    1   1H    GLY   1          2HN       GLY   1  -0.348 -12.015   1.289
    2   2H    GLY   1          1HN       GLY   1   0.373 -13.499   1.076
    3   3H    GLY   1          3HN       GLY   1  -1.325 -13.281   1.047
    4   1HA   GLY   1          1HA       GLY   1  -1.111 -14.005   3.186
    5   2HA   GLY   1          2HA       GLY   1   0.445 -13.157   3.362
    6    H    GLY   2           HN       GLY   2  -1.454 -12.529   5.324
    7   1HA   GLY   2          1HA       GLY   2  -3.042 -10.209   4.567
    8   2HA   GLY   2          2HA       GLY   2  -2.735 -10.828   6.198
    9    H    SER   3           HN       SER   3  -0.608  -9.625   3.572
   10    HA   SER   3           HA       SER   3   1.154  -8.209   5.388
   11   1HB   SER   3          1HB       SER   3   0.965  -8.318   2.373
   12   2HB   SER   3          2HB       SER   3   2.393  -7.823   3.308
   13    HG   SER   3           HG       SER   3   2.389  -9.996   4.167
   14    H    VAL   4           HN       VAL   4  -0.657  -6.903   6.223
   15    HA   VAL   4           HA       VAL   4  -1.402  -4.550   4.538
   16    HB   VAL   4           HB       VAL   4  -2.482  -5.702   7.162
   17   1HG1  VAL   4          3HG23     VAL   4  -3.141  -3.140   5.704
   18   2HG1  VAL   4          1HG21     VAL   4  -4.347  -3.968   6.730
   19   3HG1  VAL   4          2HG22     VAL   4  -2.828  -3.398   7.420
   20   1HG2  VAL   4          1HG11     VAL   4  -3.604  -5.691   4.338
   21   2HG2  VAL   4          3HG13     VAL   4  -3.150  -7.087   5.320
   22   3HG2  VAL   4          2HG12     VAL   4  -4.536  -6.104   5.795
   23    H    ILE   5           HN       ILE   5   0.354  -3.081   4.654
   24    HA   ILE   5           HA       ILE   5   0.788  -2.047   7.393
   25    HB   ILE   5           HB       ILE   5   3.269  -1.988   7.018
   26   1HG1  ILE   5          2HG12     ILE   5   2.621  -4.130   4.956
   27   2HG1  ILE   5          1HG11     ILE   5   3.230  -2.533   4.565
   28   1HG2  ILE   5          1HG21     ILE   5   2.085  -3.578   8.572
   29   2HG2  ILE   5          3HG23     ILE   5   2.173  -4.811   7.290
   30   3HG2  ILE   5          2HG22     ILE   5   3.653  -4.135   7.993
   31   1HD1  ILE   5          2HD12     ILE   5   5.256  -3.068   6.074
   32   2HD1  ILE   5          1HD11     ILE   5   4.697  -4.752   6.010
   33   3HD1  ILE   5          3HD13     ILE   5   5.139  -3.896   4.516
   34    H    VAL   6           HN       VAL   6   0.862  -0.042   7.476
   35    HA   VAL   6           HA       VAL   6   0.840   1.682   5.087
   36    HB   VAL   6           HB       VAL   6   0.530   2.379   8.045
   37   1HG1  VAL   6          1HG11     VAL   6   1.048   4.348   6.570
   38   2HG1  VAL   6          3HG13     VAL   6  -0.345   3.908   5.556
   39   3HG1  VAL   6          2HG12     VAL   6  -0.582   4.407   7.241
   40   1HG2  VAL   6          2HG22     VAL   6  -1.602   1.752   5.953
   41   2HG2  VAL   6          3HG23     VAL   6  -1.264   0.816   7.424
   42   3HG2  VAL   6          1HG21     VAL   6  -1.919   2.448   7.555
   43    H    ILE   7           HN       ILE   7   3.111   0.547   4.936
   44    HA   ILE   7           HA       ILE   7   5.165   1.709   6.698
   45    HB   ILE   7           HB       ILE   7   4.907  -0.742   6.089
   46   1HG1  ILE   7          1HG11     ILE   7   7.142  -1.314   6.069
   47   2HG1  ILE   7          2HG12     ILE   7   7.717   0.251   5.471
   48   1HG2  ILE   7          3HG23     ILE   7   4.539  -0.372   3.628
   49   2HG2  ILE   7          1HG21     ILE   7   6.256   0.080   3.481
   50   3HG2  ILE   7          2HG22     ILE   7   5.804  -1.550   3.986
   51   1HD1  ILE   7          1HD11     ILE   7   6.340  -0.312   8.146
   52   2HD1  ILE   7          2HD12     ILE   7   8.094  -0.226   7.898
   53   3HD1  ILE   7          3HD13     ILE   7   7.111   1.229   7.669
   54    H    ASP   8           HN       ASP   8   7.347   2.138   5.429
   55    HA   ASP   8           HA       ASP   8   6.807   4.070   3.223
   56   1HB   ASP   8          1HB       ASP   8   8.312   5.571   4.402
   57   2HB   ASP   8          2HB       ASP   8   7.035   5.073   5.515
   58    H    SER   9           HN       SER   9   9.221   1.953   4.731
   59    HA   SER   9           HA       SER   9  11.329   2.867   3.092
   60   1HB   SER   9          2HB       SER   9  12.686   1.326   4.373
   61   2HB   SER   9          1HB       SER   9  11.488   2.065   5.444
   62    HG   SER   9           HG       SER   9  11.381  -0.084   5.870
   63    H    LYS  10           HN       LYS  10  12.780   1.822   1.804
   64    HA   LYS  10           HA       LYS  10  11.900   0.215  -0.330
   65   1HB   LYS  10          2HB       LYS  10  13.931   1.671  -0.303
   66   2HB   LYS  10          1HB       LYS  10  14.682   0.615   0.870
   67   1HG   LYS  10          2HG       LYS  10  15.590   0.221  -1.343
   68   2HG   LYS  10          1HG       LYS  10  14.810  -1.236  -0.720
   69   1HD   LYS  10          1HD       LYS  10  12.802  -0.787  -2.102
   70   2HD   LYS  10          2HD       LYS  10  13.534   0.725  -2.672
   71   1HE   LYS  10          2HE       LYS  10  14.651  -2.090  -3.122
   72   2HE   LYS  10          1HE       LYS  10  13.691  -1.179  -4.297
   73   1HZ   LYS  10          2HZ       LYS  10  15.393   0.499  -4.308
   74   2HZ   LYS  10          3HZ       LYS  10  16.308  -0.372  -3.248
   75   3HZ   LYS  10          1HZ       LYS  10  15.996  -0.970  -4.749
   76    H    ALA  11           HN       ALA  11  13.721  -0.449   2.598
   77    HA   ALA  11           HA       ALA  11  14.223  -3.200   2.399
   78   1HB   ALA  11          2HB       ALA  11  13.507  -1.592   4.901
   79   2HB   ALA  11          1HB       ALA  11  14.283  -3.190   4.879
   80   3HB   ALA  11          3HB       ALA  11  15.131  -1.785   4.203
   81    H    ALA  12           HN       ALA  12  11.317  -1.567   3.853
   82    HA   ALA  12           HA       ALA  12   9.921  -3.993   4.360
   83   1HB   ALA  12          3HB       ALA  12   8.859  -1.187   3.836
   84   2HB   ALA  12          2HB       ALA  12   7.949  -2.566   4.494
   85   3HB   ALA  12          1HB       ALA  12   9.317  -1.883   5.413
   86    H    TRP  13           HN       TRP  13   9.752  -1.708   1.572
   87    HA   TRP  13           HA       TRP  13   7.783  -2.932   0.018
   88   1HB   TRP  13          2HB       TRP  13   8.700  -0.884  -0.703
   89   2HB   TRP  13          1HB       TRP  13  10.345  -1.455  -0.646
   90    HD1  TRP  13           HD1      TRP  13  11.094  -3.236  -2.651
   91    HE1  TRP  13           HE1      TRP  13  10.522  -3.162  -5.143
   92    HE3  TRP  13           HE3      TRP  13   7.093  -0.044  -2.489
   93    HZ2  TRP  13           HZ2      TRP  13   8.671  -1.857  -6.845
   94    HZ3  TRP  13           HZ3      TRP  13   6.005   0.664  -4.603
   95    HH2  TRP  13           HH2      TRP  13   6.725  -0.303  -6.773
   96    H    ASP  14           HN       ASP  14  11.289  -3.621  -0.101
   97    HA   ASP  14           HA       ASP  14  11.165  -5.809  -1.888
   98   1HB   ASP  14          1HB       ASP  14  13.161  -4.490  -1.301
   99   2HB   ASP  14          2HB       ASP  14  13.212  -5.210   0.306
  100    H    ALA  15           HN       ALA  15  11.547  -5.805   1.628
  101    HA   ALA  15           HA       ALA  15  11.565  -8.548   2.111
  102   1HB   ALA  15          1HB       ALA  15  10.309  -6.370   3.844
  103   2HB   ALA  15          3HB       ALA  15  10.730  -8.006   4.386
  104   3HB   ALA  15          2HB       ALA  15  12.007  -6.892   3.864
  105    H    GLN  16           HN       GLN  16   8.654  -6.484   2.330
  106    HA   GLN  16           HA       GLN  16   6.811  -8.653   2.651
  107   1HB   GLN  16          2HB       GLN  16   6.527  -5.750   1.896
  108   2HB   GLN  16          1HB       GLN  16   5.233  -6.874   1.501
  109   1HG   GLN  16          1HG       GLN  16   4.764  -5.981   3.637
  110   2HG   GLN  16          2HG       GLN  16   5.068  -7.697   3.777
  111   1HE2  GLN  16          1HE21     GLN  16   8.006  -5.201   5.315
  112   2HE2  GLN  16          2HE22     GLN  16   7.508  -4.993   3.640
  113    H    LEU  17           HN       LEU  17   7.813  -6.896  -0.314
  114    HA   LEU  17           HA       LEU  17   6.226  -8.243  -2.144
  115   1HB   LEU  17          1HB       LEU  17   7.605  -6.299  -2.651
  116   2HB   LEU  17          2HB       LEU  17   9.093  -7.238  -2.478
  117    HG   LEU  17           HG       LEU  17   8.481  -8.548  -4.495
  118   1HD1  LEU  17          2HD12     LEU  17   6.055  -6.687  -4.611
  119   2HD1  LEU  17          1HD11     LEU  17   6.583  -7.766  -5.919
  120   3HD1  LEU  17          3HD13     LEU  17   6.018  -8.450  -4.397
  121   1HD2  LEU  17          1HD21     LEU  17   9.798  -6.463  -4.704
  122   2HD2  LEU  17          3HD23     LEU  17   8.764  -6.726  -6.121
  123   3HD2  LEU  17          2HD22     LEU  17   8.297  -5.531  -4.896
  124    H    ALA  18           HN       ALA  18   8.829  -9.683  -0.283
  125    HA   ALA  18           HA       ALA  18   8.776 -12.123  -2.011
  126   1HB   ALA  18          3HB       ALA  18  10.991 -11.202  -1.497
  127   2HB   ALA  18          2HB       ALA  18  10.653 -11.296   0.242
  128   3HB   ALA  18          1HB       ALA  18  10.750 -12.782  -0.725
  129    H    LYS  19           HN       LYS  19   8.627 -11.180   1.504
  130    HA   LYS  19           HA       LYS  19   7.837 -13.853   2.232
  131   1HB   LYS  19          1HB       LYS  19   7.631 -13.078   4.455
  132   2HB   LYS  19          2HB       LYS  19   9.082 -12.379   3.745
  133   1HG   LYS  19          1HG       LYS  19   8.036 -10.259   3.465
  134   2HG   LYS  19          2HG       LYS  19   6.449 -10.823   3.980
  135   1HD   LYS  19          2HD       LYS  19   8.858 -11.017   5.832
  136   2HD   LYS  19          1HD       LYS  19   8.050  -9.468   5.581
  137   1HE   LYS  19          2HE       LYS  19   7.165 -10.517   7.572
  138   2HE   LYS  19          1HE       LYS  19   5.905 -10.357   6.342
  139   1HZ   LYS  19          1HZ       LYS  19   7.416 -12.814   6.916
  140   2HZ   LYS  19          2HZ       LYS  19   5.888 -12.488   7.439
  141   3HZ   LYS  19          3HZ       LYS  19   6.184 -12.659   5.829
  142    H    GLY  20           HN       GLY  20   5.820 -11.256   0.996
  143   1HA   GLY  20          1HA       GLY  20   3.425 -11.986   2.403
  144   2HA   GLY  20          2HA       GLY  20   3.545 -11.082   0.895
  145    H    LYS  21           HN       LYS  21   5.223 -13.690   0.041
  146    HA   LYS  21           HA       LYS  21   4.948 -15.607  -1.084
  147   1HB   LYS  21          2HB       LYS  21   2.265 -15.936   0.340
  148   2HB   LYS  21          1HB       LYS  21   3.167 -17.176  -0.512
  149   1HG   LYS  21          2HG       LYS  21   3.979 -15.736   2.046
  150   2HG   LYS  21          1HG       LYS  21   3.478 -17.418   1.888
  151   1HD   LYS  21          2HD       LYS  21   6.059 -16.170   0.828
  152   2HD   LYS  21          1HD       LYS  21   5.882 -17.272   2.189
  153   1HE   LYS  21          2HE       LYS  21   5.049 -19.058   0.649
  154   2HE   LYS  21          1HE       LYS  21   5.303 -17.976  -0.732
  155   1HZ   LYS  21          3HZ       LYS  21   7.610 -17.884  -0.179
  156   2HZ   LYS  21          1HZ       LYS  21   7.389 -18.907   1.096
  157   3HZ   LYS  21          2HZ       LYS  21   7.125 -19.435  -0.443
  158    H    GLU  22           HN       GLU  22   4.706 -13.573  -2.425
  159    HA   GLU  22           HA       GLU  22   2.392 -12.933  -3.921
  160   1HB   GLU  22          1HB       GLU  22   5.387 -12.463  -4.315
  161   2HB   GLU  22          2HB       GLU  22   4.141 -11.843  -5.387
  162   1HG   GLU  22          1HG       GLU  22   4.607 -10.089  -3.934
  163   2HG   GLU  22          2HG       GLU  22   3.025 -10.712  -3.449
  164    H    GLU  23           HN       GLU  23   1.977 -15.311  -4.136
  165    HA   GLU  23           HA       GLU  23   2.796 -16.288  -6.835
  166   1HB   GLU  23          1HB       GLU  23   2.014 -17.967  -4.426
  167   2HB   GLU  23          2HB       GLU  23   2.350 -18.461  -6.109
  168   1HG   GLU  23          1HG       GLU  23   4.691 -17.691  -5.889
  169   2HG   GLU  23          2HG       GLU  23   4.363 -17.046  -4.273
  170    H    HIS  24           HN       HIS  24   1.287 -15.320  -7.752
  171    HA   HIS  24           HA       HIS  24  -0.685 -14.905  -8.870
  172   1HB   HIS  24          1HB       HIS  24  -0.850 -17.408  -8.727
  173   2HB   HIS  24          2HB       HIS  24  -1.909 -17.224  -7.327
  174    HD2  HIS  24           HD2      HIS  24  -3.521 -14.542  -8.938
  175    HE1  HIS  24           HE1      HIS  24  -4.712 -17.715 -11.447
  176    HE2  HIS  24           HE2      HIS  24  -5.183 -15.282 -10.767
  177    H    LYS  25           HN       LYS  25  -0.532 -12.880  -7.501
  178    HA   LYS  25           HA       LYS  25  -3.096 -12.289  -6.414
  179   1HB   LYS  25          1HB       LYS  25  -2.341 -11.795  -4.054
  180   2HB   LYS  25          2HB       LYS  25  -2.521 -13.490  -4.453
  181   1HG   LYS  25          2HG       LYS  25   0.040 -13.521  -4.864
  182   2HG   LYS  25          1HG       LYS  25   0.056 -11.889  -4.183
  183   1HD   LYS  25          2HD       LYS  25   0.643 -13.500  -2.486
  184   2HD   LYS  25          1HD       LYS  25  -0.901 -12.815  -2.053
  185   1HE   LYS  25          1HE       LYS  25  -2.111 -14.798  -2.719
  186   2HE   LYS  25          2HE       LYS  25  -0.714 -15.424  -3.598
  187   1HZ   LYS  25          2HZ       LYS  25   0.418 -15.668  -1.532
  188   2HZ   LYS  25          3HZ       LYS  25  -0.895 -15.114  -0.692
  189   3HZ   LYS  25          1HZ       LYS  25  -0.989 -16.525  -1.541
  190    HA   PRO  26           HA       PRO  26  -1.422  -8.268  -7.198
  191   1HB   PRO  26          1HB       PRO  26  -3.322  -6.607  -6.301
  192   2HB   PRO  26          2HB       PRO  26  -3.661  -7.804  -7.589
  193   1HG   PRO  26          1HG       PRO  26  -4.108  -8.148  -4.627
  194   2HG   PRO  26          2HG       PRO  26  -5.369  -8.287  -5.867
  195   1HD   PRO  26          2HD       PRO  26  -4.013 -10.466  -4.923
  196   2HD   PRO  26          1HD       PRO  26  -4.330 -10.335  -6.676
  197    H    ILE  27           HN       ILE  27   0.096  -6.976  -6.432
  198    HA   ILE  27           HA       ILE  27   0.249  -6.453  -3.523
  199    HB   ILE  27           HB       ILE  27   2.417  -6.144  -5.649
  200   1HG1  ILE  27          2HG12     ILE  27   3.499  -7.938  -4.038
  201   2HG1  ILE  27          1HG11     ILE  27   1.821  -8.363  -3.688
  202   1HG2  ILE  27          2HG22     ILE  27   2.494  -5.800  -2.628
  203   2HG2  ILE  27          3HG23     ILE  27   3.883  -5.693  -3.727
  204   3HG2  ILE  27          1HG21     ILE  27   2.592  -4.498  -3.827
  205   1HD1  ILE  27          2HD12     ILE  27   3.098  -8.283  -6.455
  206   2HD1  ILE  27          1HD11     ILE  27   2.831  -9.744  -5.502
  207   3HD1  ILE  27          3HD13     ILE  27   1.447  -8.843  -6.084
  208    H    VAL  28           HN       VAL  28  -0.971  -4.752  -3.142
  209    HA   VAL  28           HA       VAL  28  -1.269  -2.613  -5.191
  210    HB   VAL  28           HB       VAL  28  -2.826  -3.105  -2.622
  211   1HG1  VAL  28          3HG13     VAL  28  -2.748  -0.725  -3.410
  212   2HG1  VAL  28          1HG11     VAL  28  -3.303  -1.245  -5.008
  213   3HG1  VAL  28          2HG12     VAL  28  -4.368  -1.428  -3.600
  214   1HG2  VAL  28          3HG23     VAL  28  -3.196  -4.895  -4.375
  215   2HG2  VAL  28          1HG21     VAL  28  -4.623  -3.921  -4.025
  216   3HG2  VAL  28          2HG22     VAL  28  -3.686  -3.618  -5.503
  217    H    VAL  29           HN       VAL  29   0.330  -1.144  -4.956
  218    HA   VAL  29           HA       VAL  29   1.297  -0.575  -2.177
  219    HB   VAL  29           HB       VAL  29   2.930  -1.762  -3.463
  220   1HG1  VAL  29          1HG11     VAL  29   2.377  -0.880  -5.750
  221   2HG1  VAL  29          3HG13     VAL  29   3.128   0.663  -5.290
  222   3HG1  VAL  29          2HG12     VAL  29   4.097  -0.819  -5.337
  223   1HG2  VAL  29          3HG23     VAL  29   3.440  -0.022  -1.676
  224   2HG2  VAL  29          2HG22     VAL  29   4.741  -0.363  -2.812
  225   3HG2  VAL  29          1HG21     VAL  29   3.769   1.116  -2.992
  226    H    ASP  30           HN       ASP  30   0.865   1.296  -1.400
  227    HA   ASP  30           HA       ASP  30  -0.128   3.508  -3.071
  228   1HB   ASP  30          2HB       ASP  30  -1.275   2.877  -1.011
  229   2HB   ASP  30          1HB       ASP  30   0.160   3.168  -0.059
  230    H    PHE  31           HN       PHE  31   1.511   4.534  -4.123
  231    HA   PHE  31           HA       PHE  31   4.004   5.307  -2.696
  232   1HB   PHE  31          1HB       PHE  31   2.965   5.871  -5.483
  233   2HB   PHE  31          2HB       PHE  31   4.394   6.613  -4.801
  234    HD1  PHE  31           HD2      PHE  31   2.976   3.421  -6.062
  235    HD2  PHE  31           HD1      PHE  31   6.488   5.427  -4.560
  236    HE1  PHE  31           HE2      PHE  31   4.439   1.827  -7.283
  237    HE2  PHE  31           HE1      PHE  31   7.923   3.834  -5.753
  238    HZ   PHE  31           HZ       PHE  31   6.912   2.061  -7.175
  239    H    THR  32           HN       THR  32   3.889   6.983  -1.315
  240    HA   THR  32           HA       THR  32   2.207   9.338  -1.933
  241    HB   THR  32           HB       THR  32   1.883   7.387   0.353
  242    HG1  THR  32           HG1      THR  32   0.294   7.345  -1.192
  243   1HG2  THR  32          1HG21     THR  32   1.236  10.354   0.561
  244   2HG2  THR  32          3HG23     THR  32   0.595   9.092   1.624
  245   3HG2  THR  32          2HG22     THR  32   2.330   9.428   1.617
  246    H    ALA  33           HN       ALA  33   2.821  11.151  -0.496
  247    HA   ALA  33           HA       ALA  33   5.688  11.053   0.339
  248   1HB   ALA  33          1HB       ALA  33   5.222  12.456  -1.738
  249   2HB   ALA  33          2HB       ALA  33   4.151  13.455  -0.749
  250   3HB   ALA  33          3HB       ALA  33   5.865  13.335  -0.344
  251    H    THR  34           HN       THR  34   6.166  12.646   2.039
  252    HA   THR  34           HA       THR  34   4.199  12.501   4.207
  253    HB   THR  34           HB       THR  34   6.017  13.749   5.434
  254    HG1  THR  34           HG1      THR  34   7.568  13.328   3.089
  255   1HG2  THR  34          1HG21     THR  34   5.936  11.267   5.418
  256   2HG2  THR  34          3HG23     THR  34   6.916  11.231   3.938
  257   3HG2  THR  34          2HG22     THR  34   7.608  11.858   5.449
  258    H    TRP  35           HN       TRP  35   5.981  15.123   2.670
  259    HA   TRP  35           HA       TRP  35   4.722  17.332   3.673
  260   1HB   TRP  35          1HB       TRP  35   5.478  18.504   1.597
  261   2HB   TRP  35          2HB       TRP  35   6.704  17.538   2.407
  262    HD1  TRP  35           HD1      TRP  35   7.811  15.543   1.089
  263    HE1  TRP  35           HE1      TRP  35   7.732  14.737  -1.302
  264    HE3  TRP  35           HE3      TRP  35   3.800  18.305  -0.578
  265    HZ2  TRP  35           HZ2      TRP  35   6.149  15.189  -3.672
  266    HZ3  TRP  35           HZ3      TRP  35   3.020  18.049  -2.912
  267    HH2  TRP  35           HH2      TRP  35   4.166  16.481  -4.461
  268    H    CYS  36           HN       CYS  36   3.314  15.280   1.113
  269    HA   CYS  36           HA       CYS  36   1.272  17.281   0.451
  270   1HB   CYS  36          1HB       CYS  36   0.327  15.648  -0.996
  271   2HB   CYS  36          2HB       CYS  36   2.065  15.705  -1.237
  272    H    GLY  37           HN       GLY  37   1.128  17.224   3.054
  273   1HA   GLY  37          1HA       GLY  37   0.076  15.802   4.872
  274   2HA   GLY  37          2HA       GLY  37  -0.738  17.327   4.504
  275    HA   PRO  38           HA       PRO  38  -4.666  15.608   3.580
  276   1HB   PRO  38          2HB       PRO  38  -4.131  16.012   0.617
  277   2HB   PRO  38          1HB       PRO  38  -5.651  16.309   1.515
  278   1HG   PRO  38          2HG       PRO  38  -4.010  18.393   1.011
  279   2HG   PRO  38          1HG       PRO  38  -4.662  18.191   2.665
  280   1HD   PRO  38          2HD       PRO  38  -1.930  17.441   1.627
  281   2HD   PRO  38          1HD       PRO  38  -2.369  18.234   3.167
  282    H    CYS  39           HN       CYS  39  -2.167  14.363   1.393
  283    HA   CYS  39           HA       CYS  39  -3.169  11.998   0.403
  284   1HB   CYS  39          1HB       CYS  39  -0.426  12.551   1.602
  285   2HB   CYS  39          2HB       CYS  39  -0.862  11.102   0.708
  286    H    LYS  40           HN       LYS  40  -1.936  12.669   3.684
  287    HA   LYS  40           HA       LYS  40  -1.769  10.023   4.637
  288   1HB   LYS  40          1HB       LYS  40  -0.816  12.195   5.562
  289   2HB   LYS  40          2HB       LYS  40  -2.405  12.507   6.286
  290   1HG   LYS  40          1HG       LYS  40  -2.213  10.344   7.532
  291   2HG   LYS  40          2HG       LYS  40  -0.630  10.063   6.796
  292   1HD   LYS  40          2HD       LYS  40  -1.364  12.397   8.626
  293   2HD   LYS  40          1HD       LYS  40  -0.471  10.943   9.099
  294   1HE   LYS  40          2HE       LYS  40   1.324  11.562   7.406
  295   2HE   LYS  40          1HE       LYS  40   0.464  13.093   7.140
  296   1HZ   LYS  40          1HZ       LYS  40   0.741  13.594   9.443
  297   2HZ   LYS  40          2HZ       LYS  40   1.548  12.180   9.701
  298   3HZ   LYS  40          3HZ       LYS  40   2.197  13.333   8.719
  299    H    MET  41           HN       MET  41  -4.620  12.065   4.196
  300    HA   MET  41           HA       MET  41  -6.322  10.616   6.085
  301   1HB   MET  41          2HB       MET  41  -7.031  12.374   3.682
  302   2HB   MET  41          1HB       MET  41  -8.131  11.847   4.961
  303   1HG   MET  41          2HG       MET  41  -6.853  13.115   6.635
  304   2HG   MET  41          1HG       MET  41  -5.671  13.593   5.416
  305   1HE   MET  41          2HE       MET  41  -9.305  13.948   6.682
  306   2HE   MET  41          3HE       MET  41  -9.965  15.231   5.640
  307   3HE   MET  41          1HE       MET  41  -9.677  13.611   4.970
  308    H    ILE  42           HN       ILE  42  -5.140   9.875   2.872
  309    HA   ILE  42           HA       ILE  42  -7.405   8.062   2.348
  310    HB   ILE  42           HB       ILE  42  -4.772   8.519   0.878
  311   1HG1  ILE  42          1HG11     ILE  42  -6.532   9.290  -0.877
  312   2HG1  ILE  42          2HG12     ILE  42  -7.666   9.426   0.466
  313   1HG2  ILE  42          3HG23     ILE  42  -7.156   6.734   0.256
  314   2HG2  ILE  42          1HG21     ILE  42  -5.877   7.151  -0.902
  315   3HG2  ILE  42          2HG22     ILE  42  -5.479   6.220   0.543
  316   1HD1  ILE  42          3HD13     ILE  42  -4.997  10.853   0.161
  317   2HD1  ILE  42          1HD11     ILE  42  -6.581  11.577  -0.151
  318   3HD1  ILE  42          2HD12     ILE  42  -6.142  11.151   1.490
  319    H    ALA  43           HN       ALA  43  -4.227   7.986   3.876
  320    HA   ALA  43           HA       ALA  43  -3.600   5.292   3.754
  321   1HB   ALA  43          3HB       ALA  43  -2.152   7.031   4.742
  322   2HB   ALA  43          1HB       ALA  43  -3.182   7.087   6.186
  323   3HB   ALA  43          2HB       ALA  43  -2.315   5.603   5.781
  324    HA   PRO  44           HA       PRO  44  -6.256   4.138   7.593
  325   1HB   PRO  44          1HB       PRO  44  -8.477   5.662   8.222
  326   2HB   PRO  44          2HB       PRO  44  -6.871   5.851   8.979
  327   1HG   PRO  44          1HG       PRO  44  -8.008   7.424   6.651
  328   2HG   PRO  44          2HG       PRO  44  -7.217   8.061   8.122
  329   1HD   PRO  44          1HD       PRO  44  -5.811   7.784   5.873
  330   2HD   PRO  44          2HD       PRO  44  -5.079   7.281   7.414
  331    H    LEU  45           HN       LEU  45  -7.977   5.900   5.018
  332    HA   LEU  45           HA       LEU  45 -10.168   4.059   4.715
  333   1HB   LEU  45          2HB       LEU  45  -8.879   6.219   3.098
  334   2HB   LEU  45          1HB       LEU  45  -9.664   4.983   2.136
  335    HG   LEU  45           HG       LEU  45 -11.040   7.001   2.684
  336   1HD1  LEU  45          1HD11     LEU  45 -12.062   4.915   1.920
  337   2HD1  LEU  45          3HD13     LEU  45 -12.190   4.333   3.594
  338   3HD1  LEU  45          2HD12     LEU  45 -13.107   5.762   3.073
  339   1HD2  LEU  45          3HD23     LEU  45 -10.305   7.263   5.060
  340   2HD2  LEU  45          1HD21     LEU  45 -12.068   7.259   4.853
  341   3HD2  LEU  45          2HD22     LEU  45 -11.257   5.826   5.495
  342    H    PHE  46           HN       PHE  46  -7.081   4.240   2.986
  343    HA   PHE  46           HA       PHE  46  -7.314   1.861   1.466
  344   1HB   PHE  46          2HB       PHE  46  -5.654   3.608   1.030
  345   2HB   PHE  46          1HB       PHE  46  -4.930   3.374   2.611
  346    HD1  PHE  46           HD1      PHE  46  -5.757   1.307  -0.450
  347    HD2  PHE  46           HD2      PHE  46  -2.855   2.285   2.591
  348    HE1  PHE  46           HE1      PHE  46  -4.050  -0.034  -1.632
  349    HE2  PHE  46           HE2      PHE  46  -1.162   0.920   1.410
  350    HZ   PHE  46           HZ       PHE  46  -1.753  -0.284  -0.672
  351    H    GLU  47           HN       GLU  47  -5.943   2.398   4.765
  352    HA   GLU  47           HA       GLU  47  -5.130  -0.261   5.240
  353   1HB   GLU  47          2HB       GLU  47  -4.493   1.746   6.556
  354   2HB   GLU  47          1HB       GLU  47  -6.126   1.803   7.243
  355   1HG   GLU  47          1HG       GLU  47  -5.780  -0.380   8.317
  356   2HG   GLU  47          2HG       GLU  47  -4.220  -0.567   7.493
  357    H    THR  48           HN       THR  48  -8.293   1.343   5.795
  358    HA   THR  48           HA       THR  48  -9.590  -0.833   7.104
  359    HB   THR  48           HB       THR  48 -10.813   1.263   5.242
  360    HG1  THR  48           HG1      THR  48  -9.605   2.180   6.965
  361   1HG2  THR  48          2HG22     THR  48 -12.026  -0.351   7.518
  362   2HG2  THR  48          3HG23     THR  48 -12.824   0.952   6.615
  363   3HG2  THR  48          1HG21     THR  48 -12.392  -0.554   5.785
  364    H    LEU  49           HN       LEU  49  -9.380   0.084   3.620
  365    HA   LEU  49           HA       LEU  49 -10.727  -2.214   2.626
  366   1HB   LEU  49          1HB       LEU  49 -10.103  -0.074   1.372
  367   2HB   LEU  49          2HB       LEU  49  -8.449  -0.694   1.280
  368    HG   LEU  49           HG       LEU  49  -9.371  -2.696   0.030
  369   1HD1  LEU  49          1HD21     LEU  49 -11.904  -1.015   0.317
  370   2HD1  LEU  49          2HD22     LEU  49 -11.704  -2.182  -1.001
  371   3HD1  LEU  49          3HD23     LEU  49 -11.688  -2.738   0.679
  372   1HD2  LEU  49          3HD13     LEU  49  -8.327  -0.765  -1.084
  373   2HD2  LEU  49          1HD11     LEU  49  -9.650  -1.432  -2.055
  374   3HD2  LEU  49          2HD12     LEU  49  -9.889   0.073  -1.138
  375    H    SER  50           HN       SER  50  -7.332  -1.635   3.504
  376    HA   SER  50           HA       SER  50  -6.234  -3.964   2.425
  377   1HB   SER  50          1HB       SER  50  -5.308  -2.582   4.958
  378   2HB   SER  50          2HB       SER  50  -4.395  -3.676   3.927
  379    HG   SER  50           HG       SER  50  -5.477  -1.307   2.859
  380    H    ASN  51           HN       ASN  51  -7.715  -3.409   5.594
  381    HA   ASN  51           HA       ASN  51  -7.222  -6.025   6.666
  382   1HB   ASN  51          1HB       ASN  51  -9.348  -3.923   7.238
  383   2HB   ASN  51          2HB       ASN  51  -9.359  -5.510   8.006
  384   1HD2  ASN  51          2HD22     ASN  51  -6.341  -2.915   9.048
  385   2HD2  ASN  51          1HD21     ASN  51  -7.150  -2.655   7.508
  386    H    ASP  52           HN       ASP  52  -9.992  -4.700   4.797
  387    HA   ASP  52           HA       ASP  52 -11.711  -6.851   4.832
  388   1HB   ASP  52          1HB       ASP  52 -12.209  -4.674   3.774
  389   2HB   ASP  52          2HB       ASP  52 -11.143  -5.074   2.419
  390    H    TYR  53           HN       TYR  53  -9.058  -6.470   2.386
  391    HA   TYR  53           HA       TYR  53  -9.517  -9.350   1.618
  392   1HB   TYR  53          2HB       TYR  53  -7.825  -7.345   0.141
  393   2HB   TYR  53          1HB       TYR  53  -8.359  -8.922  -0.385
  394    HD1  TYR  53           HD1      TYR  53  -9.533  -5.472   0.423
  395    HD2  TYR  53           HD2      TYR  53 -10.169  -9.078  -1.842
  396    HE1  TYR  53           HE1      TYR  53 -10.788  -4.204  -1.257
  397    HE2  TYR  53           HE2      TYR  53 -11.490  -7.799  -3.485
  398    HH   TYR  53           HH       TYR  53 -12.150  -4.302  -3.119
  399    H    ALA  54           HN       ALA  54  -8.066  -8.640   4.143
  400    HA   ALA  54           HA       ALA  54  -5.254  -8.765   3.645
  401   1HB   ALA  54          3HB       ALA  54  -6.870  -9.461   6.134
  402   2HB   ALA  54          2HB       ALA  54  -5.110  -9.213   6.076
  403   3HB   ALA  54          1HB       ALA  54  -6.203  -7.873   5.703
  404    H    GLY  55           HN       GLY  55  -5.481 -10.621   1.991
  405   1HA   GLY  55          1HA       GLY  55  -4.541 -13.119   3.257
  406   2HA   GLY  55          2HA       GLY  55  -6.061 -13.249   2.350
  407    H    LYS  56           HN       LYS  56  -6.006 -12.460   0.032
  408    HA   LYS  56           HA       LYS  56  -3.566 -13.354  -1.324
  409   1HB   LYS  56          2HB       LYS  56  -6.150 -12.080  -2.335
  410   2HB   LYS  56          1HB       LYS  56  -4.740 -12.436  -3.341
  411   1HG   LYS  56          2HG       LYS  56  -4.911 -14.845  -2.785
  412   2HG   LYS  56          1HG       LYS  56  -6.359 -14.496  -1.826
  413   1HD   LYS  56          2HD       LYS  56  -7.071 -15.276  -3.986
  414   2HD   LYS  56          1HD       LYS  56  -7.453 -13.553  -3.900
  415   1HE   LYS  56          1HE       LYS  56  -5.448 -13.037  -5.303
  416   2HE   LYS  56          2HE       LYS  56  -5.026 -14.760  -5.330
  417   1HZ   LYS  56          3HZ       LYS  56  -7.470 -13.545  -6.416
  418   2HZ   LYS  56          1HZ       LYS  56  -6.183 -14.019  -7.306
  419   3HZ   LYS  56          2HZ       LYS  56  -7.075 -15.146  -6.498
  420    H    VAL  57           HN       VAL  57  -5.317 -10.220  -0.825
  421    HA   VAL  57           HA       VAL  57  -3.455  -8.902  -2.568
  422    HB   VAL  57           HB       VAL  57  -5.484  -7.749  -0.655
  423   1HG1  VAL  57          1HG11     VAL  57  -4.101  -6.602  -3.127
  424   2HG1  VAL  57          3HG13     VAL  57  -5.464  -5.829  -2.317
  425   3HG1  VAL  57          2HG12     VAL  57  -3.926  -6.026  -1.471
  426   1HG2  VAL  57          3HG23     VAL  57  -5.926  -8.627  -3.516
  427   2HG2  VAL  57          2HG22     VAL  57  -6.687  -9.273  -2.063
  428   3HG2  VAL  57          1HG21     VAL  57  -7.029  -7.619  -2.565
  429    H    ILE  58           HN       ILE  58  -1.558  -8.017  -2.118
  430    HA   ILE  58           HA       ILE  58  -0.639  -7.811   0.719
  431    HB   ILE  58           HB       ILE  58   0.939  -7.347  -1.827
  432   1HG1  ILE  58          1HG11     ILE  58   0.150  -9.560  -2.134
  433   2HG1  ILE  58          2HG12     ILE  58   1.821  -9.641  -1.596
  434   1HG2  ILE  58          1HG21     ILE  58   1.762  -6.665   0.586
  435   2HG2  ILE  58          2HG22     ILE  58   2.241  -8.378   0.641
  436   3HG2  ILE  58          3HG23     ILE  58   2.843  -7.351  -0.640
  437   1HD1  ILE  58          2HD12     ILE  58   1.063 -10.251   0.697
  438   2HD1  ILE  58          3HD13     ILE  58  -0.623 -10.179   0.132
  439   3HD1  ILE  58          1HD11     ILE  58   0.500 -11.364  -0.558
  440    H    PHE  59           HN       PHE  59  -0.989  -5.788   1.667
  441    HA   PHE  59           HA       PHE  59  -1.506  -3.452  -0.153
  442   1HB   PHE  59          2HB       PHE  59  -2.472  -3.995   2.643
  443   2HB   PHE  59          1HB       PHE  59  -2.664  -2.486   1.770
  444    HD1  PHE  59           HD2      PHE  59  -3.728  -6.039   1.928
  445    HD2  PHE  59           HD1      PHE  59  -4.227  -2.251  -0.075
  446    HE1  PHE  59           HE2      PHE  59  -5.987  -6.694   1.252
  447    HE2  PHE  59           HE1      PHE  59  -6.419  -3.006  -0.953
  448    HZ   PHE  59           HZ       PHE  59  -7.319  -5.215  -0.288
  449    H    LEU  60           HN       LEU  60   0.383  -2.512  -0.384
  450    HA   LEU  60           HA       LEU  60   2.114  -2.010   2.017
  451   1HB   LEU  60          1HB       LEU  60   2.801  -2.213  -0.943
  452   2HB   LEU  60          2HB       LEU  60   3.957  -1.918   0.378
  453    HG   LEU  60           HG       LEU  60   2.343  -4.440  -0.199
  454   1HD1  LEU  60          2HD22     LEU  60   4.349  -4.036  -1.607
  455   2HD1  LEU  60          3HD23     LEU  60   5.347  -3.920  -0.143
  456   3HD1  LEU  60          1HD21     LEU  60   4.549  -5.450  -0.558
  457   1HD2  LEU  60          1HD11     LEU  60   4.225  -3.894   2.143
  458   2HD2  LEU  60          2HD12     LEU  60   2.474  -4.187   2.263
  459   3HD2  LEU  60          3HD13     LEU  60   3.524  -5.470   1.704
  460    H    LYS  61           HN       LYS  61   3.331  -0.039   1.920
  461    HA   LYS  61           HA       LYS  61   2.284   2.116   0.225
  462   1HB   LYS  61          1HB       LYS  61   0.988   2.291   2.308
  463   2HB   LYS  61          2HB       LYS  61   2.472   2.222   3.263
  464   1HG   LYS  61          2HG       LYS  61   3.220   4.367   2.247
  465   2HG   LYS  61          1HG       LYS  61   1.725   4.430   1.284
  466   1HD   LYS  61          2HD       LYS  61   0.407   4.406   3.405
  467   2HD   LYS  61          1HD       LYS  61   1.932   4.442   4.323
  468   1HE   LYS  61          1HE       LYS  61   0.902   6.574   2.392
  469   2HE   LYS  61          2HE       LYS  61   0.938   6.689   4.157
  470   1HZ   LYS  61          1HZ       LYS  61   3.331   6.518   4.056
  471   2HZ   LYS  61          3HZ       LYS  61   3.290   6.489   2.409
  472   3HZ   LYS  61          2HZ       LYS  61   2.782   7.829   3.220
  473    H    VAL  62           HN       VAL  62   3.941   3.729  -0.104
  474    HA   VAL  62           HA       VAL  62   6.616   3.122   1.017
  475    HB   VAL  62           HB       VAL  62   6.525   1.763  -0.975
  476   1HG1  VAL  62          2HG22     VAL  62   4.706   3.024  -2.187
  477   2HG1  VAL  62          3HG23     VAL  62   5.921   4.274  -2.536
  478   3HG1  VAL  62          1HG21     VAL  62   6.112   2.633  -3.189
  479   1HG2  VAL  62          1HG11     VAL  62   8.665   2.934  -0.549
  480   2HG2  VAL  62          3HG13     VAL  62   8.388   2.675  -2.280
  481   3HG2  VAL  62          2HG12     VAL  62   8.143   4.283  -1.587
  482    H    ASP  63           HN       ASP  63   7.828   4.937   1.294
  483    HA   ASP  63           HA       ASP  63   6.394   7.510   0.922
  484   1HB   ASP  63          1HB       ASP  63   7.296   7.250   3.101
  485   2HB   ASP  63          2HB       ASP  63   8.880   6.751   2.452
  486    H    VAL  64           HN       VAL  64   6.706   8.445  -1.036
  487    HA   VAL  64           HA       VAL  64   8.870   7.762  -2.784
  488    HB   VAL  64           HB       VAL  64   8.139   9.656  -4.154
  489   1HG1  VAL  64          3HG13     VAL  64   6.829   7.610  -4.283
  490   2HG1  VAL  64          2HG12     VAL  64   5.759   8.156  -2.974
  491   3HG1  VAL  64          1HG11     VAL  64   5.801   9.029  -4.515
  492   1HG2  VAL  64          2HG22     VAL  64   6.504  10.474  -1.740
  493   2HG2  VAL  64          3HG23     VAL  64   7.752  11.415  -2.577
  494   3HG2  VAL  64          1HG21     VAL  64   6.219  11.072  -3.377
  495    H    ASP  65           HN       ASP  65   8.606  10.168  -0.197
  496    HA   ASP  65           HA       ASP  65  10.693  11.923  -1.083
  497   1HB   ASP  65          2HB       ASP  65   9.792  11.367   1.762
  498   2HB   ASP  65          1HB       ASP  65  10.740  12.737   1.181
  499    H    ALA  66           HN       ALA  66  10.694   9.227   1.314
  500    HA   ALA  66           HA       ALA  66  13.541   9.083   1.551
  501   1HB   ALA  66          1HB       ALA  66  11.363   7.020   2.137
  502   2HB   ALA  66          2HB       ALA  66  13.056   6.913   2.661
  503   3HB   ALA  66          3HB       ALA  66  12.022   8.219   3.270
  504    H    VAL  67           HN       VAL  67  11.228   6.868  -0.180
  505    HA   VAL  67           HA       VAL  67  13.527   5.540  -1.458
  506    HB   VAL  67           HB       VAL  67  10.597   4.890  -1.904
  507   1HG1  VAL  67          1HG21     VAL  67  12.472   3.873  -3.301
  508   2HG1  VAL  67          2HG22     VAL  67  13.133   3.181  -1.826
  509   3HG1  VAL  67          3HG23     VAL  67  11.520   2.681  -2.385
  510   1HG2  VAL  67          2HG12     VAL  67  12.396   4.010   0.397
  511   2HG2  VAL  67          3HG13     VAL  67  10.816   4.824   0.518
  512   3HG2  VAL  67          1HG11     VAL  67  10.914   3.167  -0.089
  513    H    ALA  68           HN       ALA  68  13.793   7.928  -2.280
  514    HA   ALA  68           HA       ALA  68  12.348   8.984  -4.421
  515   1HB   ALA  68          3HB       ALA  68  14.166  10.161  -3.259
  516   2HB   ALA  68          2HB       ALA  68  15.365   9.050  -3.958
  517   3HB   ALA  68          1HB       ALA  68  14.448  10.147  -5.012
  518    H    ALA  69           HN       ALA  69  15.058   6.649  -4.571
  519    HA   ALA  69           HA       ALA  69  15.375   6.430  -7.324
  520   1HB   ALA  69          3HB       ALA  69  15.621   4.241  -5.211
  521   2HB   ALA  69          1HB       ALA  69  16.317   4.195  -6.845
  522   3HB   ALA  69          2HB       ALA  69  16.878   5.408  -5.678
  523    H    VAL  70           HN       VAL  70  13.223   4.362  -5.285
  524    HA   VAL  70           HA       VAL  70  12.195   2.899  -7.554
  525    HB   VAL  70           HB       VAL  70  10.967   3.261  -4.792
  526   1HG1  VAL  70          1HG21     VAL  70   9.391   2.306  -6.485
  527   2HG1  VAL  70          3HG23     VAL  70  10.562   1.016  -6.803
  528   3HG1  VAL  70          2HG22     VAL  70   9.818   1.175  -5.197
  529   1HG2  VAL  70          1HG11     VAL  70  12.841   1.120  -5.919
  530   2HG2  VAL  70          2HG12     VAL  70  13.289   2.295  -4.675
  531   3HG2  VAL  70          3HG13     VAL  70  12.051   1.069  -4.329
  532    H    ALA  71           HN       ALA  71  11.045   5.702  -5.636
  533    HA   ALA  71           HA       ALA  71   8.549   6.027  -6.884
  534   1HB   ALA  71          2HB       ALA  71   9.284   7.257  -4.897
  535   2HB   ALA  71          3HB       ALA  71  10.414   8.219  -5.869
  536   3HB   ALA  71          1HB       ALA  71   8.667   8.361  -6.147
  537    H    GLU  72           HN       GLU  72  11.698   7.544  -7.878
  538    HA   GLU  72           HA       GLU  72  10.496   8.792 -10.192
  539   1HB   GLU  72          1HB       GLU  72  12.687   9.472 -10.810
  540   2HB   GLU  72          2HB       GLU  72  12.507   9.663  -9.063
  541   1HG   GLU  72          2HG       GLU  72  13.756   7.465  -8.806
  542   2HG   GLU  72          1HG       GLU  72  14.095   7.518 -10.539
  543    H    ALA  73           HN       ALA  73  12.357   5.713  -9.720
  544    HA   ALA  73           HA       ALA  73  12.480   4.972 -12.443
  545   1HB   ALA  73          3HB       ALA  73  13.675   3.783 -10.644
  546   2HB   ALA  73          1HB       ALA  73  12.130   3.195  -9.986
  547   3HB   ALA  73          2HB       ALA  73  12.676   2.664 -11.590
  548    H    ALA  74           HN       ALA  74   9.870   4.505 -10.043
  549    HA   ALA  74           HA       ALA  74   8.092   3.151 -11.916
  550   1HB   ALA  74          3HB       ALA  74   8.134   2.632  -9.512
  551   2HB   ALA  74          2HB       ALA  74   7.637   4.290  -9.128
  552   3HB   ALA  74          1HB       ALA  74   6.537   3.210 -10.007
  553    H    GLY  75           HN       GLY  75   9.071   6.336 -11.873
  554   1HA   GLY  75          1HA       GLY  75   8.257   8.250 -12.750
  555   2HA   GLY  75          2HA       GLY  75   7.128   7.225 -13.658
  556    H    ILE  76           HN       ILE  76   7.353   7.772 -10.096
  557    HA   ILE  76           HA       ILE  76   4.476   8.205  -9.999
  558    HB   ILE  76           HB       ILE  76   6.609   8.596  -7.856
  559   1HG1  ILE  76          1HG11     ILE  76   6.560   6.298  -8.727
  560   2HG1  ILE  76          2HG12     ILE  76   6.016   6.412  -7.061
  561   1HG2  ILE  76          2HG22     ILE  76   3.569   8.496  -7.762
  562   2HG2  ILE  76          1HG21     ILE  76   4.586   8.253  -6.330
  563   3HG2  ILE  76          3HG23     ILE  76   4.635   9.789  -7.195
  564   1HD1  ILE  76          1HD11     ILE  76   4.229   6.075  -9.521
  565   2HD1  ILE  76          3HD13     ILE  76   4.718   4.805  -8.406
  566   3HD1  ILE  76          2HD12     ILE  76   3.681   6.114  -7.823
  567    H    THR  77           HN       THR  77   3.360  10.066  -9.813
  568    HA   THR  77           HA       THR  77   4.786  12.682  -9.615
  569    HB   THR  77           HB       THR  77   3.329  13.491 -11.495
  570    HG1  THR  77           HG1      THR  77   2.579  11.671 -12.871
  571   1HG2  THR  77          2HG22     THR  77   5.720  12.795 -11.869
  572   2HG2  THR  77          1HG21     THR  77   5.142  11.183 -12.342
  573   3HG2  THR  77          3HG23     THR  77   4.689  12.603 -13.298
  574    H    ALA  78           HN       ALA  78   1.459  11.826 -10.405
  575    HA   ALA  78           HA       ALA  78   0.373  13.690  -8.469
  576   1HB   ALA  78          3HB       ALA  78  -0.922  11.593 -10.248
  577   2HB   ALA  78          2HB       ALA  78  -1.807  12.821  -9.310
  578   3HB   ALA  78          1HB       ALA  78  -0.702  13.315 -10.610
  579    H    MET  79           HN       MET  79   1.549  12.690  -6.612
  580    HA   MET  79           HA       MET  79   0.692  10.231  -5.436
  581   1HB   MET  79          2HB       MET  79   1.749  12.707  -4.057
  582   2HB   MET  79          1HB       MET  79   1.750  11.064  -3.396
  583   1HG   MET  79          1HG       MET  79   3.636  10.499  -4.499
  584   2HG   MET  79          2HG       MET  79   3.117  11.220  -6.013
  585   1HE   MET  79          2HE       MET  79   6.006  11.307  -5.728
  586   2HE   MET  79          1HE       MET  79   5.228  12.363  -6.929
  587   3HE   MET  79          3HE       MET  79   6.469  13.020  -5.844
  588    HA   PRO  80           HA       PRO  80  -0.396   9.223  -3.301
  589   1HB   PRO  80          1HB       PRO  80  -3.343   8.696  -3.742
  590   2HB   PRO  80          2HB       PRO  80  -2.289   8.065  -2.457
  591   1HG   PRO  80          1HG       PRO  80  -3.986  10.118  -1.948
  592   2HG   PRO  80          2HG       PRO  80  -2.286  10.272  -1.396
  593   1HD   PRO  80          2HD       PRO  80  -3.515  11.346  -3.970
  594   2HD   PRO  80          1HD       PRO  80  -2.545  12.231  -2.769
  595    H    THR  81           HN       THR  81   0.303   7.572  -4.673
  596    HA   THR  81           HA       THR  81  -1.147   7.166  -7.257
  597    HB   THR  81           HB       THR  81   1.840   7.237  -6.789
  598    HG1  THR  81           HG1      THR  81   0.026   9.145  -7.557
  599   1HG2  THR  81          3HG23     THR  81   0.148   6.646  -9.265
  600   2HG2  THR  81          2HG22     THR  81   1.872   7.068  -9.331
  601   3HG2  THR  81          1HG21     THR  81   1.350   5.601  -8.483
  602    H    PHE  82           HN       PHE  82  -2.109   5.261  -7.090
  603    HA   PHE  82           HA       PHE  82  -0.994   3.141  -5.318
  604   1HB   PHE  82          1HB       PHE  82  -3.680   3.523  -6.683
  605   2HB   PHE  82          2HB       PHE  82  -3.229   2.090  -5.777
  606    HD1  PHE  82           HD1      PHE  82  -2.904   2.165  -3.317
  607    HD2  PHE  82           HD2      PHE  82  -4.188   5.653  -5.522
  608    HE1  PHE  82           HE1      PHE  82  -3.416   3.346  -1.190
  609    HE2  PHE  82           HE2      PHE  82  -4.654   6.817  -3.392
  610    HZ   PHE  82           HZ       PHE  82  -4.050   5.715  -1.221
  611    H    HIS  83           HN       HIS  83   0.228   1.573  -6.312
  612    HA   HIS  83           HA       HIS  83  -0.213   1.036  -9.253
  613   1HB   HIS  83          2HB       HIS  83   2.211   0.868  -7.516
  614   2HB   HIS  83          1HB       HIS  83   2.051  -0.073  -9.011
  615    HD2  HIS  83           HD2      HIS  83   0.716   3.515  -9.346
  616    HE1  HIS  83           HE1      HIS  83   4.505   3.325 -11.202
  617    HE2  HIS  83           HE2      HIS  83   2.430   4.752 -10.904
  618    H    VAL  84           HN       VAL  84  -0.628  -1.077  -9.849
  619    HA   VAL  84           HA       VAL  84  -1.005  -3.040  -7.628
  620    HB   VAL  84           HB       VAL  84  -2.362  -3.174 -10.340
  621   1HG1  VAL  84          2HG22     VAL  84  -2.875  -4.378  -7.580
  622   2HG1  VAL  84          3HG23     VAL  84  -3.867  -4.649  -9.019
  623   3HG1  VAL  84          1HG21     VAL  84  -2.195  -5.235  -8.975
  624   1HG2  VAL  84          2HG12     VAL  84  -3.476  -1.865  -7.838
  625   2HG2  VAL  84          1HG11     VAL  84  -3.165  -1.077  -9.408
  626   3HG2  VAL  84          3HG13     VAL  84  -4.405  -2.326  -9.282
  627    H    TYR  85           HN       TYR  85   1.007  -4.022  -7.608
  628    HA   TYR  85           HA       TYR  85   2.174  -4.980 -10.178
  629   1HB   TYR  85          1HB       TYR  85   3.197  -5.000  -7.333
  630   2HB   TYR  85          2HB       TYR  85   4.002  -5.821  -8.662
  631    HD1  TYR  85           HD2      TYR  85   3.125  -2.558  -7.191
  632    HD2  TYR  85           HD1      TYR  85   5.210  -4.553 -10.387
  633    HE1  TYR  85           HE2      TYR  85   4.163  -0.409  -7.868
  634    HE2  TYR  85           HE1      TYR  85   6.185  -2.381 -11.101
  635    HH   TYR  85           HH       TYR  85   4.919   0.679  -9.875
  636    H    LYS  86           HN       LYS  86   1.090  -6.870 -10.890
  637    HA   LYS  86           HA       LYS  86  -0.105  -8.609  -8.785
  638   1HB   LYS  86          2HB       LYS  86  -1.384  -8.044 -10.880
  639   2HB   LYS  86          1HB       LYS  86  -0.247  -9.079 -11.771
  640   1HG   LYS  86          2HG       LYS  86  -0.888 -11.004 -10.352
  641   2HG   LYS  86          1HG       LYS  86  -1.868  -9.950  -9.318
  642   1HD   LYS  86          2HD       LYS  86  -3.384  -9.450 -11.218
  643   2HD   LYS  86          1HD       LYS  86  -2.405 -10.493 -12.261
  644   1HE   LYS  86          1HE       LYS  86  -4.375 -11.717 -11.536
  645   2HE   LYS  86          2HE       LYS  86  -2.952 -12.451 -10.794
  646   1HZ   LYS  86          1HZ       LYS  86  -4.779 -10.557  -9.459
  647   2HZ   LYS  86          2HZ       LYS  86  -4.808 -12.188  -9.297
  648   3HZ   LYS  86          3HZ       LYS  86  -3.497 -11.336  -8.767
  649    H    ASP  87           HN       ASP  87   1.139 -10.058  -7.897
  650    HA   ASP  87           HA       ASP  87   2.762 -11.469  -7.338
  651   1HB   ASP  87          1HB       ASP  87   2.917 -11.918 -10.354
  652   2HB   ASP  87          2HB       ASP  87   3.927 -12.760  -9.176
  653    H    GLY  88           HN       GLY  88   3.953  -9.746 -10.165
  654   1HA   GLY  88          1HA       GLY  88   5.852  -8.146  -8.687
  655   2HA   GLY  88          2HA       GLY  88   6.669  -9.503  -9.490
  656    H    VAL  89           HN       VAL  89   3.812  -8.093 -11.105
  657    HA   VAL  89           HA       VAL  89   5.567  -6.364 -12.773
  658    HB   VAL  89           HB       VAL  89   5.481  -8.455 -13.962
  659   1HG1  VAL  89          1HG11     VAL  89   2.438  -8.336 -13.794
  660   2HG1  VAL  89          3HG13     VAL  89   3.383  -9.454 -14.789
  661   3HG1  VAL  89          2HG12     VAL  89   3.505  -9.539 -13.033
  662   1HG2  VAL  89          2HG22     VAL  89   5.317  -6.334 -15.246
  663   2HG2  VAL  89          3HG23     VAL  89   4.559  -7.706 -16.073
  664   3HG2  VAL  89          1HG21     VAL  89   3.545  -6.497 -15.267
  665    H    LYS  90           HN       LYS  90   4.613  -4.456 -13.314
  666    HA   LYS  90           HA       LYS  90   2.342  -3.595 -11.830
  667   1HB   LYS  90          1HB       LYS  90   4.273  -2.181 -12.692
  668   2HB   LYS  90          2HB       LYS  90   3.485  -2.222 -14.274
  669   1HG   LYS  90          1HG       LYS  90   1.400  -1.262 -13.169
  670   2HG   LYS  90          2HG       LYS  90   2.263  -1.251 -11.636
  671   1HD   LYS  90          2HD       LYS  90   2.287   0.974 -12.546
  672   2HD   LYS  90          1HD       LYS  90   3.932   0.333 -12.529
  673   1HE   LYS  90          1HE       LYS  90   3.406   1.594 -14.604
  674   2HE   LYS  90          2HE       LYS  90   3.831  -0.083 -14.958
  675   1HZ   LYS  90          2HZ       LYS  90   1.095   0.998 -14.795
  676   2HZ   LYS  90          1HZ       LYS  90   1.917   0.655 -16.181
  677   3HZ   LYS  90          3HZ       LYS  90   1.496  -0.563 -15.158
  678    H    ALA  91           HN       ALA  91   0.474  -4.686 -12.204
  679    HA   ALA  91           HA       ALA  91  -0.442  -5.364 -14.907
  680   1HB   ALA  91          1HB       ALA  91  -1.774  -5.605 -12.171
  681   2HB   ALA  91          2HB       ALA  91  -2.383  -6.294 -13.691
  682   3HB   ALA  91          3HB       ALA  91  -0.851  -6.875 -13.009
  683    H    ASP  92           HN       ASP  92  -0.983  -2.871 -12.447
  684    HA   ASP  92           HA       ASP  92  -2.393  -1.178 -14.336
  685   1HB   ASP  92          1HB       ASP  92  -4.053  -2.939 -13.407
  686   2HB   ASP  92          2HB       ASP  92  -3.935  -2.088 -11.860
  687    H    ASP  93           HN       ASP  93  -3.265   0.848 -12.910
  688    HA   ASP  93           HA       ASP  93  -1.896   1.395 -10.493
  689   1HB   ASP  93          2HB       ASP  93  -0.549   3.335 -11.334
  690   2HB   ASP  93          1HB       ASP  93   0.083   1.768 -11.803
  691    H    LEU  94           HN       LEU  94  -2.268   3.762  -9.970
  692    HA   LEU  94           HA       LEU  94  -4.509   5.132 -11.275
  693   1HB   LEU  94          1HB       LEU  94  -5.733   3.391 -10.205
  694   2HB   LEU  94          2HB       LEU  94  -4.712   3.423  -8.782
  695    HG   LEU  94           HG       LEU  94  -5.736   5.699  -8.206
  696   1HD1  LEU  94          1HD11     LEU  94  -7.516   4.901 -10.562
  697   2HD1  LEU  94          3HD13     LEU  94  -7.882   6.224  -9.435
  698   3HD1  LEU  94          2HD12     LEU  94  -6.486   6.330 -10.507
  699   1HD2  LEU  94          2HD22     LEU  94  -7.625   3.339  -8.511
  700   2HD2  LEU  94          3HD23     LEU  94  -6.500   3.630  -7.167
  701   3HD2  LEU  94          1HD21     LEU  94  -7.857   4.734  -7.436
  702    H    VAL  95           HN       VAL  95  -4.826   7.261 -10.314
  703    HA   VAL  95           HA       VAL  95  -2.785   8.122  -8.359
  704    HB   VAL  95           HB       VAL  95  -2.697  10.248  -9.676
  705   1HG1  VAL  95          2HG12     VAL  95  -1.713   7.741 -11.102
  706   2HG1  VAL  95          3HG13     VAL  95  -1.146   9.393 -11.407
  707   3HG1  VAL  95          1HG11     VAL  95  -0.876   8.653  -9.823
  708   1HG2  VAL  95          2HG22     VAL  95  -4.788   9.956 -11.010
  709   2HG2  VAL  95          3HG23     VAL  95  -3.369  10.291 -12.010
  710   3HG2  VAL  95          1HG21     VAL  95  -4.006   8.642 -11.917
  711    H    GLY  96           HN       GLY  96  -3.344   9.891  -7.076
  712   1HA   GLY  96          1HA       GLY  96  -4.654  11.593  -6.208
  713   2HA   GLY  96          2HA       GLY  96  -5.967  11.195  -7.335
  714    H    ALA  97           HN       ALA  97  -6.809  11.697  -4.908
  715    HA   ALA  97           HA       ALA  97  -6.894   9.373  -3.140
  716   1HB   ALA  97          3HB       ALA  97  -6.928  11.759  -2.365
  717   2HB   ALA  97          1HB       ALA  97  -8.504  11.973  -3.149
  718   3HB   ALA  97          2HB       ALA  97  -8.343  10.839  -1.794
  719    H    SER  98           HN       SER  98  -7.709   8.621  -5.687
  720    HA   SER  98           HA       SER  98 -10.562   8.788  -6.109
  721   1HB   SER  98          2HB       SER  98  -8.424   7.049  -7.390
  722   2HB   SER  98          1HB       SER  98  -9.968   7.550  -8.117
  723    HG   SER  98           HG       SER  98  -7.661   8.810  -8.304
  724    H    GLN  99           HN       GLN  99 -10.512   7.812  -3.646
  725    HA   GLN  99           HA       GLN  99 -10.011   5.151  -3.091
  726   1HB   GLN  99          1HB       GLN  99 -11.923   5.360  -1.381
  727   2HB   GLN  99          2HB       GLN  99 -10.495   6.376  -1.256
  728   1HG   GLN  99          2HG       GLN  99 -12.465   7.641  -0.698
  729   2HG   GLN  99          1HG       GLN  99 -11.689   8.322  -2.110
  730   1HE2  GLN  99          1HE21     GLN  99 -15.463   6.711  -2.369
  731   2HE2  GLN  99          2HE22     GLN  99 -14.485   6.468  -0.928
  732    H    ASP 100           HN       ASP 100 -13.016   6.316  -4.694
  733    HA   ASP 100           HA       ASP 100 -14.377   3.820  -4.679
  734   1HB   ASP 100          1HB       ASP 100 -15.450   5.938  -5.294
  735   2HB   ASP 100          2HB       ASP 100 -14.426   6.074  -6.735
  736    H    LYS 101           HN       LYS 101 -12.184   5.234  -7.128
  737    HA   LYS 101           HA       LYS 101 -12.298   2.968  -8.873
  738   1HB   LYS 101          1HB       LYS 101 -11.653   5.302  -9.544
  739   2HB   LYS 101          2HB       LYS 101 -10.155   5.124  -8.624
  740   1HG   LYS 101          2HG       LYS 101  -9.796   4.809 -11.000
  741   2HG   LYS 101          1HG       LYS 101  -9.405   3.322 -10.120
  742   1HD   LYS 101          1HD       LYS 101 -11.518   2.297 -10.819
  743   2HD   LYS 101          2HD       LYS 101 -12.040   3.803 -11.596
  744   1HE   LYS 101          2HE       LYS 101  -9.590   2.138 -12.371
  745   2HE   LYS 101          1HE       LYS 101 -11.164   2.076 -13.182
  746   1HZ   LYS 101          2HZ       LYS 101 -10.902   4.389 -13.734
  747   2HZ   LYS 101          3HZ       LYS 101  -9.414   4.427 -13.023
  748   3HZ   LYS 101          1HZ       LYS 101  -9.671   3.481 -14.344
  749    H    LEU 102           HN       LEU 102 -10.206   3.965  -6.188
  750    HA   LEU 102           HA       LEU 102  -8.187   2.015  -6.319
  751   1HB   LEU 102          1HB       LEU 102  -8.683   4.071  -4.694
  752   2HB   LEU 102          2HB       LEU 102  -9.379   2.823  -3.657
  753    HG   LEU 102           HG       LEU 102  -6.512   3.109  -4.617
  754   1HD1  LEU 102          3HD13     LEU 102  -7.885   3.237  -1.889
  755   2HD1  LEU 102          2HD12     LEU 102  -6.142   3.332  -2.146
  756   3HD1  LEU 102          1HD11     LEU 102  -7.194   4.602  -2.794
  757   1HD2  LEU 102          3HD23     LEU 102  -7.728   0.859  -2.960
  758   2HD2  LEU 102          2HD22     LEU 102  -6.954   0.715  -4.562
  759   3HD2  LEU 102          1HD21     LEU 102  -5.989   1.172  -3.154
  760    H    LYS 103           HN       LYS 103 -11.312   1.881  -4.469
  761    HA   LYS 103           HA       LYS 103 -11.148  -0.812  -3.666
  762   1HB   LYS 103          2HB       LYS 103 -13.516   1.002  -4.297
  763   2HB   LYS 103          1HB       LYS 103 -13.680  -0.628  -3.634
  764   1HG   LYS 103          2HG       LYS 103 -12.217  -0.008  -1.737
  765   2HG   LYS 103          1HG       LYS 103 -12.162   1.655  -2.291
  766   1HD   LYS 103          2HD       LYS 103 -14.680   0.086  -1.513
  767   2HD   LYS 103          1HD       LYS 103 -13.831   1.214  -0.455
  768   1HE   LYS 103          1HE       LYS 103 -15.216   1.944  -3.081
  769   2HE   LYS 103          2HE       LYS 103 -15.821   2.258  -1.451
  770   1HZ   LYS 103          2HZ       LYS 103 -13.898   3.628  -1.061
  771   2HZ   LYS 103          3HZ       LYS 103 -13.355   3.351  -2.594
  772   3HZ   LYS 103          1HZ       LYS 103 -14.762   4.174  -2.356
  773    H    ALA 104           HN       ALA 104 -12.674   0.555  -6.634
  774    HA   ALA 104           HA       ALA 104 -13.566  -1.883  -7.719
  775   1HB   ALA 104          2HB       ALA 104 -14.143   0.365  -8.600
  776   2HB   ALA 104          3HB       ALA 104 -12.493   0.536  -9.235
  777   3HB   ALA 104          1HB       ALA 104 -13.561  -0.725  -9.875
  778    H    LEU 105           HN       LEU 105 -10.333  -0.312  -8.137
  779    HA   LEU 105           HA       LEU 105  -9.322  -2.368  -9.869
  780   1HB   LEU 105          1HB       LEU 105  -7.918  -0.340  -8.076
  781   2HB   LEU 105          2HB       LEU 105  -7.075  -1.470  -9.131
  782    HG   LEU 105           HG       LEU 105  -8.896   0.807  -9.983
  783   1HD1  LEU 105          1HD11     LEU 105  -6.516   1.282  -9.407
  784   2HD1  LEU 105          2HD12     LEU 105  -5.999   0.099 -10.626
  785   3HD1  LEU 105          3HD13     LEU 105  -6.871   1.559 -11.128
  786   1HD2  LEU 105          1HD21     LEU 105  -7.847  -1.519 -11.617
  787   2HD2  LEU 105          3HD23     LEU 105  -9.516  -0.906 -11.528
  788   3HD2  LEU 105          2HD22     LEU 105  -8.271   0.041 -12.349
  789    H    VAL 106           HN       VAL 106  -9.066  -1.937  -6.281
  790    HA   VAL 106           HA       VAL 106  -7.445  -4.255  -5.929
  791    HB   VAL 106           HB       VAL 106  -9.547  -3.114  -4.031
  792   1HG1  VAL 106          1HG21     VAL 106  -7.195  -5.005  -3.550
  793   2HG1  VAL 106          3HG23     VAL 106  -8.231  -4.299  -2.291
  794   3HG1  VAL 106          2HG22     VAL 106  -8.897  -5.466  -3.443
  795   1HG2  VAL 106          3HG13     VAL 106  -6.527  -2.737  -4.262
  796   2HG2  VAL 106          1HG11     VAL 106  -7.732  -1.507  -4.612
  797   3HG2  VAL 106          2HG12     VAL 106  -7.538  -2.087  -2.957
  798    H    ALA 107           HN       ALA 107 -10.981  -3.909  -5.941
  799    HA   ALA 107           HA       ALA 107 -11.675  -6.626  -5.587
  800   1HB   ALA 107          2HB       ALA 107 -13.330  -4.778  -5.613
  801   2HB   ALA 107          3HB       ALA 107 -13.109  -4.592  -7.361
  802   3HB   ALA 107          1HB       ALA 107 -13.788  -6.093  -6.711
  803    H    LYS 108           HN       LYS 108 -11.251  -4.914  -8.713
  804    HA   LYS 108           HA       LYS 108 -11.509  -6.992 -10.532
  805   1HB   LYS 108          1HB       LYS 108 -11.261  -4.738 -11.221
  806   2HB   LYS 108          2HB       LYS 108  -9.721  -4.534 -10.433
  807   1HG   LYS 108          1HG       LYS 108  -8.570  -5.971 -12.015
  808   2HG   LYS 108          2HG       LYS 108 -10.064  -6.309 -12.871
  809   1HD   LYS 108          2HD       LYS 108  -8.809  -3.550 -12.504
  810   2HD   LYS 108          1HD       LYS 108  -8.597  -4.584 -13.926
  811   1HE   LYS 108          2HE       LYS 108 -11.070  -4.498 -14.328
  812   2HE   LYS 108          1HE       LYS 108 -11.231  -3.364 -12.972
  813   1HZ   LYS 108          1HZ       LYS 108  -9.771  -1.873 -14.116
  814   2HZ   LYS 108          3HZ       LYS 108  -9.635  -2.913 -15.387
  815   3HZ   LYS 108          2HZ       LYS 108 -11.092  -2.227 -15.037
  816    H    HIS 109           HN       HIS 109  -8.418  -5.812  -9.260
  817    HA   HIS 109           HA       HIS 109  -6.937  -8.005 -10.389
  818   1HB   HIS 109          2HB       HIS 109  -6.190  -5.815  -8.414
  819   2HB   HIS 109          1HB       HIS 109  -5.053  -6.945  -9.164
  820    HD2  HIS 109           HD2      HIS 109  -6.815  -3.642 -10.072
  821    HE1  HIS 109           HE1      HIS 109  -5.196  -5.177 -13.629
  822    HE2  HIS 109           HE2      HIS 109  -6.270  -3.136 -12.572
  823    H    ALA 110           HN       ALA 110  -8.493  -7.674  -7.232
  824    HA   ALA 110           HA       ALA 110  -7.018  -9.868  -6.005
  825   1HB   ALA 110          3HB       ALA 110  -9.756  -8.687  -5.356
  826   2HB   ALA 110          1HB       ALA 110  -8.833  -9.818  -4.347
  827   3HB   ALA 110          2HB       ALA 110  -8.206  -8.188  -4.642
  828    H    ALA 111           HN       ALA 111 -10.148  -9.496  -7.751
  829    HA   ALA 111           HA       ALA 111 -10.648 -12.399  -7.688
  830   1HB   ALA 111          1HB       ALA 111 -12.488 -10.754  -7.498
  831   2HB   ALA 111          3HB       ALA 111 -12.079 -10.107  -9.103
  832   3HB   ALA 111          2HB       ALA 111 -12.670 -11.776  -8.937
  833    H    ALA 112           HN       ALA 112  -8.175 -12.302  -8.760
  834    HA   ALA 112           HA       ALA 112  -8.542 -13.153 -11.489
  835   1HB   ALA 112          3HB       ALA 112  -6.890 -10.652 -10.895
  836   2HB   ALA 112          2HB       ALA 112  -6.929 -11.528 -12.440
  837   3HB   ALA 112          1HB       ALA 112  -8.384 -10.695 -11.857
   
  No H/Q in entry =         837
  Start of MODEL    4
    1   1H    GLY   1          1HN       GLY   1  -2.103  -8.973   2.491
    2   2H    GLY   1          3HN       GLY   1  -3.160  -9.922   3.366
    3   3H    GLY   1          2HN       GLY   1  -2.512  -8.550   4.020
    4   1HA   GLY   1          1HA       GLY   1  -1.355 -10.362   4.969
    5   2HA   GLY   1          2HA       GLY   1  -1.072 -11.014   3.338
    6    H    GLY   2           HN       GLY   2   1.125 -10.503   5.073
    7   1HA   GLY   2          1HA       GLY   2   3.112  -9.375   5.235
    8   2HA   GLY   2          2HA       GLY   2   2.934  -9.131   3.485
    9    H    SER   3           HN       SER   3   3.246  -6.969   3.015
   10    HA   SER   3           HA       SER   3   2.757  -4.839   4.892
   11   1HB   SER   3          2HB       SER   3   2.974  -4.752   1.861
   12   2HB   SER   3          1HB       SER   3   3.027  -3.363   2.954
   13    HG   SER   3           HG       SER   3   5.125  -3.986   2.468
   14    H    VAL   4           HN       VAL   4   0.654  -4.929   5.665
   15    HA   VAL   4           HA       VAL   4  -1.484  -4.129   3.779
   16    HB   VAL   4           HB       VAL   4  -1.445  -6.579   4.434
   17   1HG1  VAL   4          3HG23     VAL   4  -0.724  -6.218   6.814
   18   2HG1  VAL   4          1HG21     VAL   4  -2.345  -5.579   7.163
   19   3HG1  VAL   4          2HG22     VAL   4  -2.158  -7.253   6.623
   20   1HG2  VAL   4          2HG12     VAL   4  -3.497  -5.438   3.655
   21   2HG2  VAL   4          3HG13     VAL   4  -3.786  -6.799   4.759
   22   3HG2  VAL   4          1HG11     VAL   4  -3.923  -5.143   5.368
   23    H    ILE   5           HN       ILE   5   0.371  -2.584   5.370
   24    HA   ILE   5           HA       ILE   5  -1.409  -1.034   7.074
   25    HB   ILE   5           HB       ILE   5   0.248  -1.010   8.949
   26   1HG1  ILE   5          1HG11     ILE   5   1.521  -3.415   7.546
   27   2HG1  ILE   5          2HG12     ILE   5   2.225  -1.794   7.617
   28   1HG2  ILE   5          3HG23     ILE   5  -1.805  -2.488   8.940
   29   2HG2  ILE   5          1HG21     ILE   5  -0.760  -3.841   8.449
   30   3HG2  ILE   5          2HG22     ILE   5  -0.506  -3.028  10.003
   31   1HD1  ILE   5          2HD12     ILE   5   2.244  -1.928  10.108
   32   2HD1  ILE   5          3HD13     ILE   5   1.701  -3.620   9.986
   33   3HD1  ILE   5          1HD11     ILE   5   3.260  -3.139   9.303
   34    H    VAL   6           HN       VAL   6  -0.001   0.953   7.821
   35    HA   VAL   6           HA       VAL   6   1.090   2.064   5.406
   36    HB   VAL   6           HB       VAL   6  -0.322   3.300   6.897
   37   1HG1  VAL   6          2HG12     VAL   6   0.431   2.427   9.124
   38   2HG1  VAL   6          3HG13     VAL   6   1.885   3.430   8.989
   39   3HG1  VAL   6          1HG11     VAL   6   0.290   4.182   9.028
   40   1HG2  VAL   6          3HG23     VAL   6   1.290   4.503   5.435
   41   2HG2  VAL   6          2HG22     VAL   6   0.831   5.410   6.886
   42   3HG2  VAL   6          1HG21     VAL   6   2.415   4.623   6.799
   43    H    ILE   7           HN       ILE   7   2.732   0.407   5.135
   44    HA   ILE   7           HA       ILE   7   5.328   1.336   6.280
   45    HB   ILE   7           HB       ILE   7   4.795  -0.873   7.162
   46   1HG1  ILE   7          1HG11     ILE   7   6.991  -1.041   5.041
   47   2HG1  ILE   7          2HG12     ILE   7   7.136  -0.120   6.542
   48   1HG2  ILE   7          3HG23     ILE   7   3.360  -1.689   5.220
   49   2HG2  ILE   7          1HG21     ILE   7   4.854  -1.944   4.299
   50   3HG2  ILE   7          2HG22     ILE   7   4.552  -2.850   5.788
   51   1HD1  ILE   7          1HD11     ILE   7   6.732  -2.216   7.845
   52   2HD1  ILE   7          3HD13     ILE   7   6.753  -3.132   6.320
   53   3HD1  ILE   7          2HD12     ILE   7   8.198  -2.256   6.850
   54    H    ASP   8           HN       ASP   8   6.649   2.143   4.844
   55    HA   ASP   8           HA       ASP   8   6.165   1.868   1.930
   56   1HB   ASP   8          2HB       ASP   8   7.392   3.967   1.796
   57   2HB   ASP   8          1HB       ASP   8   6.071   4.152   2.963
   58    H    SER   9           HN       SER   9   8.616   1.738   4.438
   59    HA   SER   9           HA       SER   9  10.926   1.625   3.751
   60   1HB   SER   9          1HB       SER   9   9.742  -0.961   4.856
   61   2HB   SER   9          2HB       SER   9  11.365  -0.311   5.191
   62    HG   SER   9           HG       SER   9   9.820   0.240   6.836
   63    H    LYS  10           HN       LYS  10  11.989   1.364   1.905
   64    HA   LYS  10           HA       LYS  10  11.582  -0.078  -0.334
   65   1HB   LYS  10          1HB       LYS  10  14.297   0.256   1.003
   66   2HB   LYS  10          2HB       LYS  10  14.007  -0.112  -0.702
   67   1HG   LYS  10          2HG       LYS  10  12.759   2.072  -0.893
   68   2HG   LYS  10          1HG       LYS  10  13.302   2.466   0.759
   69   1HD   LYS  10          1HD       LYS  10  15.658   2.220   0.056
   70   2HD   LYS  10          2HD       LYS  10  15.133   1.852  -1.599
   71   1HE   LYS  10          1HE       LYS  10  14.077   4.082  -1.783
   72   2HE   LYS  10          2HE       LYS  10  14.530   4.454  -0.106
   73   1HZ   LYS  10          1HZ       LYS  10  16.816   4.264  -0.742
   74   2HZ   LYS  10          2HZ       LYS  10  16.405   3.924  -2.301
   75   3HZ   LYS  10          3HZ       LYS  10  16.052   5.401  -1.655
   76    H    ALA  11           HN       ALA  11  13.298  -1.301   2.519
   77    HA   ALA  11           HA       ALA  11  14.011  -3.868   1.553
   78   1HB   ALA  11          1HB       ALA  11  14.897  -2.908   3.643
   79   2HB   ALA  11          3HB       ALA  11  13.293  -3.028   4.402
   80   3HB   ALA  11          2HB       ALA  11  14.174  -4.501   3.940
   81    H    ALA  12           HN       ALA  12  11.006  -2.805   3.192
   82    HA   ALA  12           HA       ALA  12   9.833  -5.463   3.369
   83   1HB   ALA  12          3HB       ALA  12   9.187  -3.620   4.902
   84   2HB   ALA  12          2HB       ALA  12   8.526  -2.704   3.527
   85   3HB   ALA  12          1HB       ALA  12   7.799  -4.248   3.995
   86    H    TRP  13           HN       TRP  13   9.546  -2.610   1.248
   87    HA   TRP  13           HA       TRP  13   7.612  -3.520  -0.590
   88   1HB   TRP  13          2HB       TRP  13   8.164  -1.315  -0.912
   89   2HB   TRP  13          1HB       TRP  13   9.862  -1.549  -0.572
   90    HD1  TRP  13           HD1      TRP  13  11.496  -2.130  -2.525
   91    HE1  TRP  13           HE1      TRP  13  11.335  -2.146  -5.070
   92    HE3  TRP  13           HE3      TRP  13   6.474  -1.301  -3.005
   93    HZ2  TRP  13           HZ2      TRP  13   9.322  -1.771  -7.058
   94    HZ3  TRP  13           HZ3      TRP  13   5.513  -0.921  -5.240
   95    HH2  TRP  13           HH2      TRP  13   6.882  -1.256  -7.290
   96    H    ASP  14           HN       ASP  14  11.179  -3.831  -0.893
   97    HA   ASP  14           HA       ASP  14  11.157  -5.453  -3.211
   98   1HB   ASP  14          2HB       ASP  14  13.211  -5.165  -0.967
   99   2HB   ASP  14          1HB       ASP  14  13.491  -6.105  -2.437
  100    H    ALA  15           HN       ALA  15  11.324  -6.360   0.233
  101    HA   ALA  15           HA       ALA  15  11.545  -9.150  -0.120
  102   1HB   ALA  15          2HB       ALA  15  10.094  -7.619   2.090
  103   2HB   ALA  15          3HB       ALA  15  10.568  -9.327   2.148
  104   3HB   ALA  15          1HB       ALA  15  11.811  -8.066   2.065
  105    H    GLN  16           HN       GLN  16   8.547  -7.329   0.528
  106    HA   GLN  16           HA       GLN  16   6.715  -9.424   0.110
  107   1HB   GLN  16          2HB       GLN  16   6.554  -6.408  -0.028
  108   2HB   GLN  16          1HB       GLN  16   5.231  -7.367  -0.671
  109   1HG   GLN  16          2HG       GLN  16   4.769  -6.796   1.615
  110   2HG   GLN  16          1HG       GLN  16   4.913  -8.544   1.427
  111   1HE2  GLN  16          2HE22     GLN  16   7.130  -6.753   4.236
  112   2HE2  GLN  16          1HE21     GLN  16   5.794  -5.951   3.415
  113    H    LEU  17           HN       LEU  17   7.907  -7.033  -2.284
  114    HA   LEU  17           HA       LEU  17   6.466  -7.866  -4.498
  115   1HB   LEU  17          1HB       LEU  17   7.928  -5.863  -4.327
  116   2HB   LEU  17          2HB       LEU  17   9.352  -6.910  -4.386
  117    HG   LEU  17           HG       LEU  17   8.717  -7.595  -6.706
  118   1HD1  LEU  17          3HD23     LEU  17   6.512  -5.501  -6.356
  119   2HD1  LEU  17          2HD22     LEU  17   7.000  -6.227  -7.901
  120   3HD1  LEU  17          1HD21     LEU  17   6.273  -7.237  -6.650
  121   1HD2  LEU  17          2HD12     LEU  17  10.278  -5.734  -6.288
  122   2HD2  LEU  17          1HD11     LEU  17   9.308  -5.444  -7.743
  123   3HD2  LEU  17          3HD13     LEU  17   8.917  -4.594  -6.233
  124    H    ALA  18           HN       ALA  18   9.130  -9.633  -2.955
  125    HA   ALA  18           HA       ALA  18   9.141 -11.556  -5.264
  126   1HB   ALA  18          3HB       ALA  18  11.144 -11.120  -2.995
  127   2HB   ALA  18          2HB       ALA  18  11.279 -12.326  -4.294
  128   3HB   ALA  18          1HB       ALA  18  11.337 -10.593  -4.679
  129    H    LYS  19           HN       LYS  19   9.297 -11.614  -1.637
  130    HA   LYS  19           HA       LYS  19   8.709 -14.402  -1.537
  131   1HB   LYS  19          2HB       LYS  19   8.391 -14.115   0.828
  132   2HB   LYS  19          1HB       LYS  19   9.824 -13.258   0.295
  133   1HG   LYS  19          2HG       LYS  19   9.086 -11.318   1.057
  134   2HG   LYS  19          1HG       LYS  19   7.516 -11.459   0.272
  135   1HD   LYS  19          1HD       LYS  19   8.211 -12.854   2.903
  136   2HD   LYS  19          2HD       LYS  19   7.592 -11.208   2.804
  137   1HE   LYS  19          1HE       LYS  19   5.714 -12.543   3.267
  138   2HE   LYS  19          2HE       LYS  19   5.556 -12.054   1.575
  139   1HZ   LYS  19          3HZ       LYS  19   6.571 -14.652   2.518
  140   2HZ   LYS  19          1HZ       LYS  19   5.039 -14.366   1.985
  141   3HZ   LYS  19          2HZ       LYS  19   6.302 -14.232   0.946
  142    H    GLY  20           HN       GLY  20   6.490 -11.636  -1.993
  143   1HA   GLY  20          1HA       GLY  20   4.124 -12.895  -1.102
  144   2HA   GLY  20          2HA       GLY  20   4.273 -11.677  -2.383
  145    H    LYS  21           HN       LYS  21   6.163 -13.427  -3.988
  146    HA   LYS  21           HA       LYS  21   5.871 -14.615  -5.920
  147   1HB   LYS  21          1HB       LYS  21   4.607 -16.562  -3.930
  148   2HB   LYS  21          2HB       LYS  21   5.232 -16.968  -5.540
  149   1HG   LYS  21          1HG       LYS  21   7.487 -16.129  -4.841
  150   2HG   LYS  21          2HG       LYS  21   6.853 -15.863  -3.207
  151   1HD   LYS  21          1HD       LYS  21   6.225 -18.279  -3.071
  152   2HD   LYS  21          2HD       LYS  21   6.984 -18.551  -4.648
  153   1HE   LYS  21          1HE       LYS  21   8.379 -17.526  -2.123
  154   2HE   LYS  21          2HE       LYS  21   8.487 -19.170  -2.774
  155   1HZ   LYS  21          1HZ       LYS  21   9.484 -18.255  -4.749
  156   2HZ   LYS  21          2HZ       LYS  21   9.418 -16.733  -4.118
  157   3HZ   LYS  21          3HZ       LYS  21  10.363 -17.879  -3.408
  158    H    GLU  22           HN       GLU  22   4.255 -12.717  -6.025
  159    HA   GLU  22           HA       GLU  22   1.486 -13.247  -5.780
  160   1HB   GLU  22          1HB       GLU  22   1.249 -10.956  -6.541
  161   2HB   GLU  22          2HB       GLU  22   2.486 -11.069  -5.308
  162   1HG   GLU  22          1HG       GLU  22   3.148 -11.020  -8.280
  163   2HG   GLU  22          2HG       GLU  22   2.792  -9.547  -7.397
  164    H    GLU  23           HN       GLU  23   2.272 -15.184  -7.548
  165    HA   GLU  23           HA       GLU  23   1.890 -14.834 -10.291
  166   1HB   GLU  23          1HB       GLU  23   2.486 -16.953  -9.130
  167   2HB   GLU  23          2HB       GLU  23   0.822 -17.096  -8.539
  168   1HG   GLU  23          1HG       GLU  23   0.022 -17.183 -10.914
  169   2HG   GLU  23          2HG       GLU  23   1.701 -17.043 -11.464
  170    H    HIS  24           HN       HIS  24  -0.589 -15.355  -7.766
  171    HA   HIS  24           HA       HIS  24  -2.509 -13.764  -9.355
  172   1HB   HIS  24          1HB       HIS  24  -3.026 -16.156  -9.792
  173   2HB   HIS  24          2HB       HIS  24  -3.191 -16.435  -8.050
  174    HD2  HIS  24           HD2      HIS  24  -4.696 -13.176  -9.636
  175    HE1  HIS  24           HE1      HIS  24  -7.898 -15.673  -8.515
  176    HE2  HIS  24           HE2      HIS  24  -7.224 -13.303  -9.321
  177    H    LYS  25           HN       LYS  25  -1.182 -12.442  -7.564
  178    HA   LYS  25           HA       LYS  25  -3.082 -12.206  -5.288
  179   1HB   LYS  25          2HB       LYS  25  -0.090 -11.998  -4.900
  180   2HB   LYS  25          1HB       LYS  25  -1.361 -11.838  -3.704
  181   1HG   LYS  25          1HG       LYS  25  -2.035 -14.255  -4.244
  182   2HG   LYS  25          2HG       LYS  25  -0.529 -14.367  -5.173
  183   1HD   LYS  25          1HD       LYS  25   0.689 -13.576  -3.049
  184   2HD   LYS  25          2HD       LYS  25  -0.867 -13.714  -2.212
  185   1HE   LYS  25          2HE       LYS  25   0.287 -15.754  -1.776
  186   2HE   LYS  25          1HE       LYS  25  -0.948 -16.146  -2.992
  187   1HZ   LYS  25          3HZ       LYS  25   1.905 -15.599  -3.507
  188   2HZ   LYS  25          2HZ       LYS  25   1.205 -17.091  -3.499
  189   3HZ   LYS  25          1HZ       LYS  25   0.801 -15.992  -4.658
  190    HA   PRO  26           HA       PRO  26  -2.457  -8.091  -7.020
  191   1HB   PRO  26          2HB       PRO  26  -4.268  -6.676  -5.468
  192   2HB   PRO  26          1HB       PRO  26  -4.644  -7.606  -6.933
  193   1HG   PRO  26          1HG       PRO  26  -4.990  -8.424  -4.081
  194   2HG   PRO  26          2HG       PRO  26  -6.079  -8.740  -5.440
  195   1HD   PRO  26          2HD       PRO  26  -4.298 -10.557  -4.366
  196   2HD   PRO  26          1HD       PRO  26  -4.751 -10.613  -6.082
  197    H    ILE  27           HN       ILE  27  -0.409  -7.491  -6.533
  198    HA   ILE  27           HA       ILE  27   0.126  -6.362  -3.833
  199    HB   ILE  27           HB       ILE  27   1.857  -6.540  -6.332
  200   1HG1  ILE  27          2HG12     ILE  27   1.833  -7.962  -3.657
  201   2HG1  ILE  27          1HG11     ILE  27   1.581  -8.643  -5.250
  202   1HG2  ILE  27          1HG21     ILE  27   2.289  -4.432  -5.035
  203   2HG2  ILE  27          2HG22     ILE  27   2.532  -5.413  -3.576
  204   3HG2  ILE  27          3HG23     ILE  27   3.645  -5.538  -4.957
  205   1HD1  ILE  27          1HD11     ILE  27   4.010  -7.966  -5.753
  206   2HD1  ILE  27          2HD12     ILE  27   4.156  -7.533  -4.032
  207   3HD1  ILE  27          3HD13     ILE  27   3.826  -9.203  -4.478
  208    H    VAL  28           HN       VAL  28  -0.476  -4.297  -3.512
  209    HA   VAL  28           HA       VAL  28  -1.274  -2.649  -5.875
  210    HB   VAL  28           HB       VAL  28  -2.735  -2.663  -3.208
  211   1HG1  VAL  28          3HG13     VAL  28  -3.347  -1.489  -5.968
  212   2HG1  VAL  28          2HG12     VAL  28  -4.425  -1.416  -4.568
  213   3HG1  VAL  28          1HG11     VAL  28  -2.867  -0.565  -4.536
  214   1HG2  VAL  28          1HG21     VAL  28  -3.448  -4.083  -5.811
  215   2HG2  VAL  28          3HG23     VAL  28  -3.151  -4.836  -4.226
  216   3HG2  VAL  28          2HG22     VAL  28  -4.569  -3.818  -4.461
  217    H    VAL  29           HN       VAL  29  -0.076  -0.858  -5.917
  218    HA   VAL  29           HA       VAL  29   1.426  -0.101  -3.464
  219    HB   VAL  29           HB       VAL  29   2.225   0.763  -6.236
  220   1HG1  VAL  29          3HG23     VAL  29   3.138   1.700  -4.091
  221   2HG1  VAL  29          1HG21     VAL  29   3.736   0.074  -3.703
  222   3HG1  VAL  29          2HG22     VAL  29   4.356   0.940  -5.118
  223   1HG2  VAL  29          1HG11     VAL  29   2.925  -1.936  -5.058
  224   2HG2  VAL  29          3HG13     VAL  29   1.969  -1.640  -6.533
  225   3HG2  VAL  29          2HG12     VAL  29   3.661  -1.165  -6.493
  226    H    ASP  30           HN       ASP  30   0.516   1.633  -2.522
  227    HA   ASP  30           HA       ASP  30  -0.775   3.762  -4.176
  228   1HB   ASP  30          1HB       ASP  30  -1.993   3.121  -2.187
  229   2HB   ASP  30          2HB       ASP  30  -0.555   3.360  -1.172
  230    H    PHE  31           HN       PHE  31   1.073   4.583  -5.227
  231    HA   PHE  31           HA       PHE  31   3.474   5.294  -3.658
  232   1HB   PHE  31          1HB       PHE  31   2.683   5.779  -6.541
  233   2HB   PHE  31          2HB       PHE  31   4.119   6.424  -5.779
  234    HD1  PHE  31           HD2      PHE  31   5.934   4.948  -4.940
  235    HD2  PHE  31           HD1      PHE  31   2.629   3.407  -7.242
  236    HE1  PHE  31           HE2      PHE  31   7.371   3.119  -5.771
  237    HE2  PHE  31           HE1      PHE  31   4.094   1.573  -8.079
  238    HZ   PHE  31           HZ       PHE  31   6.457   1.439  -7.372
  239    H    THR  32           HN       THR  32   2.812   6.771  -2.154
  240    HA   THR  32           HA       THR  32   1.283   9.209  -3.008
  241    HB   THR  32           HB       THR  32  -0.126   7.737  -1.658
  242    HG1  THR  32           HG1      THR  32  -0.704   9.325  -0.235
  243   1HG2  THR  32          3HG23     THR  32   1.600   6.519  -0.333
  244   2HG2  THR  32          2HG22     THR  32   1.997   8.019   0.534
  245   3HG2  THR  32          1HG21     THR  32   0.394   7.282   0.708
  246    H    ALA  33           HN       ALA  33   1.687  10.593  -0.578
  247    HA   ALA  33           HA       ALA  33   4.533  10.616  -0.048
  248   1HB   ALA  33          2HB       ALA  33   4.290  11.938  -2.250
  249   2HB   ALA  33          1HB       ALA  33   3.391  13.138  -1.312
  250   3HB   ALA  33          3HB       ALA  33   5.080  12.777  -0.904
  251    H    THR  34           HN       THR  34   5.047  11.684   1.807
  252    HA   THR  34           HA       THR  34   3.091  12.038   3.768
  253    HB   THR  34           HB       THR  34   5.893  13.250   3.720
  254    HG1  THR  34           HG1      THR  34   6.627  11.311   3.549
  255   1HG2  THR  34          1HG21     THR  34   4.240  11.998   5.958
  256   2HG2  THR  34          3HG23     THR  34   5.894  12.629   6.106
  257   3HG2  THR  34          2HG22     THR  34   4.554  13.738   5.753
  258    H    TRP  35           HN       TRP  35   4.835  14.489   1.866
  259    HA   TRP  35           HA       TRP  35   4.018  16.720   3.420
  260   1HB   TRP  35          1HB       TRP  35   5.033  18.040   1.638
  261   2HB   TRP  35          2HB       TRP  35   6.053  16.699   2.135
  262    HD1  TRP  35           HD1      TRP  35   6.338  14.664   0.396
  263    HE1  TRP  35           HE1      TRP  35   6.189  14.583  -2.195
  264    HE3  TRP  35           HE3      TRP  35   3.876  19.074  -0.448
  265    HZ2  TRP  35           HZ2      TRP  35   5.154  16.192  -4.302
  266    HZ3  TRP  35           HZ3      TRP  35   3.361  19.790  -2.761
  267    HH2  TRP  35           HH2      TRP  35   3.981  18.356  -4.691
  268    H    CYS  36           HN       CYS  36   2.666  15.576   0.256
  269    HA   CYS  36           HA       CYS  36   0.944  17.934   0.116
  270   1HB   CYS  36          1HB       CYS  36   0.019  16.849  -1.921
  271   2HB   CYS  36          2HB       CYS  36   1.729  17.207  -1.917
  272    H    GLY  37           HN       GLY  37   0.206  17.282   2.378
  273   1HA   GLY  37          1HA       GLY  37  -1.317  16.127   3.793
  274   2HA   GLY  37          2HA       GLY  37  -2.222  17.410   2.991
  275    HA   PRO  38           HA       PRO  38  -5.388  14.656   1.550
  276   1HB   PRO  38          1HB       PRO  38  -4.493  15.458  -1.240
  277   2HB   PRO  38          2HB       PRO  38  -6.161  15.215  -0.642
  278   1HG   PRO  38          1HG       PRO  38  -5.155  17.721  -0.749
  279   2HG   PRO  38          2HG       PRO  38  -6.012  17.193   0.729
  280   1HD   PRO  38          2HD       PRO  38  -3.039  17.406   0.267
  281   2HD   PRO  38          1HD       PRO  38  -4.002  17.835   1.709
  282    H    CYS  39           HN       CYS  39  -2.410  14.459  -0.368
  283    HA   CYS  39           HA       CYS  39  -2.464  11.878  -1.432
  284   1HB   CYS  39          1HB       CYS  39  -0.130  13.371  -0.142
  285   2HB   CYS  39          2HB       CYS  39   0.019  11.977  -1.190
  286    H    LYS  40           HN       LYS  40  -1.408  12.979   1.816
  287    HA   LYS  40           HA       LYS  40  -0.736  10.293   2.650
  288   1HB   LYS  40          2HB       LYS  40   0.431  12.421   3.402
  289   2HB   LYS  40          1HB       LYS  40  -1.008  12.816   4.348
  290   1HG   LYS  40          1HG       LYS  40   0.779  11.802   5.689
  291   2HG   LYS  40          2HG       LYS  40  -0.686  10.807   5.732
  292   1HD   LYS  40          1HD       LYS  40   0.265   9.153   4.277
  293   2HD   LYS  40          2HD       LYS  40   1.572  10.235   3.758
  294   1HE   LYS  40          1HE       LYS  40   2.552  10.151   6.027
  295   2HE   LYS  40          2HE       LYS  40   1.233   9.091   6.570
  296   1HZ   LYS  40          2HZ       LYS  40   3.140   8.467   4.420
  297   2HZ   LYS  40          1HZ       LYS  40   3.230   7.894   5.962
  298   3HZ   LYS  40          3HZ       LYS  40   1.968   7.468   4.993
  299    H    MET  41           HN       MET  41  -3.420  12.569   3.140
  300    HA   MET  41           HA       MET  41  -4.866  10.970   5.069
  301   1HB   MET  41          1HB       MET  41  -5.919  12.971   3.013
  302   2HB   MET  41          2HB       MET  41  -6.834  12.335   4.383
  303   1HG   MET  41          1HG       MET  41  -4.302  14.005   4.616
  304   2HG   MET  41          2HG       MET  41  -5.953  14.576   4.849
  305   1HE   MET  41          1HE       MET  41  -5.099  15.657   7.110
  306   2HE   MET  41          2HE       MET  41  -4.327  14.722   8.414
  307   3HE   MET  41          3HE       MET  41  -3.477  14.957   6.869
  308    H    ILE  42           HN       ILE  42  -4.645  10.669   1.571
  309    HA   ILE  42           HA       ILE  42  -6.823   8.775   1.380
  310    HB   ILE  42           HB       ILE  42  -4.406   9.402  -0.343
  311   1HG1  ILE  42          2HG12     ILE  42  -7.366   9.762  -0.961
  312   2HG1  ILE  42          1HG11     ILE  42  -6.507  10.969  -0.008
  313   1HG2  ILE  42          1HG21     ILE  42  -6.644   7.399  -0.872
  314   2HG2  ILE  42          2HG22     ILE  42  -5.527   8.012  -2.109
  315   3HG2  ILE  42          3HG23     ILE  42  -4.900   7.064  -0.761
  316   1HD1  ILE  42          2HD12     ILE  42  -4.871  11.306  -1.807
  317   2HD1  ILE  42          3HD13     ILE  42  -5.726  10.119  -2.816
  318   3HD1  ILE  42          1HD11     ILE  42  -6.529  11.629  -2.342
  319    H    ALA  43           HN       ALA  43  -3.476   8.466   2.567
  320    HA   ALA  43           HA       ALA  43  -3.200   5.680   2.115
  321   1HB   ALA  43          3HB       ALA  43  -1.297   7.062   2.663
  322   2HB   ALA  43          2HB       ALA  43  -1.883   7.360   4.298
  323   3HB   ALA  43          1HB       ALA  43  -1.448   5.723   3.810
  324    HA   PRO  44           HA       PRO  44  -5.310   5.056   6.554
  325   1HB   PRO  44          2HB       PRO  44  -7.153   7.433   6.141
  326   2HB   PRO  44          1HB       PRO  44  -6.746   6.605   7.673
  327   1HG   PRO  44          1HG       PRO  44  -5.509   8.906   6.901
  328   2HG   PRO  44          2HG       PRO  44  -4.580   7.592   7.697
  329   1HD   PRO  44          1HD       PRO  44  -4.598   8.408   4.840
  330   2HD   PRO  44          2HD       PRO  44  -3.321   7.638   5.809
  331    H    LEU  45           HN       LEU  45  -7.033   6.545   3.795
  332    HA   LEU  45           HA       LEU  45  -9.366   4.848   3.962
  333   1HB   LEU  45          1HB       LEU  45  -8.185   6.109   1.442
  334   2HB   LEU  45          2HB       LEU  45  -9.807   5.481   1.652
  335    HG   LEU  45           HG       LEU  45  -8.601   7.922   3.044
  336   1HD1  LEU  45          1HD11     LEU  45  -9.194   8.201   0.642
  337   2HD1  LEU  45          2HD12     LEU  45 -10.841   7.637   0.995
  338   3HD1  LEU  45          3HD13     LEU  45 -10.249   9.157   1.701
  339   1HD2  LEU  45          2HD22     LEU  45 -11.375   6.680   3.330
  340   2HD2  LEU  45          3HD23     LEU  45 -10.161   6.885   4.614
  341   3HD2  LEU  45          1HD21     LEU  45 -10.927   8.303   3.895
  342    H    PHE  46           HN       PHE  46  -6.450   4.667   1.916
  343    HA   PHE  46           HA       PHE  46  -6.973   2.108   0.769
  344   1HB   PHE  46          1HB       PHE  46  -5.394   3.773  -0.062
  345   2HB   PHE  46          2HB       PHE  46  -4.410   3.597   1.377
  346    HD1  PHE  46           HD1      PHE  46  -5.826   1.115  -1.171
  347    HD2  PHE  46           HD2      PHE  46  -2.409   2.703   0.872
  348    HE1  PHE  46           HE1      PHE  46  -4.342  -0.297  -2.545
  349    HE2  PHE  46           HE2      PHE  46  -0.940   1.057  -0.313
  350    HZ   PHE  46           HZ       PHE  46  -1.854  -0.302  -2.119
  351    H    GLU  47           HN       GLU  47  -5.508   3.031   3.878
  352    HA   GLU  47           HA       GLU  47  -4.628   0.411   4.641
  353   1HB   GLU  47          2HB       GLU  47  -3.830   2.627   5.557
  354   2HB   GLU  47          1HB       GLU  47  -5.330   2.698   6.503
  355   1HG   GLU  47          2HG       GLU  47  -4.741   0.701   7.724
  356   2HG   GLU  47          1HG       GLU  47  -3.436   0.312   6.596
  357    H    THR  48           HN       THR  48  -7.716   2.178   4.944
  358    HA   THR  48           HA       THR  48  -8.972   0.274   6.694
  359    HB   THR  48           HB       THR  48 -10.329   1.978   4.555
  360    HG1  THR  48           HG1      THR  48  -8.926   3.174   6.038
  361   1HG2  THR  48          3HG23     THR  48 -11.300   0.854   7.213
  362   2HG2  THR  48          1HG21     THR  48 -12.221   1.910   6.123
  363   3HG2  THR  48          2HG22     THR  48 -11.781   0.272   5.604
  364    H    LEU  49           HN       LEU  49  -8.786   0.592   3.086
  365    HA   LEU  49           HA       LEU  49 -10.152  -1.884   2.579
  366   1HB   LEU  49          1HB       LEU  49  -8.066  -0.377   0.934
  367   2HB   LEU  49          2HB       LEU  49  -8.818  -1.887   0.430
  368    HG   LEU  49           HG       LEU  49  -9.899  -0.198  -0.675
  369   1HD1  LEU  49          2HD12     LEU  49 -11.294  -2.091   0.307
  370   2HD1  LEU  49          3HD13     LEU  49 -11.864  -0.936   1.532
  371   3HD1  LEU  49          1HD11     LEU  49 -12.195  -0.650  -0.177
  372   1HD2  LEU  49          1HD21     LEU  49  -9.421   1.742   0.730
  373   2HD2  LEU  49          3HD23     LEU  49 -11.133   1.660   0.295
  374   3HD2  LEU  49          2HD22     LEU  49 -10.625   1.194   1.926
  375    H    SER  50           HN       SER  50  -6.722  -1.186   3.166
  376    HA   SER  50           HA       SER  50  -5.643  -3.810   2.913
  377   1HB   SER  50          2HB       SER  50  -4.785  -1.943   5.133
  378   2HB   SER  50          1HB       SER  50  -3.881  -3.164   4.269
  379    HG   SER  50           HG       SER  50  -4.937  -1.032   2.789
  380    H    ASN  51           HN       ASN  51  -7.102  -2.347   5.846
  381    HA   ASN  51           HA       ASN  51  -7.006  -4.653   7.493
  382   1HB   ASN  51          2HB       ASN  51  -7.556  -2.607   8.529
  383   2HB   ASN  51          1HB       ASN  51  -8.827  -2.216   7.381
  384   1HD2  ASN  51          2HD22     ASN  51 -11.355  -4.094   9.039
  385   2HD2  ASN  51          1HD21     ASN  51 -10.968  -3.339   7.508
  386    H    ASP  52           HN       ASP  52  -9.550  -3.536   5.234
  387    HA   ASP  52           HA       ASP  52 -11.387  -5.632   5.802
  388   1HB   ASP  52          2HB       ASP  52 -11.081  -4.033   3.217
  389   2HB   ASP  52          1HB       ASP  52 -12.512  -4.924   3.747
  390    H    TYR  53           HN       TYR  53  -9.308  -5.305   2.882
  391    HA   TYR  53           HA       TYR  53  -9.648  -8.156   2.188
  392   1HB   TYR  53          2HB       TYR  53  -8.107  -5.850   0.996
  393   2HB   TYR  53          1HB       TYR  53  -8.086  -7.475   0.323
  394    HD1  TYR  53           HD2      TYR  53 -10.098  -8.452  -0.739
  395    HD2  TYR  53           HD1      TYR  53  -9.900  -4.319   0.468
  396    HE1  TYR  53           HE2      TYR  53 -11.576  -7.826  -2.624
  397    HE2  TYR  53           HE1      TYR  53 -11.318  -3.691  -1.459
  398    HH   TYR  53           HH       TYR  53 -12.294  -4.428  -3.439
  399    H    ALA  54           HN       ALA  54  -8.671  -8.291   4.600
  400    HA   ALA  54           HA       ALA  54  -5.914  -7.923   5.042
  401   1HB   ALA  54          3HB       ALA  54  -7.562  -8.349   6.821
  402   2HB   ALA  54          2HB       ALA  54  -7.791 -10.011   6.235
  403   3HB   ALA  54          1HB       ALA  54  -6.227  -9.509   6.913
  404    H    GLY  55           HN       GLY  55  -7.531 -10.495   3.320
  405   1HA   GLY  55          1HA       GLY  55  -5.769 -12.651   3.598
  406   2HA   GLY  55          2HA       GLY  55  -6.914 -12.375   2.278
  407    H    LYS  56           HN       LYS  56  -5.790 -13.020   0.529
  408    HA   LYS  56           HA       LYS  56  -2.960 -12.802   0.233
  409   1HB   LYS  56          1HB       LYS  56  -3.362 -13.858  -1.906
  410   2HB   LYS  56          2HB       LYS  56  -4.324 -14.653  -0.668
  411   1HG   LYS  56          1HG       LYS  56  -6.353 -13.948  -1.564
  412   2HG   LYS  56          2HG       LYS  56  -5.691 -12.433  -2.177
  413   1HD   LYS  56          2HD       LYS  56  -4.399 -13.784  -3.908
  414   2HD   LYS  56          1HD       LYS  56  -5.379 -15.182  -3.429
  415   1HE   LYS  56          1HE       LYS  56  -7.437 -13.857  -4.009
  416   2HE   LYS  56          2HE       LYS  56  -6.399 -12.486  -4.457
  417   1HZ   LYS  56          3HZ       LYS  56  -5.398 -13.900  -6.130
  418   2HZ   LYS  56          2HZ       LYS  56  -6.454 -15.105  -5.770
  419   3HZ   LYS  56          1HZ       LYS  56  -7.018 -13.679  -6.375
  420    H    VAL  57           HN       VAL  57  -3.858 -10.100   0.556
  421    HA   VAL  57           HA       VAL  57  -3.240  -8.925  -2.126
  422    HB   VAL  57           HB       VAL  57  -4.967  -7.708   0.053
  423   1HG1  VAL  57          1HG11     VAL  57  -4.392  -6.872  -2.830
  424   2HG1  VAL  57          3HG13     VAL  57  -5.614  -6.136  -1.803
  425   3HG1  VAL  57          2HG12     VAL  57  -3.895  -6.044  -1.372
  426   1HG2  VAL  57          1HG21     VAL  57  -5.819  -9.372  -2.324
  427   2HG2  VAL  57          3HG23     VAL  57  -6.322  -9.476  -0.635
  428   3HG2  VAL  57          2HG22     VAL  57  -6.874  -8.124  -1.632
  429    H    ILE  58           HN       ILE  58  -1.558  -7.411  -2.059
  430    HA   ILE  58           HA       ILE  58  -0.338  -6.919   0.671
  431    HB   ILE  58           HB       ILE  58   1.127  -6.789  -1.970
  432   1HG1  ILE  58          1HG11     ILE  58   0.534  -9.125  -1.753
  433   2HG1  ILE  58          2HG12     ILE  58   2.250  -8.909  -1.402
  434   1HG2  ILE  58          1HG21     ILE  58   2.056  -6.834   0.919
  435   2HG2  ILE  58          3HG23     ILE  58   3.095  -6.821  -0.522
  436   3HG2  ILE  58          2HG22     ILE  58   2.049  -5.443  -0.184
  437   1HD1  ILE  58          1HD11     ILE  58   1.787  -9.083   1.030
  438   2HD1  ILE  58          3HD13     ILE  58   0.059  -9.328   0.668
  439   3HD1  ILE  58          2HD12     ILE  58   1.257 -10.509   0.125
  440    H    PHE  59           HN       PHE  59  -0.904  -4.889   1.309
  441    HA   PHE  59           HA       PHE  59  -1.421  -2.801  -0.770
  442   1HB   PHE  59          1HB       PHE  59  -2.335  -2.970   2.132
  443   2HB   PHE  59          2HB       PHE  59  -2.453  -1.542   1.142
  444    HD1  PHE  59           HD2      PHE  59  -3.557  -5.159   1.143
  445    HD2  PHE  59           HD1      PHE  59  -4.503  -1.064   0.285
  446    HE1  PHE  59           HE2      PHE  59  -5.903  -5.768   0.690
  447    HE2  PHE  59           HE1      PHE  59  -6.714  -1.738  -0.600
  448    HZ   PHE  59           HZ       PHE  59  -7.475  -4.085  -0.282
  449    H    LEU  60           HN       LEU  60   0.278  -1.771  -1.166
  450    HA   LEU  60           HA       LEU  60   2.327  -1.338   0.927
  451   1HB   LEU  60          2HB       LEU  60   2.201  -2.457  -1.715
  452   2HB   LEU  60          1HB       LEU  60   3.157  -1.034  -1.871
  453    HG   LEU  60           HG       LEU  60   3.492  -3.112   0.348
  454   1HD1  LEU  60          3HD13     LEU  60   4.765  -3.055  -2.386
  455   2HD1  LEU  60          2HD12     LEU  60   5.225  -4.152  -1.045
  456   3HD1  LEU  60          1HD11     LEU  60   3.598  -4.239  -1.751
  457   1HD2  LEU  60          1HD21     LEU  60   4.664  -0.919   0.738
  458   2HD2  LEU  60          3HD23     LEU  60   5.807  -2.255   0.523
  459   3HD2  LEU  60          2HD22     LEU  60   5.505  -1.121  -0.809
  460    H    LYS  61           HN       LYS  61   2.158   0.545   1.819
  461    HA   LYS  61           HA       LYS  61   1.232   2.963   0.313
  462   1HB   LYS  61          2HB       LYS  61   1.571   2.225   3.221
  463   2HB   LYS  61          1HB       LYS  61   1.528   3.937   2.743
  464   1HG   LYS  61          2HG       LYS  61  -0.572   3.771   1.716
  465   2HG   LYS  61          1HG       LYS  61  -0.512   1.993   1.709
  466   1HD   LYS  61          2HD       LYS  61  -0.551   3.368   4.371
  467   2HD   LYS  61          1HD       LYS  61  -2.052   3.337   3.443
  468   1HE   LYS  61          1HE       LYS  61  -0.449   0.806   3.906
  469   2HE   LYS  61          2HE       LYS  61  -1.701   1.365   5.037
  470   1HZ   LYS  61          2HZ       LYS  61  -3.236   1.318   3.173
  471   2HZ   LYS  61          3HZ       LYS  61  -2.066   0.683   2.207
  472   3HZ   LYS  61          1HZ       LYS  61  -2.620  -0.170   3.495
  473    H    VAL  62           HN       VAL  62   2.921   3.399  -1.059
  474    HA   VAL  62           HA       VAL  62   5.666   3.528   0.098
  475    HB   VAL  62           HB       VAL  62   4.709   3.437  -2.796
  476   1HG1  VAL  62          1HG11     VAL  62   7.484   3.422  -1.544
  477   2HG1  VAL  62          3HG13     VAL  62   7.139   3.134  -3.258
  478   3HG1  VAL  62          2HG12     VAL  62   6.833   4.732  -2.557
  479   1HG2  VAL  62          1HG21     VAL  62   6.098   1.400  -1.001
  480   2HG2  VAL  62          3HG23     VAL  62   4.434   1.292  -1.612
  481   3HG2  VAL  62          2HG22     VAL  62   5.796   1.219  -2.740
  482    H    ASP  63           HN       ASP  63   5.874   5.438   1.133
  483    HA   ASP  63           HA       ASP  63   4.869   7.964   0.078
  484   1HB   ASP  63          1HB       ASP  63   6.791   7.275   2.335
  485   2HB   ASP  63          2HB       ASP  63   6.286   8.916   1.918
  486    H    VAL  64           HN       VAL  64   5.743   8.424  -1.933
  487    HA   VAL  64           HA       VAL  64   8.276   7.678  -2.868
  488    HB   VAL  64           HB       VAL  64   7.979   9.267  -4.646
  489   1HG1  VAL  64          3HG13     VAL  64   6.520   7.209  -4.569
  490   2HG1  VAL  64          1HG11     VAL  64   5.204   8.214  -3.958
  491   3HG1  VAL  64          2HG12     VAL  64   5.895   8.546  -5.548
  492   1HG2  VAL  64          1HG21     VAL  64   5.884  10.582  -2.911
  493   2HG2  VAL  64          3HG23     VAL  64   7.346  11.310  -3.594
  494   3HG2  VAL  64          2HG22     VAL  64   6.010  10.853  -4.660
  495    H    ASP  65           HN       ASP  65   7.457  10.517  -0.865
  496    HA   ASP  65           HA       ASP  65   9.884  11.961  -1.325
  497   1HB   ASP  65          2HB       ASP  65   9.385  13.024   0.878
  498   2HB   ASP  65          1HB       ASP  65   8.051  13.070  -0.278
  499    H    ALA  66           HN       ALA  66   9.208   9.057   0.552
  500    HA   ALA  66           HA       ALA  66  11.892   9.167   1.856
  501   1HB   ALA  66          2HB       ALA  66   9.496   7.318   2.245
  502   2HB   ALA  66          1HB       ALA  66  11.039   7.218   3.117
  503   3HB   ALA  66          3HB       ALA  66   9.996   8.642   3.313
  504    H    VAL  67           HN       VAL  67   9.788   6.868   0.067
  505    HA   VAL  67           HA       VAL  67  12.126   5.270  -0.779
  506    HB   VAL  67           HB       VAL  67   9.111   4.945  -0.955
  507   1HG1  VAL  67          1HG21     VAL  67  11.276   3.279  -2.191
  508   2HG1  VAL  67          3HG23     VAL  67   9.863   2.461  -1.485
  509   3HG1  VAL  67          2HG22     VAL  67   9.616   3.663  -2.744
  510   1HG2  VAL  67          2HG12     VAL  67  10.187   4.651   1.310
  511   2HG2  VAL  67          3HG13     VAL  67   9.526   3.144   0.678
  512   3HG2  VAL  67          1HG11     VAL  67  11.263   3.436   0.608
  513    H    ALA  68           HN       ALA  68  12.640   7.556  -1.739
  514    HA   ALA  68           HA       ALA  68  11.482   8.464  -4.134
  515   1HB   ALA  68          3HB       ALA  68  12.996   9.790  -2.731
  516   2HB   ALA  68          2HB       ALA  68  14.358   8.727  -3.146
  517   3HB   ALA  68          1HB       ALA  68  13.590   9.724  -4.401
  518    H    ALA  69           HN       ALA  69  14.452   6.460  -3.835
  519    HA   ALA  69           HA       ALA  69  15.132   6.211  -6.496
  520   1HB   ALA  69          2HB       ALA  69  16.471   5.330  -4.632
  521   2HB   ALA  69          1HB       ALA  69  15.279   4.038  -4.360
  522   3HB   ALA  69          3HB       ALA  69  16.211   4.087  -5.870
  523    H    VAL  70           HN       VAL  70  12.877   4.095  -4.713
  524    HA   VAL  70           HA       VAL  70  12.228   2.381  -6.921
  525    HB   VAL  70           HB       VAL  70  10.683   3.091  -4.433
  526   1HG1  VAL  70          3HG23     VAL  70   9.268   1.927  -6.108
  527   2HG1  VAL  70          2HG22     VAL  70  10.445   0.600  -6.136
  528   3HG1  VAL  70          1HG21     VAL  70   9.534   0.973  -4.647
  529   1HG2  VAL  70          2HG12     VAL  70  12.664   0.827  -4.922
  530   2HG2  VAL  70          3HG13     VAL  70  12.903   2.198  -3.818
  531   3HG2  VAL  70          1HG11     VAL  70  11.656   0.997  -3.469
  532    H    ALA  71           HN       ALA  71  10.614   5.269  -5.468
  533    HA   ALA  71           HA       ALA  71   8.354   5.322  -7.144
  534   1HB   ALA  71          2HB       ALA  71   8.700   6.708  -5.113
  535   2HB   ALA  71          3HB       ALA  71   9.858   7.719  -5.998
  536   3HB   ALA  71          1HB       ALA  71   8.166   7.661  -6.518
  537    H    GLU  72           HN       GLU  72  11.530   6.995  -7.674
  538    HA   GLU  72           HA       GLU  72  10.678   8.045 -10.228
  539   1HB   GLU  72          1HB       GLU  72  12.974   8.659 -10.603
  540   2HB   GLU  72          2HB       GLU  72  12.463   9.098  -8.971
  541   1HG   GLU  72          2HG       GLU  72  13.648   7.070  -8.112
  542   2HG   GLU  72          1HG       GLU  72  14.272   6.760  -9.740
  543    H    ALA  73           HN       ALA  73  12.533   5.060  -9.306
  544    HA   ALA  73           HA       ALA  73  13.025   4.150 -11.929
  545   1HB   ALA  73          3HB       ALA  73  13.993   3.120  -9.910
  546   2HB   ALA  73          1HB       ALA  73  12.391   2.514  -9.432
  547   3HB   ALA  73          2HB       ALA  73  13.167   1.911 -10.909
  548    H    ALA  74           HN       ALA  74  10.109   3.740  -9.891
  549    HA   ALA  74           HA       ALA  74   8.657   2.142 -11.817
  550   1HB   ALA  74          1HB       ALA  74   7.738   3.736  -9.388
  551   2HB   ALA  74          2HB       ALA  74   6.763   2.544 -10.274
  552   3HB   ALA  74          3HB       ALA  74   8.223   2.030  -9.407
  553    H    GLY  75           HN       GLY  75   9.477   5.471 -11.846
  554   1HA   GLY  75          1HA       GLY  75   8.914   7.097 -13.320
  555   2HA   GLY  75          2HA       GLY  75   7.774   5.985 -14.100
  556    H    ILE  76           HN       ILE  76   7.732   6.975 -10.629
  557    HA   ILE  76           HA       ILE  76   4.941   7.834 -10.969
  558    HB   ILE  76           HB       ILE  76   6.759   8.030  -8.532
  559   1HG1  ILE  76          1HG11     ILE  76   6.525   5.707  -9.289
  560   2HG1  ILE  76          2HG12     ILE  76   5.735   5.989  -7.747
  561   1HG2  ILE  76          3HG23     ILE  76   3.748   8.343  -8.933
  562   2HG2  ILE  76          2HG22     ILE  76   4.486   8.059  -7.348
  563   3HG2  ILE  76          1HG21     ILE  76   4.887   9.518  -8.251
  564   1HD1  ILE  76          1HD11     ILE  76   4.342   5.768 -10.462
  565   2HD1  ILE  76          2HD12     ILE  76   4.451   4.516  -9.225
  566   3HD1  ILE  76          3HD13     ILE  76   3.535   5.989  -8.888
  567    H    THR  77           HN       THR  77   4.173   9.868 -10.955
  568    HA   THR  77           HA       THR  77   6.047  12.182 -10.727
  569    HB   THR  77           HB       THR  77   4.909  13.149 -12.740
  570    HG1  THR  77           HG1      THR  77   3.885  11.466 -14.095
  571   1HG2  THR  77          1HG21     THR  77   7.128  11.973 -12.909
  572   2HG2  THR  77          3HG23     THR  77   6.271  10.481 -13.348
  573   3HG2  THR  77          2HG22     THR  77   6.174  11.902 -14.400
  574    H    ALA  78           HN       ALA  78   2.685  11.991 -11.748
  575    HA   ALA  78           HA       ALA  78   1.867  14.044  -9.857
  576   1HB   ALA  78          1HB       ALA  78   0.255  12.292 -11.759
  577   2HB   ALA  78          2HB       ALA  78  -0.350  13.725 -10.899
  578   3HB   ALA  78          3HB       ALA  78   0.929  13.896 -12.117
  579    H    MET  79           HN       MET  79   2.672  12.720  -7.970
  580    HA   MET  79           HA       MET  79   1.270  10.487  -7.011
  581   1HB   MET  79          1HB       MET  79   2.204  10.967  -4.844
  582   2HB   MET  79          2HB       MET  79   3.410  11.310  -6.080
  583   1HG   MET  79          1HG       MET  79   1.709  13.433  -4.693
  584   2HG   MET  79          2HG       MET  79   3.304  12.930  -4.179
  585   1HE   MET  79          3HE       MET  79   2.244  15.933  -4.817
  586   2HE   MET  79          2HE       MET  79   2.694  16.536  -6.428
  587   3HE   MET  79          1HE       MET  79   1.336  15.402  -6.255
  588    HA   PRO  80           HA       PRO  80   0.293   9.660  -5.034
  589   1HB   PRO  80          2HB       PRO  80  -2.053   8.429  -4.438
  590   2HB   PRO  80          1HB       PRO  80  -1.331   9.672  -3.376
  591   1HG   PRO  80          1HG       PRO  80  -3.494  10.060  -5.456
  592   2HG   PRO  80          2HG       PRO  80  -3.475  10.626  -3.760
  593   1HD   PRO  80          2HD       PRO  80  -2.736  12.228  -5.891
  594   2HD   PRO  80          1HD       PRO  80  -1.984  12.383  -4.284
  595    H    THR  81           HN       THR  81   0.153   7.507  -6.007
  596    HA   THR  81           HA       THR  81  -1.333   7.284  -8.587
  597    HB   THR  81           HB       THR  81   1.678   7.198  -8.201
  598    HG1  THR  81           HG1      THR  81   0.090   9.175  -8.846
  599   1HG2  THR  81          3HG23     THR  81  -0.011   6.450 -10.637
  600   2HG2  THR  81          1HG21     THR  81   1.744   6.726 -10.668
  601   3HG2  THR  81          2HG22     THR  81   1.077   5.392  -9.710
  602    H    PHE  82           HN       PHE  82  -2.325   5.362  -8.487
  603    HA   PHE  82           HA       PHE  82  -1.418   3.290  -6.594
  604   1HB   PHE  82          2HB       PHE  82  -3.956   3.784  -8.140
  605   2HB   PHE  82          1HB       PHE  82  -3.668   2.301  -7.253
  606    HD1  PHE  82           HD2      PHE  82  -4.105   6.004  -6.940
  607    HD2  PHE  82           HD1      PHE  82  -3.541   2.310  -4.777
  608    HE1  PHE  82           HE2      PHE  82  -4.626   7.159  -4.827
  609    HE2  PHE  82           HE1      PHE  82  -4.214   3.448  -2.680
  610    HZ   PHE  82           HZ       PHE  82  -4.653   5.879  -2.681
  611    H    HIS  83           HN       HIS  83  -0.171   1.587  -7.403
  612    HA   HIS  83           HA       HIS  83  -0.491   0.828 -10.308
  613   1HB   HIS  83          1HB       HIS  83   1.891   0.716  -8.431
  614   2HB   HIS  83          2HB       HIS  83   1.785  -0.243  -9.896
  615    HD2  HIS  83           HD2      HIS  83   0.461   3.245 -10.654
  616    HE1  HIS  83           HE1      HIS  83   4.567   3.228 -11.644
  617    HE2  HIS  83           HE2      HIS  83   2.380   4.515 -11.901
  618    H    VAL  84           HN       VAL  84  -0.600  -1.469 -10.700
  619    HA   VAL  84           HA       VAL  84  -0.907  -3.165  -8.269
  620    HB   VAL  84           HB       VAL  84  -2.450  -3.556 -10.857
  621   1HG1  VAL  84          1HG21     VAL  84  -2.590  -4.788  -8.059
  622   2HG1  VAL  84          2HG22     VAL  84  -3.744  -5.099  -9.355
  623   3HG1  VAL  84          3HG23     VAL  84  -2.062  -5.603  -9.546
  624   1HG2  VAL  84          2HG12     VAL  84  -3.365  -2.289  -8.239
  625   2HG2  VAL  84          1HG11     VAL  84  -3.316  -1.506  -9.838
  626   3HG2  VAL  84          3HG13     VAL  84  -4.443  -2.839  -9.536
  627    H    TYR  85           HN       TYR  85   0.552  -4.814  -8.259
  628    HA   TYR  85           HA       TYR  85   2.007  -5.446 -10.797
  629   1HB   TYR  85          1HB       TYR  85   2.916  -5.432  -7.908
  630   2HB   TYR  85          2HB       TYR  85   3.731  -6.354  -9.164
  631    HD1  TYR  85           HD2      TYR  85   2.559  -2.816  -8.549
  632    HD2  TYR  85           HD1      TYR  85   5.503  -5.427 -10.319
  633    HE1  TYR  85           HE2      TYR  85   3.962  -0.853  -9.150
  634    HE2  TYR  85           HE1      TYR  85   6.870  -3.471 -10.937
  635    HH   TYR  85           HH       TYR  85   7.096  -1.180 -10.817
  636    H    LYS  86           HN       LYS  86   1.202  -7.275 -11.653
  637    HA   LYS  86           HA       LYS  86   0.369  -9.539  -9.874
  638   1HB   LYS  86          1HB       LYS  86  -0.120  -9.053 -12.834
  639   2HB   LYS  86          2HB       LYS  86  -0.483 -10.552 -12.003
  640   1HG   LYS  86          1HG       LYS  86  -1.721  -7.836 -11.358
  641   2HG   LYS  86          2HG       LYS  86  -2.466  -9.134 -12.290
  642   1HD   LYS  86          1HD       LYS  86  -1.825  -9.142  -9.315
  643   2HD   LYS  86          2HD       LYS  86  -3.407  -9.163 -10.097
  644   1HE   LYS  86          1HE       LYS  86  -1.386 -11.436 -10.061
  645   2HE   LYS  86          2HE       LYS  86  -2.959 -11.346  -9.252
  646   1HZ   LYS  86          2HZ       LYS  86  -2.598 -11.315 -12.163
  647   2HZ   LYS  86          1HZ       LYS  86  -3.001 -12.638 -11.277
  648   3HZ   LYS  86          3HZ       LYS  86  -4.040 -11.369 -11.364
  649    H    ASP  87           HN       ASP  87   1.462 -11.448 -10.094
  650    HA   ASP  87           HA       ASP  87   3.077 -12.953 -10.393
  651   1HB   ASP  87          1HB       ASP  87   2.380 -12.842 -12.758
  652   2HB   ASP  87          2HB       ASP  87   3.569 -11.578 -13.079
  653    H    GLY  88           HN       GLY  88   4.373 -10.086 -11.802
  654   1HA   GLY  88          1HA       GLY  88   6.146  -9.216  -9.800
  655   2HA   GLY  88          2HA       GLY  88   7.083 -10.281 -10.868
  656    H    VAL  89           HN       VAL  89   4.318  -8.217 -11.976
  657    HA   VAL  89           HA       VAL  89   6.146  -6.184 -13.024
  658    HB   VAL  89           HB       VAL  89   6.327  -7.979 -14.685
  659   1HG1  VAL  89          2HG12     VAL  89   4.181  -9.154 -14.334
  660   2HG1  VAL  89          3HG13     VAL  89   3.302  -7.778 -15.034
  661   3HG1  VAL  89          1HG11     VAL  89   4.420  -8.724 -16.030
  662   1HG2  VAL  89          1HG21     VAL  89   6.356  -5.608 -15.429
  663   2HG2  VAL  89          2HG22     VAL  89   5.778  -6.731 -16.670
  664   3HG2  VAL  89          3HG23     VAL  89   4.618  -5.719 -15.797
  665    H    LYS  90           HN       LYS  90   5.122  -4.315 -13.547
  666    HA   LYS  90           HA       LYS  90   2.723  -3.585 -12.261
  667   1HB   LYS  90          2HB       LYS  90   4.665  -2.134 -12.985
  668   2HB   LYS  90          1HB       LYS  90   4.062  -2.241 -14.645
  669   1HG   LYS  90          1HG       LYS  90   1.831  -1.302 -13.690
  670   2HG   LYS  90          2HG       LYS  90   2.747  -0.953 -12.216
  671   1HD   LYS  90          1HD       LYS  90   3.267   0.113 -15.033
  672   2HD   LYS  90          2HD       LYS  90   2.644   1.017 -13.644
  673   1HE   LYS  90          1HE       LYS  90   4.837   0.591 -12.453
  674   2HE   LYS  90          2HE       LYS  90   5.459  -0.151 -13.934
  675   1HZ   LYS  90          1HZ       LYS  90   4.445   2.591 -13.790
  676   2HZ   LYS  90          3HZ       LYS  90   6.031   2.190 -13.689
  677   3HZ   LYS  90          2HZ       LYS  90   5.186   1.875 -15.072
  678    H    ALA  91           HN       ALA  91   0.824  -4.550 -12.794
  679    HA   ALA  91           HA       ALA  91   0.233  -5.411 -15.555
  680   1HB   ALA  91          3HB       ALA  91  -0.071  -6.947 -13.661
  681   2HB   ALA  91          2HB       ALA  91  -1.235  -5.826 -12.916
  682   3HB   ALA  91          1HB       ALA  91  -1.619  -6.609 -14.465
  683    H    ASP  92           HN       ASP  92  -0.939  -3.085 -13.130
  684    HA   ASP  92           HA       ASP  92  -2.516  -1.683 -15.158
  685   1HB   ASP  92          1HB       ASP  92  -3.956  -3.613 -14.347
  686   2HB   ASP  92          2HB       ASP  92  -3.879  -2.906 -12.721
  687    H    ASP  93           HN       ASP  93  -3.607   0.298 -14.022
  688    HA   ASP  93           HA       ASP  93  -2.552   1.080 -11.479
  689   1HB   ASP  93          2HB       ASP  93  -1.132   2.947 -12.195
  690   2HB   ASP  93          1HB       ASP  93  -0.495   1.463 -12.871
  691    H    LEU  94           HN       LEU  94  -2.904   3.445 -11.127
  692    HA   LEU  94           HA       LEU  94  -4.978   4.845 -12.626
  693   1HB   LEU  94          2HB       LEU  94  -6.374   3.437 -11.321
  694   2HB   LEU  94          1HB       LEU  94  -5.429   3.659  -9.853
  695    HG   LEU  94           HG       LEU  94  -7.647   4.741  -9.952
  696   1HD1  LEU  94          3HD23     LEU  94  -5.949   5.473  -8.328
  697   2HD1  LEU  94          1HD21     LEU  94  -5.526   6.825  -9.408
  698   3HD1  LEU  94          2HD22     LEU  94  -7.140   6.708  -8.745
  699   1HD2  LEU  94          3HD13     LEU  94  -7.554   5.541 -12.307
  700   2HD2  LEU  94          2HD12     LEU  94  -7.989   6.830 -11.164
  701   3HD2  LEU  94          1HD11     LEU  94  -6.353   6.757 -11.833
  702    H    VAL  95           HN       VAL  95  -3.903   6.790 -12.761
  703    HA   VAL  95           HA       VAL  95  -2.066   7.642 -10.637
  704    HB   VAL  95           HB       VAL  95  -2.955   9.251 -13.003
  705   1HG1  VAL  95          3HG13     VAL  95  -1.589  10.409 -11.289
  706   2HG1  VAL  95          2HG12     VAL  95  -0.309   9.199 -11.520
  707   3HG1  VAL  95          1HG11     VAL  95  -0.756  10.286 -12.843
  708   1HG2  VAL  95          3HG23     VAL  95  -0.760   7.121 -12.971
  709   2HG2  VAL  95          1HG21     VAL  95  -2.203   7.124 -14.007
  710   3HG2  VAL  95          2HG22     VAL  95  -0.950   8.339 -14.247
  711    H    GLY  96           HN       GLY  96  -2.555   9.447  -9.196
  712   1HA   GLY  96          1HA       GLY  96  -3.794  11.229  -8.428
  713   2HA   GLY  96          2HA       GLY  96  -5.098  10.884  -9.575
  714    H    ALA  97           HN       ALA  97  -6.627  11.074  -7.842
  715    HA   ALA  97           HA       ALA  97  -6.678   8.841  -5.850
  716   1HB   ALA  97          3HB       ALA  97  -6.325  11.095  -4.875
  717   2HB   ALA  97          1HB       ALA  97  -7.824  11.654  -5.640
  718   3HB   ALA  97          2HB       ALA  97  -7.886  10.383  -4.402
  719    H    SER  98           HN       SER  98  -8.272   7.414  -6.266
  720    HA   SER  98           HA       SER  98 -10.976   8.255  -7.010
  721   1HB   SER  98          1HB       SER  98  -9.393   6.450  -8.881
  722   2HB   SER  98          2HB       SER  98 -11.109   6.858  -9.007
  723    HG   SER  98           HG       SER  98  -9.837   9.150  -8.878
  724    H    GLN  99           HN       GLN  99 -11.146   7.411  -4.828
  725    HA   GLN  99           HA       GLN  99 -10.326   4.826  -4.025
  726   1HB   GLN  99          2HB       GLN  99 -12.252   5.011  -2.338
  727   2HB   GLN  99          1HB       GLN  99 -10.900   6.127  -2.233
  728   1HG   GLN  99          1HG       GLN  99 -13.413   6.954  -3.708
  729   2HG   GLN  99          2HG       GLN  99 -13.342   7.008  -1.947
  730   1HE2  GLN  99          1HE21     GLN  99 -11.075   9.761  -1.780
  731   2HE2  GLN  99          2HE22     GLN  99 -11.718   8.405  -0.874
  732    H    ASP 100           HN       ASP 100 -13.148   5.740  -5.958
  733    HA   ASP 100           HA       ASP 100 -14.593   3.256  -5.691
  734   1HB   ASP 100          1HB       ASP 100 -15.744   3.993  -7.713
  735   2HB   ASP 100          2HB       ASP 100 -15.635   5.322  -6.553
  736    H    LYS 101           HN       LYS 101 -12.214   4.540  -8.039
  737    HA   LYS 101           HA       LYS 101 -12.044   2.157  -9.597
  738   1HB   LYS 101          2HB       LYS 101 -11.290   4.466 -10.321
  739   2HB   LYS 101          1HB       LYS 101  -9.949   4.315  -9.186
  740   1HG   LYS 101          1HG       LYS 101  -9.170   3.863 -11.397
  741   2HG   LYS 101          2HG       LYS 101  -9.027   2.403 -10.408
  742   1HD   LYS 101          2HD       LYS 101 -11.151   1.551 -11.508
  743   2HD   LYS 101          1HD       LYS 101 -11.142   2.995 -12.535
  744   1HE   LYS 101          2HE       LYS 101  -9.012   0.800 -12.379
  745   2HE   LYS 101          1HE       LYS 101 -10.159   1.063 -13.699
  746   1HZ   LYS 101          1HZ       LYS 101  -9.093   3.177 -14.101
  747   2HZ   LYS 101          3HZ       LYS 101  -8.004   2.889 -12.897
  748   3HZ   LYS 101          2HZ       LYS 101  -8.025   1.928 -14.227
  749    H    LEU 102           HN       LEU 102 -10.298   3.338  -6.723
  750    HA   LEU 102           HA       LEU 102  -8.291   1.389  -6.565
  751   1HB   LEU 102          2HB       LEU 102  -8.624   3.477  -5.192
  752   2HB   LEU 102          1HB       LEU 102  -9.813   2.615  -4.224
  753    HG   LEU 102           HG       LEU 102  -8.221   1.131  -3.297
  754   1HD1  LEU 102          2HD22     LEU 102  -6.275   2.302  -5.319
  755   2HD1  LEU 102          1HD21     LEU 102  -5.764   1.379  -3.886
  756   3HD1  LEU 102          3HD23     LEU 102  -6.745   0.598  -5.125
  757   1HD2  LEU 102          2HD12     LEU 102  -8.423   3.403  -2.346
  758   2HD2  LEU 102          3HD13     LEU 102  -6.760   2.831  -2.178
  759   3HD2  LEU 102          1HD11     LEU 102  -7.160   3.996  -3.443
  760    H    LYS 103           HN       LYS 103 -11.517   1.375  -4.995
  761    HA   LYS 103           HA       LYS 103 -11.476  -1.233  -3.917
  762   1HB   LYS 103          2HB       LYS 103 -13.736   0.438  -5.101
  763   2HB   LYS 103          1HB       LYS 103 -13.993  -1.076  -4.235
  764   1HG   LYS 103          1HG       LYS 103 -13.110  -0.198  -2.197
  765   2HG   LYS 103          2HG       LYS 103 -12.512   1.271  -2.983
  766   1HD   LYS 103          2HD       LYS 103 -14.885   1.844  -3.610
  767   2HD   LYS 103          1HD       LYS 103 -15.442   0.470  -2.645
  768   1HE   LYS 103          2HE       LYS 103 -13.856   2.884  -1.627
  769   2HE   LYS 103          1HE       LYS 103 -15.595   2.626  -1.420
  770   1HZ   LYS 103          1HZ       LYS 103 -15.080   0.647  -0.161
  771   2HZ   LYS 103          2HZ       LYS 103 -13.465   0.942  -0.313
  772   3HZ   LYS 103          3HZ       LYS 103 -14.417   1.991   0.523
  773    H    ALA 104           HN       ALA 104 -12.619  -0.127  -7.142
  774    HA   ALA 104           HA       ALA 104 -13.289  -2.658  -8.186
  775   1HB   ALA 104          1HB       ALA 104 -13.905  -0.477  -9.208
  776   2HB   ALA 104          2HB       ALA 104 -12.217  -0.242  -9.708
  777   3HB   ALA 104          3HB       ALA 104 -13.157  -1.587 -10.373
  778    H    LEU 105           HN       LEU 105 -10.102  -0.972  -8.225
  779    HA   LEU 105           HA       LEU 105  -8.744  -2.830  -9.896
  780   1HB   LEU 105          1HB       LEU 105  -7.814  -0.908  -7.734
  781   2HB   LEU 105          2HB       LEU 105  -6.681  -1.963  -8.561
  782    HG   LEU 105           HG       LEU 105  -8.495  -0.119 -10.140
  783   1HD1  LEU 105          1HD21     LEU 105  -5.761   0.489  -8.921
  784   2HD1  LEU 105          2HD22     LEU 105  -6.550   1.459 -10.180
  785   3HD1  LEU 105          3HD23     LEU 105  -7.288   1.331  -8.578
  786   1HD2  LEU 105          1HD11     LEU 105  -7.263  -1.912 -11.372
  787   2HD2  LEU 105          3HD13     LEU 105  -6.698  -0.288 -11.804
  788   3HD2  LEU 105          2HD12     LEU 105  -5.737  -1.288 -10.710
  789    H    VAL 106           HN       VAL 106  -8.977  -2.636  -6.278
  790    HA   VAL 106           HA       VAL 106  -7.387  -4.957  -5.850
  791    HB   VAL 106           HB       VAL 106  -9.719  -4.002  -4.121
  792   1HG1  VAL 106          1HG21     VAL 106  -7.308  -5.811  -3.579
  793   2HG1  VAL 106          3HG23     VAL 106  -8.394  -5.196  -2.324
  794   3HG1  VAL 106          2HG22     VAL 106  -9.007  -6.305  -3.557
  795   1HG2  VAL 106          3HG13     VAL 106  -7.971  -2.223  -4.436
  796   2HG2  VAL 106          2HG12     VAL 106  -8.031  -2.845  -2.785
  797   3HG2  VAL 106          1HG11     VAL 106  -6.746  -3.375  -3.889
  798    H    ALA 107           HN       ALA 107 -10.924  -4.649  -6.168
  799    HA   ALA 107           HA       ALA 107 -11.567  -7.401  -5.942
  800   1HB   ALA 107          1HB       ALA 107 -13.256  -5.617  -5.941
  801   2HB   ALA 107          2HB       ALA 107 -12.934  -5.268  -7.651
  802   3HB   ALA 107          3HB       ALA 107 -13.631  -6.830  -7.179
  803    H    LYS 108           HN       LYS 108 -11.072  -5.536  -8.962
  804    HA   LYS 108           HA       LYS 108 -11.249  -7.504 -10.897
  805   1HB   LYS 108          2HB       LYS 108 -11.058  -5.195 -11.458
  806   2HB   LYS 108          1HB       LYS 108  -9.497  -5.031 -10.644
  807   1HG   LYS 108          1HG       LYS 108  -8.402  -6.450 -12.324
  808   2HG   LYS 108          2HG       LYS 108  -9.922  -6.648 -13.191
  809   1HD   LYS 108          2HD       LYS 108  -8.520  -3.985 -12.637
  810   2HD   LYS 108          1HD       LYS 108  -8.368  -4.921 -14.132
  811   1HE   LYS 108          1HE       LYS 108 -10.838  -4.679 -14.498
  812   2HE   LYS 108          2HE       LYS 108 -10.925  -3.640 -13.061
  813   1HZ   LYS 108          1HZ       LYS 108  -9.387  -2.154 -14.114
  814   2HZ   LYS 108          3HZ       LYS 108  -9.328  -3.103 -15.458
  815   3HZ   LYS 108          2HZ       LYS 108 -10.738  -2.359 -15.037
  816    H    HIS 109           HN       HIS 109  -8.231  -6.439  -9.256
  817    HA   HIS 109           HA       HIS 109  -6.736  -8.664 -10.455
  818   1HB   HIS 109          1HB       HIS 109  -5.970  -6.373  -8.610
  819   2HB   HIS 109          2HB       HIS 109  -4.831  -7.522  -9.318
  820    HD2  HIS 109           HD2      HIS 109  -6.611  -4.261 -10.276
  821    HE1  HIS 109           HE1      HIS 109  -4.989  -5.842 -13.831
  822    HE2  HIS 109           HE2      HIS 109  -6.105  -3.803 -12.802
  823    H    ALA 110           HN       ALA 110  -8.860  -8.838  -8.012
  824    HA   ALA 110           HA       ALA 110  -7.217 -10.743  -6.397
  825   1HB   ALA 110          2HB       ALA 110  -9.980  -9.563  -5.879
  826   2HB   ALA 110          1HB       ALA 110  -9.151 -10.768  -4.879
  827   3HB   ALA 110          3HB       ALA 110  -8.470  -9.143  -5.038
  828    H    ALA 111           HN       ALA 111 -10.223 -10.291  -8.298
  829    HA   ALA 111           HA       ALA 111 -10.945 -13.074  -8.436
  830   1HB   ALA 111          2HB       ALA 111 -11.619 -10.717 -10.263
  831   2HB   ALA 111          1HB       ALA 111 -12.410 -12.308 -10.291
  832   3HB   ALA 111          3HB       ALA 111 -12.561 -11.266  -8.861
  833    H    ALA 112           HN       ALA 112  -9.345 -10.854 -10.709
  834    HA   ALA 112           HA       ALA 112  -8.129 -13.128 -12.222
  835   1HB   ALA 112          1HB       ALA 112  -9.373 -11.454 -13.592
  836   2HB   ALA 112          3HB       ALA 112  -8.337 -10.168 -12.928
  837   3HB   ALA 112          2HB       ALA 112  -7.629 -11.450 -13.929
   
  No H/Q in entry =         837
  Start of MODEL    5
    1   1H    GLY   1          1HN       GLY   1  -6.848  -7.953   9.414
    2   2H    GLY   1          2HN       GLY   1  -6.370  -6.397   9.518
    3   3H    GLY   1          3HN       GLY   1  -7.977  -6.762   9.765
    4   1HA   GLY   1          1HA       GLY   1  -8.312  -7.306   7.538
    5   2HA   GLY   1          2HA       GLY   1  -7.291  -5.838   7.516
    6    H    GLY   2           HN       GLY   2  -6.834  -7.045   5.253
    7   1HA   GLY   2          1HA       GLY   2  -5.142  -9.367   5.276
    8   2HA   GLY   2          2HA       GLY   2  -5.341  -8.209   3.949
    9    H    SER   3           HN       SER   3  -2.893  -9.014   3.927
   10    HA   SER   3           HA       SER   3  -1.023  -7.766   5.713
   11   1HB   SER   3          2HB       SER   3   0.411  -8.376   3.479
   12   2HB   SER   3          1HB       SER   3  -0.097  -9.571   4.681
   13    HG   SER   3           HG       SER   3  -1.545  -8.930   2.328
   14    H    VAL   4           HN       VAL   4  -2.062  -5.648   5.737
   15    HA   VAL   4           HA       VAL   4  -1.231  -3.914   3.456
   16    HB   VAL   4           HB       VAL   4  -3.528  -3.736   5.426
   17   1HG1  VAL   4          1HG21     VAL   4  -2.406  -1.670   3.578
   18   2HG1  VAL   4          3HG23     VAL   4  -4.169  -1.813   3.691
   19   3HG1  VAL   4          2HG22     VAL   4  -3.194  -1.543   5.144
   20   1HG2  VAL   4          1HG11     VAL   4  -3.412  -4.695   2.557
   21   2HG2  VAL   4          2HG12     VAL   4  -4.279  -5.338   3.928
   22   3HG2  VAL   4          3HG13     VAL   4  -4.866  -3.881   3.139
   23    H    ILE   5           HN       ILE   5   0.395  -2.495   3.907
   24    HA   ILE   5           HA       ILE   5   0.505  -1.297   6.606
   25    HB   ILE   5           HB       ILE   5   2.852  -1.772   6.940
   26   1HG1  ILE   5          1HG11     ILE   5   2.877  -3.665   4.556
   27   2HG1  ILE   5          2HG12     ILE   5   3.410  -1.987   4.419
   28   1HG2  ILE   5          2HG22     ILE   5   1.184  -3.403   7.817
   29   2HG2  ILE   5          3HG23     ILE   5   1.459  -4.425   6.384
   30   3HG2  ILE   5          1HG21     ILE   5   2.772  -4.112   7.528
   31   1HD1  ILE   5          3HD13     ILE   5   5.015  -2.337   6.305
   32   2HD1  ILE   5          2HD12     ILE   5   4.653  -4.074   6.225
   33   3HD1  ILE   5          1HD11     ILE   5   5.368  -3.239   4.830
   34    H    VAL   6           HN       VAL   6   2.345   0.273   6.717
   35    HA   VAL   6           HA       VAL   6   2.649   1.854   4.245
   36    HB   VAL   6           HB       VAL   6   2.690   2.807   7.153
   37   1HG1  VAL   6          1HG21     VAL   6   2.779   4.309   4.505
   38   2HG1  VAL   6          3HG23     VAL   6   2.627   5.075   6.101
   39   3HG1  VAL   6          2HG22     VAL   6   4.092   4.176   5.687
   40   1HG2  VAL   6          2HG12     VAL   6   0.468   3.055   5.081
   41   2HG2  VAL   6          3HG13     VAL   6   0.392   2.218   6.641
   42   3HG2  VAL   6          1HG11     VAL   6   0.543   3.976   6.596
   43    H    ILE   7           HN       ILE   7   4.865   2.217   3.693
   44    HA   ILE   7           HA       ILE   7   6.893   1.535   5.677
   45    HB   ILE   7           HB       ILE   7   6.085  -0.664   4.700
   46   1HG1  ILE   7          1HG11     ILE   7   8.236  -1.603   4.066
   47   2HG1  ILE   7          2HG12     ILE   7   8.966  -0.002   3.945
   48   1HG2  ILE   7          2HG22     ILE   7   5.516   0.191   2.420
   49   2HG2  ILE   7          1HG21     ILE   7   7.250   0.365   2.071
   50   3HG2  ILE   7          3HG23     ILE   7   6.560  -1.234   2.387
   51   1HD1  ILE   7          2HD12     ILE   7   7.695  -1.176   6.471
   52   2HD1  ILE   7          1HD11     ILE   7   9.430  -1.204   6.115
   53   3HD1  ILE   7          3HD13     ILE   7   8.620   0.342   6.378
   54    H    ASP   8           HN       ASP   8   8.963   2.162   5.118
   55    HA   ASP   8           HA       ASP   8   9.245   3.900   2.708
   56   1HB   ASP   8          2HB       ASP   8  10.870   5.163   4.029
   57   2HB   ASP   8          1HB       ASP   8   9.272   5.197   4.781
   58    H    SER   9           HN       SER   9  11.139   2.055   5.028
   59    HA   SER   9           HA       SER   9  13.533   1.668   3.962
   60   1HB   SER   9          1HB       SER   9  11.820  -0.447   5.331
   61   2HB   SER   9          2HB       SER   9  13.590  -0.439   5.240
   62    HG   SER   9           HG       SER   9  11.955   1.542   6.517
   63    H    LYS  10           HN       LYS  10  13.973   1.375   1.866
   64    HA   LYS  10           HA       LYS  10  12.795   0.001  -0.155
   65   1HB   LYS  10          1HB       LYS  10  15.782  -0.045   0.400
   66   2HB   LYS  10          2HB       LYS  10  14.997  -0.304  -1.161
   67   1HG   LYS  10          1HG       LYS  10  14.112   2.040  -1.051
   68   2HG   LYS  10          2HG       LYS  10  15.060   2.298   0.434
   69   1HD   LYS  10          1HD       LYS  10  17.134   1.682  -0.825
   70   2HD   LYS  10          2HD       LYS  10  16.165   1.550  -2.306
   71   1HE   LYS  10          2HE       LYS  10  15.486   3.945  -2.052
   72   2HE   LYS  10          1HE       LYS  10  16.488   4.065  -0.592
   73   1HZ   LYS  10          1HZ       LYS  10  18.395   3.547  -1.931
   74   2HZ   LYS  10          3HZ       LYS  10  17.468   3.443  -3.289
   75   3HZ   LYS  10          2HZ       LYS  10  17.625   4.885  -2.507
   76    H    ALA  11           HN       ALA  11  15.114  -1.375   2.169
   77    HA   ALA  11           HA       ALA  11  15.289  -4.004   1.245
   78   1HB   ALA  11          1HB       ALA  11  16.665  -3.096   3.080
   79   2HB   ALA  11          3HB       ALA  11  15.242  -3.037   4.146
   80   3HB   ALA  11          2HB       ALA  11  15.868  -4.600   3.579
   81    H    ALA  12           HN       ALA  12  12.801  -2.626   3.440
   82    HA   ALA  12           HA       ALA  12  11.448  -5.159   3.890
   83   1HB   ALA  12          3HB       ALA  12  11.336  -3.312   5.518
   84   2HB   ALA  12          2HB       ALA  12  10.528  -2.291   4.307
   85   3HB   ALA  12          1HB       ALA  12   9.720  -3.747   4.922
   86    H    TRP  13           HN       TRP  13  10.991  -2.302   1.802
   87    HA   TRP  13           HA       TRP  13   8.577  -2.999   0.510
   88   1HB   TRP  13          2HB       TRP  13   9.149  -0.914  -0.144
   89   2HB   TRP  13          1HB       TRP  13  10.865  -1.189   0.046
   90    HD1  TRP  13           HD1      TRP  13  12.309  -1.712  -2.029
   91    HE1  TRP  13           HE1      TRP  13  11.930  -1.807  -4.541
   92    HE3  TRP  13           HE3      TRP  13   7.205  -1.215  -2.100
   93    HZ2  TRP  13           HZ2      TRP  13   9.765  -1.508  -6.361
   94    HZ3  TRP  13           HZ3      TRP  13   6.053  -0.929  -4.280
   95    HH2  TRP  13           HH2      TRP  13   7.290  -1.165  -6.408
   96    H    ASP  14           HN       ASP  14  11.902  -3.645  -0.664
   97    HA   ASP  14           HA       ASP  14  11.187  -5.334  -2.814
   98   1HB   ASP  14          2HB       ASP  14  13.740  -5.187  -1.144
   99   2HB   ASP  14          1HB       ASP  14  13.574  -6.149  -2.620
  100    H    ALA  15           HN       ALA  15  12.181  -6.142   0.511
  101    HA   ALA  15           HA       ALA  15  12.156  -8.928   0.285
  102   1HB   ALA  15          2HB       ALA  15  11.394  -7.227   2.695
  103   2HB   ALA  15          3HB       ALA  15  11.763  -8.961   2.732
  104   3HB   ALA  15          1HB       ALA  15  13.022  -7.804   2.272
  105    H    GLN  16           HN       GLN  16   9.443  -6.929   1.530
  106    HA   GLN  16           HA       GLN  16   7.640  -9.133   1.690
  107   1HB   GLN  16          1HB       GLN  16   7.475  -6.895   2.833
  108   2HB   GLN  16          2HB       GLN  16   6.807  -6.233   1.322
  109   1HG   GLN  16          2HG       GLN  16   4.980  -7.959   1.419
  110   2HG   GLN  16          1HG       GLN  16   5.702  -8.636   2.881
  111   1HE2  GLN  16          2HE22     GLN  16   4.671  -5.150   4.317
  112   2HE2  GLN  16          1HE21     GLN  16   6.237  -5.520   3.617
  113    H    LEU  17           HN       LEU  17   8.108  -6.648  -0.858
  114    HA   LEU  17           HA       LEU  17   6.134  -7.321  -2.671
  115   1HB   LEU  17          1HB       LEU  17   7.583  -5.415  -2.956
  116   2HB   LEU  17          2HB       LEU  17   9.014  -6.444  -3.042
  117    HG   LEU  17           HG       LEU  17   8.287  -7.326  -5.234
  118   1HD1  LEU  17          1HD21     LEU  17   6.073  -5.239  -4.954
  119   2HD1  LEU  17          2HD22     LEU  17   6.495  -6.089  -6.455
  120   3HD1  LEU  17          3HD23     LEU  17   5.865  -7.004  -5.080
  121   1HD2  LEU  17          3HD13     LEU  17   9.834  -5.415  -5.048
  122   2HD2  LEU  17          1HD11     LEU  17   8.786  -5.247  -6.468
  123   3HD2  LEU  17          2HD12     LEU  17   8.458  -4.293  -5.006
  124    H    ALA  18           HN       ALA  18   9.407  -8.852  -2.394
  125    HA   ALA  18           HA       ALA  18   8.674 -10.755  -4.523
  126   1HB   ALA  18          3HB       ALA  18  10.955  -9.772  -4.360
  127   2HB   ALA  18          1HB       ALA  18  11.168 -10.514  -2.758
  128   3HB   ALA  18          2HB       ALA  18  11.003 -11.540  -4.201
  129    H    LYS  19           HN       LYS  19   9.387 -11.092  -0.952
  130    HA   LYS  19           HA       LYS  19   9.231 -13.918  -1.028
  131   1HB   LYS  19          2HB       LYS  19   8.934 -13.922   1.308
  132   2HB   LYS  19          1HB       LYS  19  10.141 -12.699   0.897
  133   1HG   LYS  19          1HG       LYS  19   8.863 -10.987   1.717
  134   2HG   LYS  19          2HG       LYS  19   7.340 -11.677   1.212
  135   1HD   LYS  19          2HD       LYS  19   7.286 -11.651   3.548
  136   2HD   LYS  19          1HD       LYS  19   7.537 -13.342   3.125
  137   1HE   LYS  19          2HE       LYS  19   9.747 -11.385   3.973
  138   2HE   LYS  19          1HE       LYS  19   8.906 -12.491   5.069
  139   1HZ   LYS  19          2HZ       LYS  19   9.723 -14.321   3.771
  140   2HZ   LYS  19          3HZ       LYS  19  10.560 -13.293   2.792
  141   3HZ   LYS  19          1HZ       LYS  19  10.954 -13.412   4.384
  142    H    GLY  20           HN       GLY  20   6.626 -11.507  -0.991
  143   1HA   GLY  20          1HA       GLY  20   4.454 -13.123  -0.301
  144   2HA   GLY  20          2HA       GLY  20   4.421 -11.803  -1.484
  145    H    LYS  21           HN       LYS  21   6.313 -13.066  -3.378
  146    HA   LYS  21           HA       LYS  21   5.969 -14.077  -5.415
  147   1HB   LYS  21          2HB       LYS  21   5.429 -16.417  -3.528
  148   2HB   LYS  21          1HB       LYS  21   5.859 -16.530  -5.238
  149   1HG   LYS  21          2HG       LYS  21   8.007 -15.201  -4.642
  150   2HG   LYS  21          1HG       LYS  21   7.531 -15.418  -2.959
  151   1HD   LYS  21          1HD       LYS  21   8.895 -17.225  -3.127
  152   2HD   LYS  21          2HD       LYS  21   7.394 -17.998  -3.642
  153   1HE   LYS  21          1HE       LYS  21   9.631 -16.896  -5.427
  154   2HE   LYS  21          2HE       LYS  21   9.277 -18.602  -5.120
  155   1HZ   LYS  21          1HZ       LYS  21   7.159 -18.281  -6.195
  156   2HZ   LYS  21          2HZ       LYS  21   7.524 -16.706  -6.511
  157   3HZ   LYS  21          3HZ       LYS  21   8.407 -17.910  -7.205
  158    H    GLU  22           HN       GLU  22   3.924 -12.606  -5.055
  159    HA   GLU  22           HA       GLU  22   1.351 -13.953  -4.823
  160   1HB   GLU  22          1HB       GLU  22   2.244 -11.122  -5.472
  161   2HB   GLU  22          2HB       GLU  22   0.568 -11.535  -5.239
  162   1HG   GLU  22          1HG       GLU  22   2.696 -12.011  -3.108
  163   2HG   GLU  22          2HG       GLU  22   1.654 -10.604  -3.202
  164    H    GLU  23           HN       GLU  23   2.351 -15.285  -6.755
  165    HA   GLU  23           HA       GLU  23   2.486 -15.063  -9.329
  166   1HB   GLU  23          1HB       GLU  23   0.446 -16.903  -8.003
  167   2HB   GLU  23          2HB       GLU  23   1.021 -17.049  -9.673
  168   1HG   GLU  23          2HG       GLU  23   3.361 -17.291  -8.826
  169   2HG   GLU  23          1HG       GLU  23   2.748 -17.262  -7.166
  170    H    HIS  24           HN       HIS  24  -0.880 -15.191  -8.107
  171    HA   HIS  24           HA       HIS  24  -1.678 -13.046  -9.995
  172   1HB   HIS  24          2HB       HIS  24  -2.251 -15.249 -11.031
  173   2HB   HIS  24          1HB       HIS  24  -3.220 -15.649  -9.610
  174    HD2  HIS  24           HD2      HIS  24  -5.623 -14.045  -9.341
  175    HE1  HIS  24           HE1      HIS  24  -5.480 -12.676 -13.338
  176    HE2  HIS  24           HE2      HIS  24  -6.963 -12.898 -11.259
  177    H    LYS  25           HN       LYS  25  -0.998 -12.324  -7.597
  178    HA   LYS  25           HA       LYS  25  -3.600 -11.993  -6.211
  179   1HB   LYS  25          2HB       LYS  25  -1.016 -12.898  -4.931
  180   2HB   LYS  25          1HB       LYS  25  -2.300 -12.050  -4.033
  181   1HG   LYS  25          2HG       LYS  25  -3.906 -13.786  -4.729
  182   2HG   LYS  25          1HG       LYS  25  -2.621 -14.636  -5.612
  183   1HD   LYS  25          2HD       LYS  25  -1.330 -14.905  -3.516
  184   2HD   LYS  25          1HD       LYS  25  -2.603 -14.070  -2.611
  185   1HE   LYS  25          1HE       LYS  25  -3.020 -16.610  -4.255
  186   2HE   LYS  25          2HE       LYS  25  -2.717 -16.605  -2.504
  187   1HZ   LYS  25          3HZ       LYS  25  -4.715 -15.298  -2.246
  188   2HZ   LYS  25          2HZ       LYS  25  -5.005 -15.366  -3.866
  189   3HZ   LYS  25          1HZ       LYS  25  -5.034 -16.744  -2.969
  190    HA   PRO  26           HA       PRO  26  -2.261  -7.902  -6.905
  191   1HB   PRO  26          2HB       PRO  26  -4.009  -6.439  -5.418
  192   2HB   PRO  26          1HB       PRO  26  -4.505  -7.433  -6.811
  193   1HG   PRO  26          1HG       PRO  26  -4.593  -8.205  -3.894
  194   2HG   PRO  26          2HG       PRO  26  -5.927  -8.307  -5.082
  195   1HD   PRO  26          2HD       PRO  26  -4.350 -10.463  -4.505
  196   2HD   PRO  26          1HD       PRO  26  -4.880 -10.156  -6.191
  197    H    ILE  27           HN       ILE  27  -0.230  -7.348  -6.313
  198    HA   ILE  27           HA       ILE  27   0.233  -6.535  -3.496
  199    HB   ILE  27           HB       ILE  27   2.103  -6.528  -5.886
  200   1HG1  ILE  27          1HG11     ILE  27   1.824  -8.425  -3.541
  201   2HG1  ILE  27          2HG12     ILE  27   1.544  -8.803  -5.248
  202   1HG2  ILE  27          3HG23     ILE  27   2.539  -4.782  -4.078
  203   2HG2  ILE  27          2HG22     ILE  27   2.755  -6.112  -2.935
  204   3HG2  ILE  27          1HG21     ILE  27   3.840  -5.932  -4.323
  205   1HD1  ILE  27          1HD11     ILE  27   3.965  -8.318  -5.701
  206   2HD1  ILE  27          2HD12     ILE  27   4.205  -8.134  -3.939
  207   3HD1  ILE  27          3HD13     ILE  27   3.715  -9.684  -4.599
  208    H    VAL  28           HN       VAL  28  -0.877  -4.628  -3.178
  209    HA   VAL  28           HA       VAL  28  -1.279  -2.783  -5.486
  210    HB   VAL  28           HB       VAL  28  -2.653  -2.660  -2.779
  211   1HG1  VAL  28          3HG13     VAL  28  -3.226  -1.451  -5.531
  212   2HG1  VAL  28          1HG11     VAL  28  -4.272  -1.293  -4.116
  213   3HG1  VAL  28          2HG12     VAL  28  -2.651  -0.566  -4.108
  214   1HG2  VAL  28          3HG23     VAL  28  -3.550  -4.013  -5.359
  215   2HG2  VAL  28          1HG21     VAL  28  -3.262  -4.806  -3.787
  216   3HG2  VAL  28          2HG22     VAL  28  -4.592  -3.663  -3.970
  217    H    VAL  29           HN       VAL  29   0.229  -1.231  -5.611
  218    HA   VAL  29           HA       VAL  29   1.768  -0.493  -3.164
  219    HB   VAL  29           HB       VAL  29   2.407  -0.452  -6.113
  220   1HG1  VAL  29          3HG13     VAL  29   4.091   0.453  -3.742
  221   2HG1  VAL  29          2HG12     VAL  29   4.620   0.315  -5.442
  222   3HG1  VAL  29          1HG11     VAL  29   3.408   1.517  -4.985
  223   1HG2  VAL  29          2HG22     VAL  29   3.448  -2.031  -3.730
  224   2HG2  VAL  29          1HG21     VAL  29   2.449  -2.665  -5.047
  225   3HG2  VAL  29          3HG23     VAL  29   4.104  -2.125  -5.378
  226    H    ASP  30           HN       ASP  30   1.204   1.371  -2.285
  227    HA   ASP  30           HA       ASP  30  -0.168   3.454  -3.958
  228   1HB   ASP  30          1HB       ASP  30  -1.507   2.814  -2.114
  229   2HB   ASP  30          2HB       ASP  30  -0.172   2.898  -0.984
  230    H    PHE  31           HN       PHE  31   1.411   4.672  -4.865
  231    HA   PHE  31           HA       PHE  31   3.714   5.609  -3.211
  232   1HB   PHE  31          1HB       PHE  31   3.011   5.962  -6.149
  233   2HB   PHE  31          2HB       PHE  31   4.384   6.690  -5.354
  234    HD1  PHE  31           HD2      PHE  31   6.161   5.165  -4.275
  235    HD2  PHE  31           HD1      PHE  31   3.174   3.743  -7.045
  236    HE1  PHE  31           HE2      PHE  31   7.586   3.215  -4.818
  237    HE2  PHE  31           HE1      PHE  31   4.647   1.837  -7.634
  238    HZ   PHE  31           HZ       PHE  31   6.807   1.518  -6.472
  239    H    THR  32           HN       THR  32   2.539   6.936  -1.757
  240    HA   THR  32           HA       THR  32   1.179   9.335  -2.930
  241    HB   THR  32           HB       THR  32   0.563   7.692  -0.459
  242    HG1  THR  32           HG1      THR  32  -0.672   7.272  -2.246
  243   1HG2  THR  32          3HG23     THR  32  -0.287  10.588  -0.965
  244   2HG2  THR  32          2HG22     THR  32  -1.005   9.506   0.240
  245   3HG2  THR  32          1HG21     THR  32   0.677  10.012   0.420
  246    H    ALA  33           HN       ALA  33   1.863  11.298  -2.287
  247    HA   ALA  33           HA       ALA  33   4.500  11.511  -1.066
  248   1HB   ALA  33          3HB       ALA  33   2.507  13.573  -2.075
  249   2HB   ALA  33          2HB       ALA  33   4.127  13.944  -1.442
  250   3HB   ALA  33          1HB       ALA  33   3.958  12.969  -2.904
  251    H    THR  34           HN       THR  34   3.674  10.367   0.896
  252    HA   THR  34           HA       THR  34   2.147  10.902   2.953
  253    HB   THR  34           HB       THR  34   5.207  10.754   2.968
  254    HG1  THR  34           HG1      THR  34   4.501   8.463   3.326
  255   1HG2  THR  34          1HG21     THR  34   3.251  10.068   5.195
  256   2HG2  THR  34          2HG22     THR  34   4.982   9.655   5.164
  257   3HG2  THR  34          3HG23     THR  34   4.496  11.347   5.215
  258    H    TRP  35           HN       TRP  35   4.881  13.037   2.163
  259    HA   TRP  35           HA       TRP  35   4.875  14.696   4.400
  260   1HB   TRP  35          1HB       TRP  35   6.396  14.425   2.262
  261   2HB   TRP  35          2HB       TRP  35   5.497  15.802   1.649
  262    HD1  TRP  35           HD1      TRP  35   8.289  14.630   3.705
  263    HE1  TRP  35           HE1      TRP  35   9.510  16.604   4.920
  264    HE3  TRP  35           HE3      TRP  35   4.912  18.383   2.824
  265    HZ2  TRP  35           HZ2      TRP  35   9.054  19.382   5.410
  266    HZ3  TRP  35           HZ3      TRP  35   5.333  20.670   3.669
  267    HH2  TRP  35           HH2      TRP  35   7.391  21.180   4.960
  268    H    CYS  36           HN       CYS  36   2.739  15.011   1.498
  269    HA   CYS  36           HA       CYS  36   2.133  17.800   2.189
  270   1HB   CYS  36          1HB       CYS  36   0.599  17.759   0.295
  271   2HB   CYS  36          2HB       CYS  36   2.267  17.369  -0.055
  272    H    GLY  37           HN       GLY  37   1.561  16.994   4.399
  273   1HA   GLY  37          1HA       GLY  37  -0.012  16.244   5.990
  274   2HA   GLY  37          2HA       GLY  37  -0.539  17.856   5.526
  275    HA   PRO  38           HA       PRO  38  -4.646  16.440   4.679
  276   1HB   PRO  38          2HB       PRO  38  -4.187  17.567   1.894
  277   2HB   PRO  38          1HB       PRO  38  -5.666  17.673   2.896
  278   1HG   PRO  38          1HG       PRO  38  -3.949  19.762   2.854
  279   2HG   PRO  38          2HG       PRO  38  -4.583  19.188   4.425
  280   1HD   PRO  38          2HD       PRO  38  -1.879  18.653   3.196
  281   2HD   PRO  38          1HD       PRO  38  -2.314  19.017   4.892
  282    H    CYS  39           HN       CYS  39  -2.358  15.834   2.036
  283    HA   CYS  39           HA       CYS  39  -3.526  13.786   0.574
  284   1HB   CYS  39          2HB       CYS  39  -0.622  14.091   1.456
  285   2HB   CYS  39          1HB       CYS  39  -1.178  13.045   0.157
  286    H    LYS  40           HN       LYS  40  -1.936  13.599   3.757
  287    HA   LYS  40           HA       LYS  40  -1.481  10.844   3.980
  288   1HB   LYS  40          2HB       LYS  40  -2.338  12.871   6.089
  289   2HB   LYS  40          1HB       LYS  40  -1.748  11.250   6.445
  290   1HG   LYS  40          2HG       LYS  40   0.425  11.720   5.458
  291   2HG   LYS  40          1HG       LYS  40  -0.091  13.339   4.965
  292   1HD   LYS  40          1HD       LYS  40  -0.569  13.906   7.352
  293   2HD   LYS  40          2HD       LYS  40   0.047  12.322   7.845
  294   1HE   LYS  40          2HE       LYS  40   1.646  14.510   6.423
  295   2HE   LYS  40          1HE       LYS  40   1.730  14.111   8.149
  296   1HZ   LYS  40          1HZ       LYS  40   2.474  11.898   7.476
  297   2HZ   LYS  40          3HZ       LYS  40   2.489  12.406   5.898
  298   3HZ   LYS  40          2HZ       LYS  40   3.501  13.099   6.995
  299    H    MET  41           HN       MET  41  -4.549  12.613   4.190
  300    HA   MET  41           HA       MET  41  -6.078  10.772   5.670
  301   1HB   MET  41          1HB       MET  41  -7.973  11.934   4.883
  302   2HB   MET  41          2HB       MET  41  -6.679  13.117   4.970
  303   1HG   MET  41          1HG       MET  41  -7.715  13.636   2.963
  304   2HG   MET  41          2HG       MET  41  -6.337  12.682   2.432
  305   1HE   MET  41          3HE       MET  41 -10.130  12.670   3.231
  306   2HE   MET  41          1HE       MET  41 -10.725  11.249   2.343
  307   3HE   MET  41          2HE       MET  41  -9.790  11.024   3.833
  308    H    ILE  42           HN       ILE  42  -4.904  10.469   2.382
  309    HA   ILE  42           HA       ILE  42  -6.879   8.557   1.489
  310    HB   ILE  42           HB       ILE  42  -4.031   9.159   0.581
  311   1HG1  ILE  42          1HG11     ILE  42  -6.647  10.109  -0.671
  312   2HG1  ILE  42          2HG12     ILE  42  -5.756  11.084   0.499
  313   1HG2  ILE  42          3HG23     ILE  42  -6.312   7.644  -0.790
  314   2HG2  ILE  42          1HG21     ILE  42  -4.788   8.101  -1.571
  315   3HG2  ILE  42          2HG22     ILE  42  -4.774   6.952  -0.237
  316   1HD1  ILE  42          1HD11     ILE  42  -3.752  11.066  -0.929
  317   2HD1  ILE  42          2HD12     ILE  42  -4.664  10.201  -2.180
  318   3HD1  ILE  42          3HD13     ILE  42  -5.162  11.825  -1.692
  319    H    ALA  43           HN       ALA  43  -3.801   8.365   3.279
  320    HA   ALA  43           HA       ALA  43  -3.222   5.651   2.777
  321   1HB   ALA  43          3HB       ALA  43  -1.602   7.300   3.636
  322   2HB   ALA  43          1HB       ALA  43  -2.443   7.367   5.191
  323   3HB   ALA  43          2HB       ALA  43  -1.675   5.859   4.676
  324    HA   PRO  44           HA       PRO  44  -5.232   4.450   7.006
  325   1HB   PRO  44          1HB       PRO  44  -7.290   5.932   8.029
  326   2HB   PRO  44          2HB       PRO  44  -5.576   6.230   8.445
  327   1HG   PRO  44          2HG       PRO  44  -7.197   7.594   6.270
  328   2HG   PRO  44          1HG       PRO  44  -6.290   8.386   7.579
  329   1HD   PRO  44          1HD       PRO  44  -5.178   8.063   5.194
  330   2HD   PRO  44          2HD       PRO  44  -4.178   7.682   6.623
  331    H    LEU  45           HN       LEU  45  -7.022   6.066   4.407
  332    HA   LEU  45           HA       LEU  45  -9.299   4.285   4.622
  333   1HB   LEU  45          1HB       LEU  45  -8.429   6.546   2.900
  334   2HB   LEU  45          2HB       LEU  45  -9.387   5.324   2.084
  335    HG   LEU  45           HG       LEU  45 -10.107   6.552   4.822
  336   1HD1  LEU  45          2HD22     LEU  45 -10.039   8.324   3.116
  337   2HD1  LEU  45          3HD23     LEU  45 -11.232   7.414   2.150
  338   3HD1  LEU  45          1HD21     LEU  45 -11.674   8.032   3.754
  339   1HD2  LEU  45          1HD11     LEU  45 -11.798   5.013   2.777
  340   2HD2  LEU  45          3HD13     LEU  45 -11.405   4.476   4.417
  341   3HD2  LEU  45          2HD12     LEU  45 -12.471   5.850   4.187
  342    H    PHE  46           HN       PHE  46  -6.432   4.503   2.508
  343    HA   PHE  46           HA       PHE  46  -6.984   2.148   0.976
  344   1HB   PHE  46          2HB       PHE  46  -5.281   3.674   0.326
  345   2HB   PHE  46          1HB       PHE  46  -4.512   3.587   1.883
  346    HD1  PHE  46           HD1      PHE  46  -5.585   1.179  -0.851
  347    HD2  PHE  46           HD2      PHE  46  -2.380   2.440   1.744
  348    HE1  PHE  46           HE1      PHE  46  -4.003  -0.217  -2.121
  349    HE2  PHE  46           HE2      PHE  46  -0.799   1.020   0.465
  350    HZ   PHE  46           HZ       PHE  46  -1.552  -0.138  -1.616
  351    H    GLU  47           HN       GLU  47  -5.497   2.628   4.227
  352    HA   GLU  47           HA       GLU  47  -5.197  -0.195   4.782
  353   1HB   GLU  47          1HB       GLU  47  -5.375   2.240   6.599
  354   2HB   GLU  47          2HB       GLU  47  -4.889   0.628   7.106
  355   1HG   GLU  47          1HG       GLU  47  -2.890   0.675   5.779
  356   2HG   GLU  47          2HG       GLU  47  -3.390   2.118   4.901
  357    H    THR  48           HN       THR  48  -7.940   2.056   5.278
  358    HA   THR  48           HA       THR  48  -9.533   0.350   6.871
  359    HB   THR  48           HB       THR  48 -10.361   2.296   4.677
  360    HG1  THR  48           HG1      THR  48  -9.145   3.028   6.617
  361   1HG2  THR  48          2HG22     THR  48 -12.086   1.182   6.878
  362   2HG2  THR  48          1HG21     THR  48 -12.479   2.528   5.787
  363   3HG2  THR  48          3HG23     THR  48 -12.274   0.904   5.118
  364    H    LEU  49           HN       LEU  49  -9.114   0.453   3.279
  365    HA   LEU  49           HA       LEU  49 -10.852  -1.756   2.773
  366   1HB   LEU  49          1HB       LEU  49  -8.534  -0.538   1.261
  367   2HB   LEU  49          2HB       LEU  49  -9.317  -2.005   0.664
  368    HG   LEU  49           HG       LEU  49 -10.741   0.603   1.206
  369   1HD1  LEU  49          1HD21     LEU  49  -9.135   0.767  -0.670
  370   2HD1  LEU  49          2HD22     LEU  49  -9.864  -0.670  -1.421
  371   3HD1  LEU  49          3HD23     LEU  49 -10.805   0.828  -1.257
  372   1HD2  LEU  49          2HD12     LEU  49 -11.703  -2.014   0.015
  373   2HD2  LEU  49          1HD11     LEU  49 -12.393  -1.116   1.381
  374   3HD2  LEU  49          3HD13     LEU  49 -12.536  -0.468  -0.248
  375    H    SER  50           HN       SER  50  -7.738  -1.861   4.368
  376    HA   SER  50           HA       SER  50  -7.020  -4.551   3.640
  377   1HB   SER  50          2HB       SER  50  -5.682  -4.603   5.585
  378   2HB   SER  50          1HB       SER  50  -5.709  -2.879   5.156
  379    HG   SER  50           HG       SER  50  -7.046  -2.463   6.790
  380    H    ASN  51           HN       ASN  51  -9.284  -3.049   5.883
  381    HA   ASN  51           HA       ASN  51  -9.739  -5.348   7.401
  382   1HB   ASN  51          2HB       ASN  51 -10.436  -3.111   8.188
  383   2HB   ASN  51          1HB       ASN  51 -11.662  -3.010   6.910
  384   1HD2  ASN  51          1HD21     ASN  51 -14.042  -4.937   8.672
  385   2HD2  ASN  51          2HD22     ASN  51 -13.686  -3.969   7.252
  386    H    ASP  52           HN       ASP  52 -11.511  -3.870   4.675
  387    HA   ASP  52           HA       ASP  52 -13.489  -5.783   4.183
  388   1HB   ASP  52          2HB       ASP  52 -11.884  -4.144   2.137
  389   2HB   ASP  52          1HB       ASP  52 -13.414  -4.970   1.847
  390    H    TYR  53           HN       TYR  53 -10.191  -5.541   2.659
  391    HA   TYR  53           HA       TYR  53 -10.525  -8.258   1.560
  392   1HB   TYR  53          1HB       TYR  53  -8.454  -6.067   1.180
  393   2HB   TYR  53          2HB       TYR  53  -8.475  -7.639   0.370
  394    HD1  TYR  53           HD2      TYR  53 -10.631  -8.325  -0.881
  395    HD2  TYR  53           HD1      TYR  53  -9.731  -4.242   0.166
  396    HE1  TYR  53           HE2      TYR  53 -12.183  -7.527  -2.640
  397    HE2  TYR  53           HE1      TYR  53 -11.139  -3.462  -1.688
  398    HH   TYR  53           HH       TYR  53 -12.228  -4.318  -3.813
  399    H    ALA  54           HN       ALA  54 -10.652  -8.794   3.940
  400    HA   ALA  54           HA       ALA  54  -8.171  -9.092   5.414
  401   1HB   ALA  54          2HB       ALA  54 -10.859 -10.496   5.692
  402   2HB   ALA  54          3HB       ALA  54  -9.529 -10.556   6.870
  403   3HB   ALA  54          1HB       ALA  54 -10.349  -9.020   6.537
  404    H    GLY  55           HN       GLY  55  -7.064  -9.884   3.286
  405   1HA   GLY  55          1HA       GLY  55  -6.722 -12.792   3.507
  406   2HA   GLY  55          2HA       GLY  55  -7.466 -12.229   1.995
  407    H    LYS  56           HN       LYS  56  -5.518 -13.249   1.100
  408    HA   LYS  56           HA       LYS  56  -2.880 -12.135   1.545
  409   1HB   LYS  56          1HB       LYS  56  -3.991 -14.186  -0.419
  410   2HB   LYS  56          2HB       LYS  56  -2.279 -13.765  -0.221
  411   1HG   LYS  56          1HG       LYS  56  -2.354 -14.456   2.143
  412   2HG   LYS  56          2HG       LYS  56  -4.051 -14.947   1.963
  413   1HD   LYS  56          2HD       LYS  56  -3.402 -16.551   0.177
  414   2HD   LYS  56          1HD       LYS  56  -1.702 -16.095   0.374
  415   1HE   LYS  56          1HE       LYS  56  -3.470 -17.350   2.535
  416   2HE   LYS  56          2HE       LYS  56  -2.273 -18.210   1.554
  417   1HZ   LYS  56          3HZ       LYS  56  -0.580 -16.801   2.484
  418   2HZ   LYS  56          1HZ       LYS  56  -1.691 -16.028   3.428
  419   3HZ   LYS  56          2HZ       LYS  56  -1.382 -17.628   3.662
  420    H    VAL  57           HN       VAL  57  -3.959 -10.004   1.049
  421    HA   VAL  57           HA       VAL  57  -3.301  -9.257  -1.787
  422    HB   VAL  57           HB       VAL  57  -4.765  -7.374  -1.600
  423   1HG1  VAL  57          1HG21     VAL  57  -5.733  -9.589  -2.314
  424   2HG1  VAL  57          3HG23     VAL  57  -6.337  -9.811  -0.662
  425   3HG1  VAL  57          2HG22     VAL  57  -6.927  -8.461  -1.647
  426   1HG2  VAL  57          2HG12     VAL  57  -5.514  -8.312   1.208
  427   2HG2  VAL  57          1HG11     VAL  57  -4.650  -6.814   0.799
  428   3HG2  VAL  57          3HG13     VAL  57  -6.314  -7.022   0.295
  429    H    ILE  58           HN       ILE  58  -1.519  -7.773  -1.889
  430    HA   ILE  58           HA       ILE  58  -0.339  -7.201   0.835
  431    HB   ILE  58           HB       ILE  58   1.250  -7.193  -1.693
  432   1HG1  ILE  58          1HG11     ILE  58   0.367  -9.401  -1.680
  433   2HG1  ILE  58          2HG12     ILE  58   2.060  -9.423  -1.173
  434   1HG2  ILE  58          2HG22     ILE  58   2.136  -6.078   0.328
  435   2HG2  ILE  58          1HG21     ILE  58   1.950  -7.570   1.245
  436   3HG2  ILE  58          3HG23     ILE  58   3.089  -7.501  -0.117
  437   1HD1  ILE  58          1HD11     ILE  58   1.319  -9.705   1.208
  438   2HD1  ILE  58          2HD12     ILE  58  -0.362  -9.776   0.626
  439   3HD1  ILE  58          3HD13     ILE  58   0.798 -11.009   0.137
  440    H    PHE  59           HN       PHE  59  -1.233  -5.161   1.336
  441    HA   PHE  59           HA       PHE  59  -1.179  -3.075  -0.831
  442   1HB   PHE  59          2HB       PHE  59  -2.340  -2.968   1.900
  443   2HB   PHE  59          1HB       PHE  59  -2.214  -1.604   0.833
  444    HD1  PHE  59           HD2      PHE  59  -3.216  -4.642  -0.979
  445    HD2  PHE  59           HD1      PHE  59  -4.598  -1.328   1.418
  446    HE1  PHE  59           HE2      PHE  59  -5.567  -5.240  -1.465
  447    HE2  PHE  59           HE1      PHE  59  -6.913  -2.087   1.129
  448    HZ   PHE  59           HZ       PHE  59  -7.424  -4.083  -0.262
  449    H    LEU  60           HN       LEU  60   0.734  -2.054  -0.993
  450    HA   LEU  60           HA       LEU  60   2.457  -1.582   1.422
  451   1HB   LEU  60          1HB       LEU  60   3.064  -1.913  -1.531
  452   2HB   LEU  60          2HB       LEU  60   4.278  -1.469  -0.311
  453    HG   LEU  60           HG       LEU  60   2.705  -4.073  -0.461
  454   1HD1  LEU  60          1HD21     LEU  60   4.354  -3.823  -2.280
  455   2HD1  LEU  60          3HD23     LEU  60   5.627  -3.473  -1.091
  456   3HD1  LEU  60          2HD22     LEU  60   4.857  -5.073  -1.133
  457   1HD2  LEU  60          3HD13     LEU  60   4.983  -3.221   1.397
  458   2HD2  LEU  60          2HD12     LEU  60   3.319  -3.633   1.883
  459   3HD2  LEU  60          1HD11     LEU  60   4.381  -4.878   1.217
  460    H    LYS  61           HN       LYS  61   1.730   0.536   2.070
  461    HA   LYS  61           HA       LYS  61   1.665   2.605  -0.075
  462   1HB   LYS  61          2HB       LYS  61   0.089   3.053   1.639
  463   2HB   LYS  61          1HB       LYS  61   1.282   2.802   2.913
  464   1HG   LYS  61          2HG       LYS  61   2.563   4.775   2.143
  465   2HG   LYS  61          1HG       LYS  61   1.423   5.007   0.804
  466   1HD   LYS  61          2HD       LYS  61  -0.282   5.744   2.256
  467   2HD   LYS  61          1HD       LYS  61   0.447   4.969   3.674
  468   1HE   LYS  61          2HE       LYS  61   0.786   7.404   3.811
  469   2HE   LYS  61          1HE       LYS  61   2.328   6.559   3.666
  470   1HZ   LYS  61          2HZ       LYS  61   2.273   7.066   1.302
  471   2HZ   LYS  61          1HZ       LYS  61   0.902   7.960   1.530
  472   3HZ   LYS  61          3HZ       LYS  61   2.320   8.404   2.250
  473    H    VAL  62           HN       VAL  62   3.515   3.306  -0.905
  474    HA   VAL  62           HA       VAL  62   6.038   2.906   0.622
  475    HB   VAL  62           HB       VAL  62   5.527   3.624  -2.279
  476   1HG1  VAL  62          1HG11     VAL  62   8.112   3.328  -0.678
  477   2HG1  VAL  62          2HG12     VAL  62   8.064   3.342  -2.447
  478   3HG1  VAL  62          3HG13     VAL  62   7.580   4.779  -1.548
  479   1HG2  VAL  62          2HG22     VAL  62   5.136   1.235  -1.655
  480   2HG2  VAL  62          1HG21     VAL  62   6.567   1.427  -2.685
  481   3HG2  VAL  62          3HG23     VAL  62   6.758   1.171  -0.937
  482    H    ASP  63           HN       ASP  63   6.720   4.589   1.828
  483    HA   ASP  63           HA       ASP  63   5.607   7.256   1.575
  484   1HB   ASP  63          2HB       ASP  63   8.073   6.232   3.037
  485   2HB   ASP  63          1HB       ASP  63   7.448   7.879   3.155
  486    H    VAL  64           HN       VAL  64   5.856   7.617  -0.640
  487    HA   VAL  64           HA       VAL  64   7.947   7.705  -2.358
  488    HB   VAL  64           HB       VAL  64   5.844   9.857  -1.854
  489   1HG1  VAL  64          1HG21     VAL  64   7.616   9.529  -4.307
  490   2HG1  VAL  64          2HG22     VAL  64   6.173  10.557  -4.216
  491   3HG1  VAL  64          3HG23     VAL  64   7.570  10.929  -3.209
  492   1HG2  VAL  64          3HG13     VAL  64   4.930   7.631  -2.439
  493   2HG2  VAL  64          2HG12     VAL  64   4.658   8.805  -3.732
  494   3HG2  VAL  64          1HG11     VAL  64   5.957   7.601  -3.887
  495    H    ASP  65           HN       ASP  65   7.270  10.269   0.012
  496    HA   ASP  65           HA       ASP  65   9.377  12.049  -0.558
  497   1HB   ASP  65          2HB       ASP  65   8.076  11.491   2.115
  498   2HB   ASP  65          1HB       ASP  65   8.954  12.954   1.628
  499    H    ALA  66           HN       ALA  66   9.474   8.985   1.232
  500    HA   ALA  66           HA       ALA  66  12.169   9.582   2.322
  501   1HB   ALA  66          2HB       ALA  66  10.384   7.123   2.593
  502   2HB   ALA  66          3HB       ALA  66  11.956   7.381   3.376
  503   3HB   ALA  66          1HB       ALA  66  10.578   8.422   3.784
  504    H    VAL  67           HN       VAL  67  10.684   6.848   0.439
  505    HA   VAL  67           HA       VAL  67  13.381   6.427  -0.786
  506    HB   VAL  67           HB       VAL  67  12.473   4.366  -1.659
  507   1HG1  VAL  67          1HG11     VAL  67  13.842   4.518   0.391
  508   2HG1  VAL  67          2HG12     VAL  67  12.359   4.619   1.361
  509   3HG1  VAL  67          3HG13     VAL  67  12.715   3.165   0.400
  510   1HG2  VAL  67          3HG23     VAL  67  10.039   4.902  -1.582
  511   2HG2  VAL  67          2HG22     VAL  67  10.473   3.374  -0.795
  512   3HG2  VAL  67          1HG21     VAL  67  10.101   4.805   0.193
  513    H    ALA  68           HN       ALA  68  12.786   8.673  -1.630
  514    HA   ALA  68           HA       ALA  68  11.174   9.078  -3.878
  515   1HB   ALA  68          1HB       ALA  68  12.473  10.853  -2.759
  516   2HB   ALA  68          2HB       ALA  68  13.990  10.148  -3.364
  517   3HB   ALA  68          3HB       ALA  68  12.807  10.827  -4.502
  518    H    ALA  69           HN       ALA  69  14.375   7.537  -3.677
  519    HA   ALA  69           HA       ALA  69  14.906   7.203  -6.431
  520   1HB   ALA  69          1HB       ALA  69  16.561   6.829  -4.641
  521   2HB   ALA  69          2HB       ALA  69  15.650   5.408  -4.081
  522   3HB   ALA  69          3HB       ALA  69  16.416   5.399  -5.683
  523    H    VAL  70           HN       VAL  70  12.878   5.209  -4.217
  524    HA   VAL  70           HA       VAL  70  12.620   2.997  -6.102
  525    HB   VAL  70           HB       VAL  70  10.997   3.739  -3.636
  526   1HG1  VAL  70          1HG21     VAL  70  11.025   1.165  -5.277
  527   2HG1  VAL  70          3HG23     VAL  70  10.174   1.415  -3.737
  528   3HG1  VAL  70          2HG22     VAL  70   9.671   2.303  -5.179
  529   1HG2  VAL  70          1HG11     VAL  70  13.422   3.126  -3.248
  530   2HG2  VAL  70          2HG12     VAL  70  12.274   1.945  -2.576
  531   3HG2  VAL  70          3HG13     VAL  70  13.128   1.602  -4.097
  532    H    ALA  71           HN       ALA  71  10.680   5.790  -5.055
  533    HA   ALA  71           HA       ALA  71   8.454   5.436  -6.789
  534   1HB   ALA  71          3HB       ALA  71   8.571   7.112  -4.960
  535   2HB   ALA  71          2HB       ALA  71   9.721   8.075  -5.908
  536   3HB   ALA  71          1HB       ALA  71   8.069   7.843  -6.492
  537    H    GLU  72           HN       GLU  72  11.502   7.276  -7.372
  538    HA   GLU  72           HA       GLU  72  11.105   7.977 -10.015
  539   1HB   GLU  72          1HB       GLU  72  13.236   8.082  -8.144
  540   2HB   GLU  72          2HB       GLU  72  13.899   7.119  -9.462
  541   1HG   GLU  72          1HG       GLU  72  13.195   8.890 -11.056
  542   2HG   GLU  72          2HG       GLU  72  12.535   9.814  -9.675
  543    H    ALA  73           HN       ALA  73  12.777   5.010  -8.822
  544    HA   ALA  73           HA       ALA  73  13.272   3.862 -11.328
  545   1HB   ALA  73          2HB       ALA  73  14.260   3.069  -9.197
  546   2HB   ALA  73          3HB       ALA  73  12.673   2.461  -8.674
  547   3HB   ALA  73          1HB       ALA  73  13.486   1.734 -10.075
  548    H    ALA  74           HN       ALA  74  10.375   3.585  -9.243
  549    HA   ALA  74           HA       ALA  74   8.969   1.750 -10.986
  550   1HB   ALA  74          2HB       ALA  74   8.092   3.541  -8.688
  551   2HB   ALA  74          1HB       ALA  74   7.041   2.353  -9.499
  552   3HB   ALA  74          3HB       ALA  74   8.491   1.820  -8.630
  553    H    GLY  75           HN       GLY  75   9.715   5.075 -11.412
  554   1HA   GLY  75          1HA       GLY  75   9.200   6.372 -13.217
  555   2HA   GLY  75          2HA       GLY  75   7.969   5.204 -13.726
  556    H    ILE  76           HN       ILE  76   8.031   6.659 -10.459
  557    HA   ILE  76           HA       ILE  76   5.342   7.775 -10.934
  558    HB   ILE  76           HB       ILE  76   7.164   7.478  -8.549
  559   1HG1  ILE  76          2HG12     ILE  76   5.274   6.322  -7.622
  560   2HG1  ILE  76          1HG11     ILE  76   4.206   6.837  -8.936
  561   1HG2  ILE  76          1HG21     ILE  76   4.696   9.247  -8.683
  562   2HG2  ILE  76          2HG22     ILE  76   5.432   8.663  -7.180
  563   3HG2  ILE  76          3HG23     ILE  76   6.339   9.750  -8.228
  564   1HD1  ILE  76          3HD13     ILE  76   6.604   5.025  -9.324
  565   2HD1  ILE  76          1HD11     ILE  76   4.954   4.447  -9.041
  566   3HD1  ILE  76          2HD12     ILE  76   5.315   5.366 -10.505
  567    H    THR  77           HN       THR  77   5.095   9.679 -11.918
  568    HA   THR  77           HA       THR  77   7.192  11.786 -11.779
  569    HB   THR  77           HB       THR  77   5.753  12.693 -13.686
  570    HG1  THR  77           HG1      THR  77   4.417  10.991 -14.644
  571   1HG2  THR  77          3HG23     THR  77   7.859  11.423 -14.097
  572   2HG2  THR  77          2HG22     THR  77   6.941   9.903 -14.096
  573   3HG2  THR  77          1HG21     THR  77   6.652  11.116 -15.359
  574    H    ALA  78           HN       ALA  78   3.690  11.590 -12.095
  575    HA   ALA  78           HA       ALA  78   3.232  13.618  -9.962
  576   1HB   ALA  78          3HB       ALA  78   2.002  13.859 -12.098
  577   2HB   ALA  78          2HB       ALA  78   1.310  12.233 -11.889
  578   3HB   ALA  78          1HB       ALA  78   0.893  13.531 -10.750
  579    H    MET  79           HN       MET  79   1.751  13.083  -8.203
  580    HA   MET  79           HA       MET  79   1.069  10.321  -7.725
  581   1HB   MET  79          1HB       MET  79   2.333  10.053  -5.692
  582   2HB   MET  79          2HB       MET  79   3.441  10.566  -6.932
  583   1HG   MET  79          2HG       MET  79   2.289  12.251  -4.686
  584   2HG   MET  79          1HG       MET  79   3.919  11.623  -4.825
  585   1HE   MET  79          1HE       MET  79   4.922  12.230  -7.671
  586   2HE   MET  79          2HE       MET  79   5.609  13.854  -7.467
  587   3HE   MET  79          3HE       MET  79   5.842  12.628  -6.201
  588    HA   PRO  80           HA       PRO  80   0.352   9.627  -5.040
  589   1HB   PRO  80          2HB       PRO  80  -2.072   8.624  -4.465
  590   2HB   PRO  80          1HB       PRO  80  -1.320   9.927  -3.493
  591   1HG   PRO  80          1HG       PRO  80  -3.284  10.317  -5.749
  592   2HG   PRO  80          2HG       PRO  80  -3.428  10.868  -4.055
  593   1HD   PRO  80          1HD       PRO  80  -2.371  12.491  -6.008
  594   2HD   PRO  80          2HD       PRO  80  -1.611  12.449  -4.394
  595    H    THR  81           HN       THR  81   0.572   7.678  -6.040
  596    HA   THR  81           HA       THR  81  -0.991   7.088  -8.511
  597    HB   THR  81           HB       THR  81   2.020   7.177  -8.173
  598    HG1  THR  81           HG1      THR  81   1.781   8.875  -9.481
  599   1HG2  THR  81          3HG23     THR  81   0.370   5.926 -10.415
  600   2HG2  THR  81          1HG21     THR  81   2.106   6.289 -10.513
  601   3HG2  THR  81          2HG22     THR  81   1.523   5.093  -9.343
  602    H    PHE  82           HN       PHE  82  -1.820   5.135  -8.384
  603    HA   PHE  82           HA       PHE  82  -0.894   3.218  -6.298
  604   1HB   PHE  82          2HB       PHE  82  -3.578   3.711  -7.601
  605   2HB   PHE  82          1HB       PHE  82  -3.233   2.274  -6.664
  606    HD1  PHE  82           HD2      PHE  82  -3.552   5.999  -6.521
  607    HD2  PHE  82           HD1      PHE  82  -3.109   2.380  -4.204
  608    HE1  PHE  82           HE2      PHE  82  -3.977   7.266  -4.448
  609    HE2  PHE  82           HE1      PHE  82  -3.692   3.645  -2.147
  610    HZ   PHE  82           HZ       PHE  82  -3.877   6.129  -2.243
  611    H    HIS  83           HN       HIS  83   0.223   1.523  -7.132
  612    HA   HIS  83           HA       HIS  83  -0.256   0.662  -9.977
  613   1HB   HIS  83          1HB       HIS  83   2.084   0.375  -8.091
  614   2HB   HIS  83          2HB       HIS  83   1.923  -0.541  -9.603
  615    HD2  HIS  83           HD2      HIS  83   0.866   2.908 -10.548
  616    HE1  HIS  83           HE1      HIS  83   5.066   2.768 -11.022
  617    HE2  HIS  83           HE2      HIS  83   2.951   4.056 -11.641
  618    H    VAL  84           HN       VAL  84  -0.530  -1.635 -10.301
  619    HA   VAL  84           HA       VAL  84  -0.880  -3.253  -7.809
  620    HB   VAL  84           HB       VAL  84  -2.521  -3.660 -10.331
  621   1HG1  VAL  84          2HG22     VAL  84  -2.602  -4.743  -7.474
  622   2HG1  VAL  84          3HG23     VAL  84  -3.859  -5.030  -8.677
  623   3HG1  VAL  84          1HG21     VAL  84  -2.225  -5.650  -8.954
  624   1HG2  VAL  84          1HG11     VAL  84  -3.303  -2.192  -7.780
  625   2HG2  VAL  84          2HG12     VAL  84  -3.239  -1.508  -9.423
  626   3HG2  VAL  84          3HG13     VAL  84  -4.435  -2.745  -9.028
  627    H    TYR  85           HN       TYR  85   0.709  -4.726  -7.772
  628    HA   TYR  85           HA       TYR  85   1.918  -5.616 -10.342
  629   1HB   TYR  85          1HB       TYR  85   3.054  -5.562  -7.530
  630   2HB   TYR  85          2HB       TYR  85   3.824  -6.323  -8.907
  631    HD1  TYR  85           HD1      TYR  85   2.609  -3.037  -7.575
  632    HD2  TYR  85           HD2      TYR  85   5.361  -5.071 -10.194
  633    HE1  TYR  85           HE1      TYR  85   3.861  -0.924  -7.945
  634    HE2  TYR  85           HE2      TYR  85   6.485  -2.918 -10.682
  635    HH   TYR  85           HH       TYR  85   5.091   0.172  -9.687
  636    H    LYS  86           HN       LYS  86   1.680  -7.691 -10.920
  637    HA   LYS  86           HA       LYS  86   0.472  -9.658  -9.008
  638   1HB   LYS  86          2HB       LYS  86   0.655  -9.584 -12.045
  639   2HB   LYS  86          1HB       LYS  86   0.299 -11.060 -11.125
  640   1HG   LYS  86          1HG       LYS  86  -1.595  -9.967 -10.016
  641   2HG   LYS  86          2HG       LYS  86  -1.310  -8.474 -10.927
  642   1HD   LYS  86          1HD       LYS  86  -1.745  -9.646 -13.052
  643   2HD   LYS  86          2HD       LYS  86  -1.935 -11.189 -12.204
  644   1HE   LYS  86          1HE       LYS  86  -3.716  -8.738 -11.775
  645   2HE   LYS  86          2HE       LYS  86  -4.119 -10.128 -12.796
  646   1HZ   LYS  86          1HZ       LYS  86  -3.971 -11.526 -10.873
  647   2HZ   LYS  86          2HZ       LYS  86  -3.620 -10.241  -9.905
  648   3HZ   LYS  86          3HZ       LYS  86  -5.085 -10.340 -10.624
  649    H    ASP  87           HN       ASP  87   1.862 -11.042  -8.120
  650    HA   ASP  87           HA       ASP  87   3.687 -12.113  -7.445
  651   1HB   ASP  87          1HB       ASP  87   3.520 -13.135  -9.744
  652   2HB   ASP  87          2HB       ASP  87   4.720 -11.979 -10.314
  653    H    GLY  88           HN       GLY  88   4.850  -9.910  -9.834
  654   1HA   GLY  88          1HA       GLY  88   5.978  -7.925  -8.143
  655   2HA   GLY  88          2HA       GLY  88   7.273  -9.038  -8.638
  656    H    VAL  89           HN       VAL  89   4.508  -8.486 -10.811
  657    HA   VAL  89           HA       VAL  89   6.177  -6.777 -12.595
  658    HB   VAL  89           HB       VAL  89   4.284  -9.056 -13.327
  659   1HG1  VAL  89          2HG22     VAL  89   5.992  -7.221 -15.071
  660   2HG1  VAL  89          1HG21     VAL  89   5.081  -8.634 -15.642
  661   3HG1  VAL  89          3HG23     VAL  89   4.216  -7.237 -14.996
  662   1HG2  VAL  89          2HG12     VAL  89   7.322  -8.836 -13.530
  663   2HG2  VAL  89          1HG11     VAL  89   6.416  -9.945 -12.479
  664   3HG2  VAL  89          3HG13     VAL  89   6.340 -10.137 -14.233
  665    H    LYS  90           HN       LYS  90   5.150  -4.909 -13.113
  666    HA   LYS  90           HA       LYS  90   2.757  -4.135 -11.820
  667   1HB   LYS  90          1HB       LYS  90   4.607  -2.656 -12.562
  668   2HB   LYS  90          2HB       LYS  90   4.079  -2.845 -14.241
  669   1HG   LYS  90          2HG       LYS  90   2.024  -1.673 -13.823
  670   2HG   LYS  90          1HG       LYS  90   2.128  -1.934 -12.085
  671   1HD   LYS  90          2HD       LYS  90   2.656   0.360 -12.499
  672   2HD   LYS  90          1HD       LYS  90   4.100  -0.462 -11.921
  673   1HE   LYS  90          1HE       LYS  90   4.677   1.069 -13.717
  674   2HE   LYS  90          2HE       LYS  90   4.968  -0.591 -14.259
  675   1HZ   LYS  90          2HZ       LYS  90   2.578   1.013 -14.858
  676   2HZ   LYS  90          3HZ       LYS  90   3.838   0.762 -15.898
  677   3HZ   LYS  90          1HZ       LYS  90   2.885  -0.500 -15.426
  678    H    ALA  91           HN       ALA  91   0.806  -4.924 -12.240
  679    HA   ALA  91           HA       ALA  91   0.058  -5.913 -14.922
  680   1HB   ALA  91          1HB       ALA  91  -0.340  -7.335 -12.945
  681   2HB   ALA  91          3HB       ALA  91  -1.353  -6.063 -12.222
  682   3HB   ALA  91          2HB       ALA  91  -1.867  -6.863 -13.722
  683    H    ASP  92           HN       ASP  92  -0.695  -3.317 -12.603
  684    HA   ASP  92           HA       ASP  92  -2.146  -1.886 -14.714
  685   1HB   ASP  92          2HB       ASP  92  -3.772  -3.518 -13.635
  686   2HB   ASP  92          1HB       ASP  92  -3.567  -2.633 -12.113
  687    H    ASP  93           HN       ASP  93  -2.977   0.256 -13.871
  688    HA   ASP  93           HA       ASP  93  -1.409   1.413 -11.655
  689   1HB   ASP  93          1HB       ASP  93  -1.399   2.587 -14.455
  690   2HB   ASP  93          2HB       ASP  93  -0.659   3.293 -13.030
  691    H    LEU  94           HN       LEU  94  -2.196   3.504 -11.090
  692    HA   LEU  94           HA       LEU  94  -4.456   4.768 -12.419
  693   1HB   LEU  94          2HB       LEU  94  -5.696   3.187 -11.113
  694   2HB   LEU  94          1HB       LEU  94  -4.731   3.468  -9.665
  695    HG   LEU  94           HG       LEU  94  -6.169   5.839 -10.851
  696   1HD1  LEU  94          1HD21     LEU  94  -7.875   4.064 -10.972
  697   2HD1  LEU  94          3HD23     LEU  94  -7.648   3.742  -9.235
  698   3HD1  LEU  94          2HD22     LEU  94  -8.257   5.315  -9.775
  699   1HD2  LEU  94          1HD11     LEU  94  -4.789   6.051  -8.722
  700   2HD2  LEU  94          2HD12     LEU  94  -6.494   6.433  -8.485
  701   3HD2  LEU  94          3HD13     LEU  94  -5.858   4.863  -7.965
  702    H    VAL  95           HN       VAL  95  -4.499   7.018 -11.793
  703    HA   VAL  95           HA       VAL  95  -2.414   7.900  -9.897
  704    HB   VAL  95           HB       VAL  95  -3.420   9.418 -12.296
  705   1HG1  VAL  95          3HG13     VAL  95  -1.072   9.856 -10.425
  706   2HG1  VAL  95          1HG11     VAL  95  -1.388  10.800 -11.896
  707   3HG1  VAL  95          2HG12     VAL  95  -2.540  10.854 -10.558
  708   1HG2  VAL  95          1HG21     VAL  95  -0.831   7.804 -12.023
  709   2HG2  VAL  95          3HG23     VAL  95  -2.145   7.469 -13.172
  710   3HG2  VAL  95          2HG22     VAL  95  -1.177   8.934 -13.349
  711    H    GLY  96           HN       GLY  96  -3.140   9.614  -8.542
  712   1HA   GLY  96          1HA       GLY  96  -4.719  11.120  -7.686
  713   2HA   GLY  96          2HA       GLY  96  -5.997  10.443  -8.712
  714    H    ALA  97           HN       ALA  97  -7.350  10.128  -6.738
  715    HA   ALA  97           HA       ALA  97  -6.855   7.523  -5.502
  716   1HB   ALA  97          2HB       ALA  97  -7.083  10.078  -3.838
  717   2HB   ALA  97          1HB       ALA  97  -7.113   8.416  -3.203
  718   3HB   ALA  97          3HB       ALA  97  -5.645   9.043  -3.980
  719    H    SER  98           HN       SER  98  -8.794   6.554  -5.030
  720    HA   SER  98           HA       SER  98 -11.310   7.945  -4.698
  721   1HB   SER  98          2HB       SER  98 -10.652   6.540  -7.319
  722   2HB   SER  98          1HB       SER  98 -12.315   6.743  -6.744
  723    HG   SER  98           HG       SER  98 -10.670   9.005  -6.814
  724    H    GLN  99           HN       GLN  99 -11.871   6.730  -2.978
  725    HA   GLN  99           HA       GLN  99 -10.892   4.238  -2.222
  726   1HB   GLN  99          2HB       GLN  99 -13.484   5.692  -1.554
  727   2HB   GLN  99          1HB       GLN  99 -13.026   4.159  -0.806
  728   1HG   GLN  99          2HG       GLN  99 -12.396   5.986   0.632
  729   2HG   GLN  99          1HG       GLN  99 -10.966   5.103   0.075
  730   1HE2  GLN  99          1HE21     GLN  99  -9.563   8.304  -0.593
  731   2HE2  GLN  99          2HE22     GLN  99  -9.445   6.825   0.346
  732    H    ASP 100           HN       ASP 100 -13.940   4.887  -4.004
  733    HA   ASP 100           HA       ASP 100 -14.845   2.179  -4.114
  734   1HB   ASP 100          2HB       ASP 100 -16.296   2.954  -5.896
  735   2HB   ASP 100          1HB       ASP 100 -16.263   4.176  -4.620
  736    H    LYS 101           HN       LYS 101 -12.759   4.137  -6.257
  737    HA   LYS 101           HA       LYS 101 -12.511   2.114  -8.256
  738   1HB   LYS 101          1HB       LYS 101 -12.027   4.712  -8.326
  739   2HB   LYS 101          2HB       LYS 101 -10.421   4.249  -7.763
  740   1HG   LYS 101          2HG       LYS 101 -10.463   4.499 -10.183
  741   2HG   LYS 101          1HG       LYS 101 -10.098   2.830  -9.742
  742   1HD   LYS 101          2HD       LYS 101 -11.648   3.112 -11.701
  743   2HD   LYS 101          1HD       LYS 101 -12.272   2.069 -10.436
  744   1HE   LYS 101          1HE       LYS 101 -14.012   3.573 -11.331
  745   2HE   LYS 101          2HE       LYS 101 -13.750   3.875  -9.613
  746   1HZ   LYS 101          1HZ       LYS 101 -12.636   5.458 -11.829
  747   2HZ   LYS 101          3HZ       LYS 101 -13.900   5.891 -10.861
  748   3HZ   LYS 101          2HZ       LYS 101 -12.388   5.751 -10.225
  749    H    LEU 102           HN       LEU 102 -10.595   2.943  -5.353
  750    HA   LEU 102           HA       LEU 102  -8.522   1.006  -5.811
  751   1HB   LEU 102          1HB       LEU 102  -9.630   2.287  -3.283
  752   2HB   LEU 102          2HB       LEU 102  -8.286   1.143  -3.250
  753    HG   LEU 102           HG       LEU 102  -8.214   3.621  -5.009
  754   1HD1  LEU 102          1HD11     LEU 102  -7.224   3.330  -2.139
  755   2HD1  LEU 102          3HD13     LEU 102  -6.871   4.693  -3.223
  756   3HD1  LEU 102          2HD12     LEU 102  -8.536   4.390  -2.700
  757   1HD2  LEU 102          2HD22     LEU 102  -6.548   1.741  -5.462
  758   2HD2  LEU 102          1HD21     LEU 102  -5.835   3.264  -4.962
  759   3HD2  LEU 102          3HD23     LEU 102  -5.975   1.925  -3.798
  760    H    LYS 103           HN       LYS 103 -11.649   0.808  -4.043
  761    HA   LYS 103           HA       LYS 103 -11.409  -1.859  -3.236
  762   1HB   LYS 103          2HB       LYS 103 -13.212  -0.079  -2.728
  763   2HB   LYS 103          1HB       LYS 103 -14.016  -0.602  -4.209
  764   1HG   LYS 103          1HG       LYS 103 -14.184  -2.897  -3.342
  765   2HG   LYS 103          2HG       LYS 103 -13.288  -2.433  -1.877
  766   1HD   LYS 103          2HD       LYS 103 -15.074  -0.737  -1.369
  767   2HD   LYS 103          1HD       LYS 103 -15.999  -1.359  -2.744
  768   1HE   LYS 103          2HE       LYS 103 -15.135  -2.903  -0.236
  769   2HE   LYS 103          1HE       LYS 103 -16.773  -2.356  -0.611
  770   1HZ   LYS 103          3HZ       LYS 103 -16.743  -3.809  -2.523
  771   2HZ   LYS 103          1HZ       LYS 103 -15.231  -4.339  -2.133
  772   3HZ   LYS 103          2HZ       LYS 103 -16.495  -4.646  -1.125
  773    H    ALA 104           HN       ALA 104 -12.777  -0.503  -6.231
  774    HA   ALA 104           HA       ALA 104 -13.359  -2.903  -7.583
  775   1HB   ALA 104          2HB       ALA 104 -14.110  -0.654  -8.309
  776   2HB   ALA 104          1HB       ALA 104 -12.450  -0.264  -8.809
  777   3HB   ALA 104          3HB       ALA 104 -13.336  -1.563  -9.623
  778    H    LEU 105           HN       LEU 105 -10.257  -1.009  -7.622
  779    HA   LEU 105           HA       LEU 105  -8.864  -2.644  -9.463
  780   1HB   LEU 105          2HB       LEU 105  -8.012  -0.909  -7.125
  781   2HB   LEU 105          1HB       LEU 105  -6.819  -1.867  -7.985
  782    HG   LEU 105           HG       LEU 105  -8.638   0.011  -9.519
  783   1HD1  LEU 105          1HD21     LEU 105  -6.038   0.660  -8.057
  784   2HD1  LEU 105          3HD23     LEU 105  -6.717   1.651  -9.360
  785   3HD1  LEU 105          2HD22     LEU 105  -7.621   1.447  -7.853
  786   1HD2  LEU 105          2HD12     LEU 105  -7.223  -1.667 -10.763
  787   2HD2  LEU 105          1HD11     LEU 105  -6.746   0.009 -11.092
  788   3HD2  LEU 105          3HD13     LEU 105  -5.781  -0.977  -9.985
  789    H    VAL 106           HN       VAL 106  -8.992  -2.846  -5.855
  790    HA   VAL 106           HA       VAL 106  -7.352  -5.157  -5.681
  791    HB   VAL 106           HB       VAL 106  -9.637  -4.325  -3.851
  792   1HG1  VAL 106          3HG23     VAL 106  -7.283  -6.257  -3.524
  793   2HG1  VAL 106          2HG22     VAL 106  -8.206  -5.635  -2.156
  794   3HG1  VAL 106          1HG21     VAL 106  -9.007  -6.643  -3.373
  795   1HG2  VAL 106          1HG11     VAL 106  -7.709  -2.619  -4.171
  796   2HG2  VAL 106          3HG13     VAL 106  -8.055  -3.162  -2.524
  797   3HG2  VAL 106          2HG12     VAL 106  -6.685  -3.844  -3.420
  798    H    ALA 107           HN       ALA 107 -10.903  -4.889  -5.849
  799    HA   ALA 107           HA       ALA 107 -11.536  -7.643  -5.787
  800   1HB   ALA 107          3HB       ALA 107 -12.943  -5.425  -7.349
  801   2HB   ALA 107          2HB       ALA 107 -13.621  -7.017  -6.961
  802   3HB   ALA 107          1HB       ALA 107 -13.245  -5.877  -5.660
  803    H    LYS 108           HN       LYS 108 -11.017  -5.595  -8.681
  804    HA   LYS 108           HA       LYS 108 -11.233  -7.486 -10.718
  805   1HB   LYS 108          1HB       LYS 108 -11.042  -5.117 -11.177
  806   2HB   LYS 108          2HB       LYS 108  -9.549  -4.977 -10.315
  807   1HG   LYS 108          2HG       LYS 108  -9.236  -4.740 -12.713
  808   2HG   LYS 108          1HG       LYS 108  -8.254  -5.996 -11.983
  809   1HD   LYS 108          1HD       LYS 108  -8.994  -6.710 -14.129
  810   2HD   LYS 108          2HD       LYS 108  -9.701  -7.752 -12.921
  811   1HE   LYS 108          1HE       LYS 108 -11.202  -5.385 -14.167
  812   2HE   LYS 108          2HE       LYS 108 -11.155  -7.006 -14.889
  813   1HZ   LYS 108          3HZ       LYS 108 -12.102  -7.914 -12.955
  814   2HZ   LYS 108          2HZ       LYS 108 -12.215  -6.431 -12.231
  815   3HZ   LYS 108          1HZ       LYS 108 -13.086  -6.757 -13.593
  816    H    HIS 109           HN       HIS 109  -8.207  -6.326  -9.277
  817    HA   HIS 109           HA       HIS 109  -6.679  -8.403 -10.575
  818   1HB   HIS 109          1HB       HIS 109  -5.964  -6.451  -8.362
  819   2HB   HIS 109          2HB       HIS 109  -4.800  -7.511  -9.196
  820    HD2  HIS 109           HD2      HIS 109  -6.357  -4.067  -9.704
  821    HE1  HIS 109           HE1      HIS 109  -5.288  -5.397 -13.560
  822    HE2  HIS 109           HE2      HIS 109  -6.043  -3.371 -12.212
  823    H    ALA 110           HN       ALA 110  -8.390  -8.464  -7.492
  824    HA   ALA 110           HA       ALA 110  -7.003 -10.826  -6.511
  825   1HB   ALA 110          3HB       ALA 110  -9.781  -9.736  -5.892
  826   2HB   ALA 110          2HB       ALA 110  -8.944 -11.031  -5.015
  827   3HB   ALA 110          1HB       ALA 110  -8.286  -9.386  -4.993
  828    H    ALA 111           HN       ALA 111  -9.953 -10.196  -8.454
  829    HA   ALA 111           HA       ALA 111 -10.339 -13.102  -8.947
  830   1HB   ALA 111          2HB       ALA 111 -12.014 -10.643  -9.614
  831   2HB   ALA 111          1HB       ALA 111 -12.450 -12.329  -9.990
  832   3HB   ALA 111          3HB       ALA 111 -12.290 -11.802  -8.304
  833    H    ALA 112           HN       ALA 112 -11.252 -10.841 -11.485
  834    HA   ALA 112           HA       ALA 112  -8.954 -10.956 -13.082
  835   1HB   ALA 112          2HB       ALA 112 -11.276 -12.815 -13.810
  836   2HB   ALA 112          3HB       ALA 112  -9.937 -12.366 -14.886
  837   3HB   ALA 112          1HB       ALA 112  -9.616 -13.335 -13.434
   
  No H/Q in entry =         837
  Start of MODEL    6
    1   1H    GLY   1          3HN       GLY   1  -1.569  -6.207   8.651
    2   2H    GLY   1          1HN       GLY   1  -0.956  -5.093   9.742
    3   3H    GLY   1          2HN       GLY   1  -0.427  -5.151   8.164
    4   1HA   GLY   1          1HA       GLY   1   1.248  -6.153   9.395
    5   2HA   GLY   1          2HA       GLY   1   0.046  -7.209  10.174
    6    H    GLY   2           HN       GLY   2   2.122  -8.482   8.875
    7   1HA   GLY   2          1HA       GLY   2   2.566 -10.074   7.300
    8   2HA   GLY   2          2HA       GLY   2   0.809 -10.232   7.103
    9    H    SER   3           HN       SER   3   0.034  -9.724   5.080
   10    HA   SER   3           HA       SER   3   1.800  -8.652   3.065
   11   1HB   SER   3          2HB       SER   3   0.038  -9.199   1.594
   12   2HB   SER   3          1HB       SER   3   0.095 -10.487   2.777
   13    HG   SER   3           HG       SER   3  -1.988  -9.085   2.137
   14    H    VAL   4           HN       VAL   4  -0.380  -7.231   5.349
   15    HA   VAL   4           HA       VAL   4  -0.743  -4.757   3.731
   16    HB   VAL   4           HB       VAL   4  -1.989  -5.774   6.334
   17   1HG1  VAL   4          3HG23     VAL   4  -2.329  -3.131   4.888
   18   2HG1  VAL   4          2HG22     VAL   4  -3.498  -3.767   6.080
   19   3HG1  VAL   4          1HG21     VAL   4  -1.844  -3.403   6.564
   20   1HG2  VAL   4          3HG13     VAL   4  -3.177  -5.471   3.551
   21   2HG2  VAL   4          1HG11     VAL   4  -2.867  -6.978   4.418
   22   3HG2  VAL   4          2HG12     VAL   4  -4.079  -5.855   5.034
   23    H    ILE   5           HN       ILE   5   1.029  -3.421   3.879
   24    HA   ILE   5           HA       ILE   5   1.962  -2.829   6.603
   25    HB   ILE   5           HB       ILE   5   3.178  -4.873   4.939
   26   1HG1  ILE   5          2HG12     ILE   5   3.990  -3.614   7.593
   27   2HG1  ILE   5          1HG11     ILE   5   2.831  -4.937   7.335
   28   1HG2  ILE   5          2HG22     ILE   5   4.488  -3.027   3.886
   29   2HG2  ILE   5          3HG23     ILE   5   5.123  -2.629   5.512
   30   3HG2  ILE   5          1HG21     ILE   5   5.465  -4.197   4.758
   31   1HD1  ILE   5          2HD12     ILE   5   4.670  -6.335   6.385
   32   2HD1  ILE   5          1HD11     ILE   5   5.827  -5.051   6.822
   33   3HD1  ILE   5          3HD13     ILE   5   4.907  -5.883   8.081
   34    H    VAL   6           HN       VAL   6   3.267  -1.089   6.840
   35    HA   VAL   6           HA       VAL   6   3.202   0.926   4.684
   36    HB   VAL   6           HB       VAL   6   3.732   1.211   7.679
   37   1HG1  VAL   6          1HG21     VAL   6   3.359   3.308   5.495
   38   2HG1  VAL   6          3HG23     VAL   6   3.514   3.644   7.232
   39   3HG1  VAL   6          2HG22     VAL   6   4.873   2.940   6.344
   40   1HG2  VAL   6          2HG12     VAL   6   1.354   0.647   7.288
   41   2HG2  VAL   6          1HG11     VAL   6   1.548   2.318   7.828
   42   3HG2  VAL   6          3HG13     VAL   6   1.227   1.978   6.120
   43    H    ILE   7           HN       ILE   7   5.249   1.193   3.641
   44    HA   ILE   7           HA       ILE   7   7.632   0.503   5.209
   45    HB   ILE   7           HB       ILE   7   6.557  -1.631   4.064
   46   1HG1  ILE   7          1HG11     ILE   7   8.810  -2.494   3.419
   47   2HG1  ILE   7          2HG12     ILE   7   9.493  -0.905   3.814
   48   1HG2  ILE   7          1HG21     ILE   7   6.216  -0.542   1.843
   49   2HG2  ILE   7          2HG22     ILE   7   7.985  -0.493   1.629
   50   3HG2  ILE   7          3HG23     ILE   7   7.153  -2.044   1.779
   51   1HD1  ILE   7          3HD13     ILE   7   8.550  -1.192   6.171
   52   2HD1  ILE   7          1HD11     ILE   7   7.946  -2.784   5.679
   53   3HD1  ILE   7          2HD12     ILE   7   9.687  -2.461   5.733
   54    H    ASP   8           HN       ASP   8   9.528   1.307   4.460
   55    HA   ASP   8           HA       ASP   8   9.572   2.857   1.941
   56   1HB   ASP   8          1HB       ASP   8   9.956   4.033   4.736
   57   2HB   ASP   8          2HB       ASP   8  10.527   4.805   3.251
   58    H    SER   9           HN       SER   9  10.758   0.550   2.064
   59    HA   SER   9           HA       SER   9  13.561   1.297   1.882
   60   1HB   SER   9          1HB       SER   9  12.821  -1.007   3.725
   61   2HB   SER   9          2HB       SER   9  14.442  -0.431   3.300
   62    HG   SER   9           HG       SER   9  13.283   1.679   4.240
   63    H    LYS  10           HN       LYS  10  13.983   0.536  -0.101
   64    HA   LYS  10           HA       LYS  10  12.570  -1.196  -1.666
   65   1HB   LYS  10          2HB       LYS  10  14.634  -1.454  -2.946
   66   2HB   LYS  10          1HB       LYS  10  14.212   0.217  -2.474
   67   1HG   LYS  10          2HG       LYS  10  15.983   0.091  -0.679
   68   2HG   LYS  10          1HG       LYS  10  16.397  -1.541  -1.255
   69   1HD   LYS  10          1HD       LYS  10  16.936  -0.627  -3.486
   70   2HD   LYS  10          2HD       LYS  10  16.522   1.008  -2.924
   71   1HE   LYS  10          2HE       LYS  10  18.282   0.856  -1.180
   72   2HE   LYS  10          1HE       LYS  10  18.691  -0.782  -1.732
   73   1HZ   LYS  10          2HZ       LYS  10  18.914   1.669  -3.338
   74   2HZ   LYS  10          3HZ       LYS  10  20.164   0.852  -2.640
   75   3HZ   LYS  10          1HZ       LYS  10  19.293   0.148  -3.848
   76    H    ALA  11           HN       ALA  11  15.103  -2.033   0.581
   77    HA   ALA  11           HA       ALA  11  15.400  -4.813  -0.018
   78   1HB   ALA  11          1HB       ALA  11  15.659  -3.415   2.687
   79   2HB   ALA  11          3HB       ALA  11  16.285  -5.027   2.282
   80   3HB   ALA  11          2HB       ALA  11  16.944  -3.592   1.471
   81    H    ALA  12           HN       ALA  12  13.113  -3.124   2.155
   82    HA   ALA  12           HA       ALA  12  11.892  -5.606   3.107
   83   1HB   ALA  12          1HB       ALA  12  12.057  -3.671   4.584
   84   2HB   ALA  12          3HB       ALA  12  11.100  -2.699   3.445
   85   3HB   ALA  12          2HB       ALA  12  10.365  -4.106   4.265
   86    H    TRP  13           HN       TRP  13  11.235  -3.062   0.687
   87    HA   TRP  13           HA       TRP  13   8.655  -3.827  -0.189
   88   1HB   TRP  13          1HB       TRP  13   9.802  -1.817  -1.046
   89   2HB   TRP  13          2HB       TRP  13  11.082  -2.803  -1.688
   90    HD1  TRP  13           HD1      TRP  13  10.630  -4.362  -3.798
   91    HE1  TRP  13           HE1      TRP  13   9.195  -3.928  -5.886
   92    HE3  TRP  13           HE3      TRP  13   7.857  -0.435  -2.066
   93    HZ2  TRP  13           HZ2      TRP  13   7.224  -2.082  -6.723
   94    HZ3  TRP  13           HZ3      TRP  13   6.480   0.850  -3.669
   95    HH2  TRP  13           HH2      TRP  13   5.998  -0.060  -5.933
   96    H    ASP  14           HN       ASP  14  11.886  -4.966  -1.283
   97    HA   ASP  14           HA       ASP  14  11.018  -7.031  -2.998
   98   1HB   ASP  14          1HB       ASP  14  13.331  -6.107  -2.810
   99   2HB   ASP  14          2HB       ASP  14  13.555  -6.966  -1.294
  100    H    ALA  15           HN       ALA  15  12.073  -7.216   0.379
  101    HA   ALA  15           HA       ALA  15  11.617  -9.924   0.858
  102   1HB   ALA  15          2HB       ALA  15  12.635  -8.319   2.492
  103   2HB   ALA  15          3HB       ALA  15  11.002  -7.715   2.864
  104   3HB   ALA  15          1HB       ALA  15  11.430  -9.396   3.220
  105    H    GLN  16           HN       GLN  16   9.204  -7.314   1.176
  106    HA   GLN  16           HA       GLN  16   7.023  -8.974   1.971
  107   1HB   GLN  16          2HB       GLN  16   6.972  -6.510   2.182
  108   2HB   GLN  16          1HB       GLN  16   6.895  -6.369   0.418
  109   1HG   GLN  16          1HG       GLN  16   4.619  -6.209   1.245
  110   2HG   GLN  16          2HG       GLN  16   4.747  -7.772   0.473
  111   1HE2  GLN  16          2HE22     GLN  16   4.053  -7.478   4.490
  112   2HE2  GLN  16          1HE21     GLN  16   4.773  -6.106   3.655
  113    H    LEU  17           HN       LEU  17   8.050  -7.712  -1.251
  114    HA   LEU  17           HA       LEU  17   6.071  -8.858  -2.819
  115   1HB   LEU  17          1HB       LEU  17   7.891  -7.241  -3.508
  116   2HB   LEU  17          2HB       LEU  17   9.030  -8.586  -3.554
  117    HG   LEU  17           HG       LEU  17   7.697  -9.657  -5.352
  118   1HD1  LEU  17          2HD12     LEU  17   5.937  -7.199  -4.956
  119   2HD1  LEU  17          3HD13     LEU  17   5.970  -8.093  -6.479
  120   3HD1  LEU  17          1HD11     LEU  17   5.456  -8.916  -5.002
  121   1HD2  LEU  17          2HD22     LEU  17   9.553  -8.098  -5.885
  122   2HD2  LEU  17          1HD21     LEU  17   8.270  -8.033  -7.107
  123   3HD2  LEU  17          3HD23     LEU  17   8.404  -6.739  -5.896
  124    H    ALA  18           HN       ALA  18   9.185 -10.333  -1.856
  125    HA   ALA  18           HA       ALA  18   8.859 -12.857  -3.062
  126   1HB   ALA  18          2HB       ALA  18  10.953 -12.025  -2.106
  127   2HB   ALA  18          3HB       ALA  18  10.281 -12.136  -0.469
  128   3HB   ALA  18          1HB       ALA  18  10.520 -13.610  -1.429
  129    H    LYS  19           HN       LYS  19   8.148 -12.060   0.433
  130    HA   LYS  19           HA       LYS  19   6.915 -14.633   0.833
  131   1HB   LYS  19          1HB       LYS  19   6.177 -13.820   2.961
  132   2HB   LYS  19          2HB       LYS  19   7.835 -13.279   2.661
  133   1HG   LYS  19          2HG       LYS  19   6.980 -11.065   2.040
  134   2HG   LYS  19          1HG       LYS  19   5.315 -11.576   2.275
  135   1HD   LYS  19          1HD       LYS  19   5.996 -10.311   4.204
  136   2HD   LYS  19          2HD       LYS  19   5.711 -11.990   4.660
  137   1HE   LYS  19          2HE       LYS  19   7.712 -11.059   5.769
  138   2HE   LYS  19          1HE       LYS  19   8.146 -12.420   4.732
  139   1HZ   LYS  19          1HZ       LYS  19   8.412  -9.573   4.042
  140   2HZ   LYS  19          2HZ       LYS  19   9.640 -10.584   4.476
  141   3HZ   LYS  19          3HZ       LYS  19   8.828 -10.831   3.062
  142    H    GLY  20           HN       GLY  20   5.716 -11.810  -0.773
  143   1HA   GLY  20          1HA       GLY  20   2.951 -11.982  -0.346
  144   2HA   GLY  20          2HA       GLY  20   3.781 -11.331  -1.772
  145    H    LYS  21           HN       LYS  21   5.108 -14.095  -2.188
  146    HA   LYS  21           HA       LYS  21   4.744 -16.002  -3.344
  147   1HB   LYS  21          1HB       LYS  21   1.812 -16.104  -2.561
  148   2HB   LYS  21          2HB       LYS  21   2.984 -17.404  -2.823
  149   1HG   LYS  21          2HG       LYS  21   4.230 -16.422  -0.767
  150   2HG   LYS  21          1HG       LYS  21   2.704 -15.552  -0.465
  151   1HD   LYS  21          1HD       LYS  21   1.531 -17.823  -0.582
  152   2HD   LYS  21          2HD       LYS  21   3.146 -18.550  -0.501
  153   1HE   LYS  21          2HE       LYS  21   1.785 -16.737   1.548
  154   2HE   LYS  21          1HE       LYS  21   2.274 -18.426   1.764
  155   1HZ   LYS  21          2HZ       LYS  21   4.565 -17.672   1.542
  156   2HZ   LYS  21          3HZ       LYS  21   4.053 -16.105   1.422
  157   3HZ   LYS  21          1HZ       LYS  21   3.799 -16.951   2.812
  158    H    GLU  22           HN       GLU  22   5.147 -14.506  -5.017
  159    HA   GLU  22           HA       GLU  22   3.190 -13.207  -6.609
  160   1HB   GLU  22          2HB       GLU  22   6.021 -13.970  -7.442
  161   2HB   GLU  22          1HB       GLU  22   5.050 -12.605  -7.970
  162   1HG   GLU  22          2HG       GLU  22   6.284 -11.438  -6.492
  163   2HG   GLU  22          1HG       GLU  22   5.161 -12.052  -5.285
  164    H    GLU  23           HN       GLU  23   2.168 -15.754  -6.555
  165    HA   GLU  23           HA       GLU  23   2.874 -17.200  -9.025
  166   1HB   GLU  23          2HB       GLU  23   0.469 -17.515  -7.155
  167   2HB   GLU  23          1HB       GLU  23   0.813 -18.499  -8.576
  168   1HG   GLU  23          1HG       GLU  23   1.643 -19.782  -6.813
  169   2HG   GLU  23          2HG       GLU  23   3.091 -19.053  -7.515
  170    H    HIS  24           HN       HIS  24  -0.042 -15.448  -7.924
  171    HA   HIS  24           HA       HIS  24  -0.428 -14.172 -10.548
  172   1HB   HIS  24          1HB       HIS  24  -2.672 -15.081 -10.834
  173   2HB   HIS  24          2HB       HIS  24  -1.512 -16.409 -10.768
  174    HD2  HIS  24           HD2      HIS  24  -4.413 -14.856  -8.625
  175    HE1  HIS  24           HE1      HIS  24  -3.223 -18.468  -6.785
  176    HE2  HIS  24           HE2      HIS  24  -4.945 -16.553  -6.734
  177    H    LYS  25           HN       LYS  25   0.190 -13.263  -7.812
  178    HA   LYS  25           HA       LYS  25  -2.459 -12.415  -6.766
  179   1HB   LYS  25          1HB       LYS  25   0.194 -12.233  -5.336
  180   2HB   LYS  25          2HB       LYS  25  -1.383 -11.949  -4.647
  181   1HG   LYS  25          1HG       LYS  25  -0.479 -14.665  -5.710
  182   2HG   LYS  25          2HG       LYS  25  -0.450 -14.144  -4.027
  183   1HD   LYS  25          1HD       LYS  25  -2.917 -13.765  -4.088
  184   2HD   LYS  25          2HD       LYS  25  -2.971 -14.388  -5.750
  185   1HE   LYS  25          1HE       LYS  25  -2.109 -16.561  -5.003
  186   2HE   LYS  25          2HE       LYS  25  -1.957 -15.962  -3.342
  187   1HZ   LYS  25          1HZ       LYS  25  -4.512 -16.123  -4.805
  188   2HZ   LYS  25          2HZ       LYS  25  -3.971 -17.230  -3.712
  189   3HZ   LYS  25          3HZ       LYS  25  -4.299 -15.690  -3.243
  190    HA   PRO  26           HA       PRO  26  -1.539  -8.109  -7.623
  191   1HB   PRO  26          1HB       PRO  26  -3.466  -6.912  -6.132
  192   2HB   PRO  26          2HB       PRO  26  -3.872  -7.906  -7.563
  193   1HG   PRO  26          1HG       PRO  26  -3.646  -8.923  -4.695
  194   2HG   PRO  26          2HG       PRO  26  -5.145  -8.948  -5.682
  195   1HD   PRO  26          1HD       PRO  26  -3.494 -11.030  -5.490
  196   2HD   PRO  26          2HD       PRO  26  -4.000 -10.564  -7.142
  197    H    ILE  27           HN       ILE  27   0.054  -6.861  -6.900
  198    HA   ILE  27           HA       ILE  27   0.315  -6.375  -3.974
  199    HB   ILE  27           HB       ILE  27   2.455  -6.157  -6.145
  200   1HG1  ILE  27          2HG12     ILE  27   3.429  -7.943  -4.325
  201   2HG1  ILE  27          1HG11     ILE  27   1.717  -8.361  -4.252
  202   1HG2  ILE  27          2HG22     ILE  27   2.587  -5.714  -3.141
  203   2HG2  ILE  27          3HG23     ILE  27   3.963  -5.686  -4.262
  204   3HG2  ILE  27          1HG21     ILE  27   2.702  -4.461  -4.389
  205   1HD1  ILE  27          2HD12     ILE  27   3.392  -8.238  -6.790
  206   2HD1  ILE  27          1HD11     ILE  27   2.941  -9.713  -5.910
  207   3HD1  ILE  27          3HD13     ILE  27   1.689  -8.727  -6.683
  208    H    VAL  28           HN       VAL  28  -0.989  -4.640  -3.674
  209    HA   VAL  28           HA       VAL  28  -1.077  -2.555  -5.803
  210    HB   VAL  28           HB       VAL  28  -3.291  -3.297  -5.155
  211   1HG1  VAL  28          1HG21     VAL  28  -2.654  -2.559  -2.303
  212   2HG1  VAL  28          3HG23     VAL  28  -4.244  -2.961  -2.976
  213   3HG1  VAL  28          2HG22     VAL  28  -2.977  -4.182  -2.944
  214   1HG2  VAL  28          3HG13     VAL  28  -2.913  -1.017  -5.847
  215   2HG2  VAL  28          1HG11     VAL  28  -4.243  -1.144  -4.694
  216   3HG2  VAL  28          2HG12     VAL  28  -2.656  -0.517  -4.172
  217    H    VAL  29           HN       VAL  29  -0.023  -0.696  -5.461
  218    HA   VAL  29           HA       VAL  29   1.088  -0.230  -2.727
  219    HB   VAL  29           HB       VAL  29   2.896  -0.979  -4.113
  220   1HG1  VAL  29          3HG13     VAL  29   1.992  -0.514  -6.339
  221   2HG1  VAL  29          2HG12     VAL  29   2.177   1.236  -6.044
  222   3HG1  VAL  29          1HG11     VAL  29   3.602   0.177  -6.116
  223   1HG2  VAL  29          1HG21     VAL  29   2.971   2.059  -3.726
  224   2HG2  VAL  29          3HG23     VAL  29   3.417   0.817  -2.538
  225   3HG2  VAL  29          2HG22     VAL  29   4.354   1.018  -4.024
  226    H    ASP  30           HN       ASP  30   0.818   1.634  -1.875
  227    HA   ASP  30           HA       ASP  30  -0.686   3.789  -3.303
  228   1HB   ASP  30          1HB       ASP  30  -1.903   2.867  -1.452
  229   2HB   ASP  30          2HB       ASP  30  -0.496   2.930  -0.389
  230    H    PHE  31           HN       PHE  31   0.903   5.058  -4.139
  231    HA   PHE  31           HA       PHE  31   3.334   5.723  -2.532
  232   1HB   PHE  31          2HB       PHE  31   2.586   6.122  -5.446
  233   2HB   PHE  31          1HB       PHE  31   4.018   6.771  -4.698
  234    HD1  PHE  31           HD1      PHE  31   5.774   5.201  -3.723
  235    HD2  PHE  31           HD2      PHE  31   2.593   3.886  -6.323
  236    HE1  PHE  31           HE1      PHE  31   7.303   3.558  -4.764
  237    HE2  PHE  31           HE2      PHE  31   4.138   2.266  -7.381
  238    HZ   PHE  31           HZ       PHE  31   6.518   2.187  -6.700
  239    H    THR  32           HN       THR  32   2.559   7.268  -1.100
  240    HA   THR  32           HA       THR  32   1.297   9.739  -2.221
  241    HB   THR  32           HB       THR  32   0.592   8.198   0.311
  242    HG1  THR  32           HG1      THR  32  -0.600   7.480  -1.383
  243   1HG2  THR  32          2HG22     THR  32  -0.295  10.975  -0.562
  244   2HG2  THR  32          1HG21     THR  32  -1.134   9.997   0.653
  245   3HG2  THR  32          3HG23     THR  32   0.515  10.537   0.968
  246    H    ALA  33           HN       ALA  33   1.803  11.633  -0.758
  247    HA   ALA  33           HA       ALA  33   4.570  11.388   0.373
  248   1HB   ALA  33          3HB       ALA  33   3.272  13.714  -1.112
  249   2HB   ALA  33          1HB       ALA  33   4.861  13.717  -0.342
  250   3HB   ALA  33          2HB       ALA  33   4.556  12.652  -1.719
  251    H    THR  34           HN       THR  34   4.991  13.258   1.921
  252    HA   THR  34           HA       THR  34   2.938  13.193   4.022
  253    HB   THR  34           HB       THR  34   4.697  14.437   5.295
  254    HG1  THR  34           HG1      THR  34   6.374  13.992   3.049
  255   1HG2  THR  34          3HG23     THR  34   4.665  11.948   5.299
  256   2HG2  THR  34          1HG21     THR  34   5.715  11.925   3.869
  257   3HG2  THR  34          2HG22     THR  34   6.321  12.576   5.401
  258    H    TRP  35           HN       TRP  35   4.866  15.749   2.580
  259    HA   TRP  35           HA       TRP  35   3.586  18.015   3.337
  260   1HB   TRP  35          1HB       TRP  35   4.550  19.053   1.283
  261   2HB   TRP  35          2HB       TRP  35   5.671  18.063   2.209
  262    HD1  TRP  35           HD1      TRP  35   6.796  15.988   1.004
  263    HE1  TRP  35           HE1      TRP  35   6.790  15.090  -1.347
  264    HE3  TRP  35           HE3      TRP  35   2.950  18.810  -0.933
  265    HZ2  TRP  35           HZ2      TRP  35   5.344  15.532  -3.814
  266    HZ3  TRP  35           HZ3      TRP  35   2.274  18.507  -3.293
  267    HH2  TRP  35           HH2      TRP  35   3.461  16.884  -4.743
  268    H    CYS  36           HN       CYS  36   2.232  15.824   0.891
  269    HA   CYS  36           HA       CYS  36   0.343  17.825  -0.099
  270   1HB   CYS  36          2HB       CYS  36  -0.662  15.985  -1.329
  271   2HB   CYS  36          1HB       CYS  36   1.067  16.132  -1.591
  272    H    GLY  37           HN       GLY  37   0.516  16.566   2.891
  273   1HA   GLY  37          1HA       GLY  37  -0.914  16.067   4.577
  274   2HA   GLY  37          2HA       GLY  37  -1.557  17.632   4.106
  275    HA   PRO  38           HA       PRO  38  -5.637  15.981   3.575
  276   1HB   PRO  38          2HB       PRO  38  -5.368  17.103   0.761
  277   2HB   PRO  38          1HB       PRO  38  -6.821  17.105   1.808
  278   1HG   PRO  38          2HG       PRO  38  -5.262  19.312   1.726
  279   2HG   PRO  38          1HG       PRO  38  -5.801  18.688   3.313
  280   1HD   PRO  38          1HD       PRO  38  -3.104  18.406   2.012
  281   2HD   PRO  38          2HD       PRO  38  -3.522  18.652   3.728
  282    H    CYS  39           HN       CYS  39  -3.349  15.327   0.942
  283    HA   CYS  39           HA       CYS  39  -4.558  13.173  -0.380
  284   1HB   CYS  39          1HB       CYS  39  -2.304  12.493  -0.971
  285   2HB   CYS  39          2HB       CYS  39  -2.429  14.254  -1.014
  286    H    LYS  40           HN       LYS  40  -2.985  13.202   2.812
  287    HA   LYS  40           HA       LYS  40  -2.596  10.455   3.249
  288   1HB   LYS  40          2HB       LYS  40  -3.330  12.731   5.153
  289   2HB   LYS  40          1HB       LYS  40  -2.918  11.098   5.679
  290   1HG   LYS  40          2HG       LYS  40  -0.698  11.317   4.490
  291   2HG   LYS  40          1HG       LYS  40  -1.075  13.027   4.220
  292   1HD   LYS  40          2HD       LYS  40  -1.434  13.265   6.729
  293   2HD   LYS  40          1HD       LYS  40  -0.949  11.574   6.910
  294   1HE   LYS  40          1HE       LYS  40   0.963  12.875   7.445
  295   2HE   LYS  40          2HE       LYS  40   1.284  12.173   5.850
  296   1HZ   LYS  40          2HZ       LYS  40   0.273  14.895   6.351
  297   2HZ   LYS  40          1HZ       LYS  40   1.840  14.518   6.029
  298   3HZ   LYS  40          3HZ       LYS  40   0.696  14.279   4.880
  299    H    MET  41           HN       MET  41  -5.641  12.249   3.139
  300    HA   MET  41           HA       MET  41  -7.200  10.468   4.782
  301   1HB   MET  41          1HB       MET  41  -7.966  12.298   2.458
  302   2HB   MET  41          2HB       MET  41  -9.127  11.475   3.498
  303   1HG   MET  41          1HG       MET  41  -7.082  13.540   4.408
  304   2HG   MET  41          2HG       MET  41  -8.809  13.798   4.205
  305   1HE   MET  41          3HE       MET  41 -10.634  12.555   5.631
  306   2HE   MET  41          2HE       MET  41  -9.895  10.931   5.643
  307   3HE   MET  41          1HE       MET  41 -10.305  11.732   7.174
  308    H    ILE  42           HN       ILE  42  -5.847  10.013   1.586
  309    HA   ILE  42           HA       ILE  42  -7.803   8.030   0.774
  310    HB   ILE  42           HB       ILE  42  -4.909   8.416  -0.061
  311   1HG1  ILE  42          2HG12     ILE  42  -7.315   9.433  -1.615
  312   2HG1  ILE  42          1HG11     ILE  42  -6.517  10.453  -0.416
  313   1HG2  ILE  42          3HG23     ILE  42  -7.301   6.855  -1.143
  314   2HG2  ILE  42          2HG22     ILE  42  -5.960   7.284  -2.199
  315   3HG2  ILE  42          1HG21     ILE  42  -5.669   6.252  -0.785
  316   1HD1  ILE  42          2HD12     ILE  42  -4.322  10.089  -1.543
  317   2HD1  ILE  42          3HD13     ILE  42  -5.169   9.258  -2.859
  318   3HD1  ILE  42          1HD11     ILE  42  -5.513  10.959  -2.513
  319    H    ALA  43           HN       ALA  43  -4.917   8.072   2.802
  320    HA   ALA  43           HA       ALA  43  -4.119   5.409   2.670
  321   1HB   ALA  43          1HB       ALA  43  -2.821   7.183   3.774
  322   2HB   ALA  43          2HB       ALA  43  -3.971   7.223   5.123
  323   3HB   ALA  43          3HB       ALA  43  -3.023   5.763   4.814
  324    HA   PRO  44           HA       PRO  44  -6.981   4.114   6.342
  325   1HB   PRO  44          1HB       PRO  44  -9.308   5.545   6.795
  326   2HB   PRO  44          2HB       PRO  44  -7.773   5.796   7.673
  327   1HG   PRO  44          2HG       PRO  44  -8.768   7.306   5.241
  328   2HG   PRO  44          1HG       PRO  44  -8.163   7.994   6.771
  329   1HD   PRO  44          1HD       PRO  44  -6.495   7.793   4.709
  330   2HD   PRO  44          2HD       PRO  44  -5.926   7.252   6.303
  331    H    LEU  45           HN       LEU  45  -8.458   5.739   3.561
  332    HA   LEU  45           HA       LEU  45 -10.635   3.901   3.163
  333   1HB   LEU  45          2HB       LEU  45  -9.108   5.867   1.449
  334   2HB   LEU  45          1HB       LEU  45 -10.144   4.715   0.647
  335    HG   LEU  45           HG       LEU  45 -11.085   6.457   2.990
  336   1HD1  LEU  45          3HD13     LEU  45 -11.135   7.159   0.030
  337   2HD1  LEU  45          1HD11     LEU  45 -11.975   8.060   1.310
  338   3HD1  LEU  45          2HD12     LEU  45 -10.206   7.983   1.299
  339   1HD2  LEU  45          3HD23     LEU  45 -12.599   5.155   0.669
  340   2HD2  LEU  45          2HD22     LEU  45 -12.596   4.564   2.342
  341   3HD2  LEU  45          1HD21     LEU  45 -13.325   6.129   1.963
  342    H    PHE  46           HN       PHE  46  -7.388   4.073   1.686
  343    HA   PHE  46           HA       PHE  46  -7.525   1.557   0.325
  344   1HB   PHE  46          2HB       PHE  46  -5.968   3.306  -0.255
  345   2HB   PHE  46          1HB       PHE  46  -5.277   3.292   1.344
  346    HD1  PHE  46           HD1      PHE  46  -5.913   0.882  -1.556
  347    HD2  PHE  46           HD2      PHE  46  -3.165   2.211   1.501
  348    HE1  PHE  46           HE1      PHE  46  -4.159  -0.515  -2.500
  349    HE2  PHE  46           HE2      PHE  46  -1.423   0.723   0.582
  350    HZ   PHE  46           HZ       PHE  46  -1.841  -0.505  -1.529
  351    H    GLU  47           HN       GLU  47  -6.535   2.449   3.635
  352    HA   GLU  47           HA       GLU  47  -5.503  -0.039   4.447
  353   1HB   GLU  47          1HB       GLU  47  -5.457   2.272   5.658
  354   2HB   GLU  47          2HB       GLU  47  -7.048   1.808   6.289
  355   1HG   GLU  47          2HG       GLU  47  -5.361   1.240   7.913
  356   2HG   GLU  47          1HG       GLU  47  -6.039  -0.256   7.262
  357    H    THR  48           HN       THR  48  -8.854   1.210   4.330
  358    HA   THR  48           HA       THR  48 -10.096  -0.944   5.716
  359    HB   THR  48           HB       THR  48 -11.276   0.629   3.380
  360    HG1  THR  48           HG1      THR  48 -10.370   1.966   5.108
  361   1HG2  THR  48          2HG22     THR  48 -12.548  -0.723   5.795
  362   2HG2  THR  48          1HG21     THR  48 -13.397   0.240   4.571
  363   3HG2  THR  48          3HG23     THR  48 -12.641  -1.299   4.116
  364    H    LEU  49           HN       LEU  49  -9.459  -0.486   2.182
  365    HA   LEU  49           HA       LEU  49 -10.336  -3.078   1.361
  366   1HB   LEU  49          1HB       LEU  49  -8.146  -1.302   0.225
  367   2HB   LEU  49          2HB       LEU  49  -8.735  -2.757  -0.563
  368    HG   LEU  49           HG       LEU  49 -10.613  -0.495   0.150
  369   1HD1  LEU  49          2HD12     LEU  49  -8.726   0.379  -1.251
  370   2HD1  LEU  49          1HD11     LEU  49  -9.066  -0.873  -2.459
  371   3HD1  LEU  49          3HD13     LEU  49 -10.257   0.399  -2.115
  372   1HD2  LEU  49          3HD23     LEU  49 -11.638  -2.685  -0.441
  373   2HD2  LEU  49          1HD21     LEU  49 -11.986  -1.450  -1.652
  374   3HD2  LEU  49          2HD22     LEU  49 -10.747  -2.669  -1.978
  375    H    SER  50           HN       SER  50  -7.184  -1.906   2.579
  376    HA   SER  50           HA       SER  50  -5.725  -4.290   2.235
  377   1HB   SER  50          1HB       SER  50  -5.367  -2.471   4.647
  378   2HB   SER  50          2HB       SER  50  -4.207  -3.490   3.815
  379    HG   SER  50           HG       SER  50  -5.434  -1.336   2.466
  380    H    ASN  51           HN       ASN  51  -7.701  -3.262   5.033
  381    HA   ASN  51           HA       ASN  51  -7.267  -5.594   6.604
  382   1HB   ASN  51          1HB       ASN  51  -8.280  -3.322   7.271
  383   2HB   ASN  51          2HB       ASN  51  -9.807  -3.907   6.606
  384   1HD2  ASN  51          1HD21     ASN  51  -9.577  -6.617   9.344
  385   2HD2  ASN  51          2HD22     ASN  51  -9.351  -6.800   7.617
  386    H    ASP  52           HN       ASP  52  -9.754  -4.772   4.140
  387    HA   ASP  52           HA       ASP  52 -11.331  -7.130   4.480
  388   1HB   ASP  52          2HB       ASP  52 -10.901  -5.463   1.948
  389   2HB   ASP  52          1HB       ASP  52 -12.199  -6.624   2.225
  390    H    TYR  53           HN       TYR  53  -8.904  -6.398   1.940
  391    HA   TYR  53           HA       TYR  53  -8.781  -9.211   1.045
  392   1HB   TYR  53          1HB       TYR  53  -7.579  -6.604   0.125
  393   2HB   TYR  53          2HB       TYR  53  -7.309  -8.158  -0.667
  394    HD1  TYR  53           HD1      TYR  53  -9.118  -9.310  -1.864
  395    HD2  TYR  53           HD2      TYR  53  -9.592  -5.323  -0.291
  396    HE1  TYR  53           HE1      TYR  53 -11.019  -8.922  -3.396
  397    HE2  TYR  53           HE2      TYR  53 -11.487  -4.952  -1.794
  398    HH   TYR  53           HH       TYR  53 -12.952  -5.905  -3.308
  399    H    ALA  54           HN       ALA  54  -7.969  -9.350   3.558
  400    HA   ALA  54           HA       ALA  54  -5.188  -8.643   3.945
  401   1HB   ALA  54          1HB       ALA  54  -6.780  -8.868   5.803
  402   2HB   ALA  54          2HB       ALA  54  -6.967 -10.603   5.455
  403   3HB   ALA  54          3HB       ALA  54  -5.405  -9.967   6.016
  404    H    GLY  55           HN       GLY  55  -3.341  -9.959   4.050
  405   1HA   GLY  55          1HA       GLY  55  -2.002 -11.782   3.910
  406   2HA   GLY  55          2HA       GLY  55  -3.431 -12.811   3.748
  407    H    LYS  56           HN       LYS  56  -4.539 -12.663   1.506
  408    HA   LYS  56           HA       LYS  56  -2.434 -13.597  -0.275
  409   1HB   LYS  56          1HB       LYS  56  -4.125 -14.339  -1.708
  410   2HB   LYS  56          2HB       LYS  56  -4.590 -14.711  -0.046
  411   1HG   LYS  56          1HG       LYS  56  -6.132 -12.670  -0.117
  412   2HG   LYS  56          2HG       LYS  56  -5.702 -12.525  -1.844
  413   1HD   LYS  56          2HD       LYS  56  -6.383 -14.955  -2.127
  414   2HD   LYS  56          1HD       LYS  56  -7.040 -14.904  -0.482
  415   1HE   LYS  56          2HE       LYS  56  -8.559 -13.050  -1.188
  416   2HE   LYS  56          1HE       LYS  56  -7.847 -13.117  -2.819
  417   1HZ   LYS  56          2HZ       LYS  56  -8.554 -15.398  -2.960
  418   2HZ   LYS  56          3HZ       LYS  56  -9.319 -15.289  -1.504
  419   3HZ   LYS  56          1HZ       LYS  56  -9.840 -14.372  -2.775
  420    H    VAL  57           HN       VAL  57  -4.213 -10.570  -0.069
  421    HA   VAL  57           HA       VAL  57  -2.999  -9.629  -2.635
  422    HB   VAL  57           HB       VAL  57  -5.120  -8.471  -0.833
  423   1HG1  VAL  57          2HG22     VAL  57  -3.841  -6.675  -1.987
  424   2HG1  VAL  57          1HG21     VAL  57  -4.322  -7.342  -3.540
  425   3HG1  VAL  57          3HG23     VAL  57  -5.555  -6.751  -2.441
  426   1HG2  VAL  57          1HG11     VAL  57  -5.341  -9.960  -3.455
  427   2HG2  VAL  57          2HG12     VAL  57  -6.164 -10.267  -1.917
  428   3HG2  VAL  57          3HG13     VAL  57  -6.618  -8.866  -2.893
  429    H    ILE  58           HN       ILE  58  -1.345  -8.062  -2.500
  430    HA   ILE  58           HA       ILE  58  -0.348  -7.560   0.301
  431    HB   ILE  58           HB       ILE  58   1.114  -7.412  -2.341
  432   1HG1  ILE  58          1HG11     ILE  58   2.484  -9.234  -1.564
  433   2HG1  ILE  58          2HG12     ILE  58   1.544  -9.413  -0.087
  434   1HG2  ILE  58          2HG22     ILE  58   1.929  -5.775  -0.627
  435   2HG2  ILE  58          3HG23     ILE  58   2.171  -7.125   0.494
  436   3HG2  ILE  58          1HG21     ILE  58   3.108  -7.024  -1.011
  437   1HD1  ILE  58          3HD13     ILE  58   0.328  -9.790  -2.859
  438   2HD1  ILE  58          2HD12     ILE  58   1.145 -11.088  -1.981
  439   3HD1  ILE  58          1HD11     ILE  58  -0.295 -10.363  -1.286
  440    H    PHE  59           HN       PHE  59  -0.352  -5.558   1.119
  441    HA   PHE  59           HA       PHE  59  -1.143  -3.278  -0.664
  442   1HB   PHE  59          1HB       PHE  59  -2.032  -3.889   2.162
  443   2HB   PHE  59          2HB       PHE  59  -2.140  -2.302   1.432
  444    HD1  PHE  59           HD2      PHE  59  -3.221  -5.872   0.908
  445    HD2  PHE  59           HD1      PHE  59  -4.074  -1.699   0.272
  446    HE1  PHE  59           HE2      PHE  59  -5.413  -6.441  -0.005
  447    HE2  PHE  59           HE1      PHE  59  -6.195  -2.286  -0.837
  448    HZ   PHE  59           HZ       PHE  59  -6.900  -4.674  -0.971
  449    H    LEU  60           HN       LEU  60   0.660  -2.252  -1.004
  450    HA   LEU  60           HA       LEU  60   2.690  -1.876   1.155
  451   1HB   LEU  60          1HB       LEU  60   2.660  -1.605  -1.871
  452   2HB   LEU  60          2HB       LEU  60   4.015  -1.034  -0.869
  453    HG   LEU  60           HG       LEU  60   3.028  -3.890  -1.204
  454   1HD1  LEU  60          1HD21     LEU  60   4.291  -2.925  -3.119
  455   2HD1  LEU  60          2HD22     LEU  60   5.625  -2.520  -2.020
  456   3HD1  LEU  60          3HD23     LEU  60   5.196  -4.218  -2.313
  457   1HD2  LEU  60          1HD11     LEU  60   5.174  -2.695   0.591
  458   2HD2  LEU  60          2HD12     LEU  60   3.850  -3.793   1.051
  459   3HD2  LEU  60          3HD13     LEU  60   5.206  -4.389   0.076
  460    H    LYS  61           HN       LYS  61   2.012  -0.109   2.412
  461    HA   LYS  61           HA       LYS  61   1.188   2.359   0.937
  462   1HB   LYS  61          1HB       LYS  61  -0.102   1.987   2.902
  463   2HB   LYS  61          2HB       LYS  61   1.330   1.670   3.872
  464   1HG   LYS  61          1HG       LYS  61   0.490   3.885   4.377
  465   2HG   LYS  61          2HG       LYS  61   2.060   4.032   3.595
  466   1HD   LYS  61          1HD       LYS  61   0.770   4.471   1.382
  467   2HD   LYS  61          2HD       LYS  61  -0.698   4.473   2.366
  468   1HE   LYS  61          2HE       LYS  61  -0.020   6.736   2.029
  469   2HE   LYS  61          1HE       LYS  61   0.335   6.362   3.721
  470   1HZ   LYS  61          3HZ       LYS  61   2.300   6.326   1.510
  471   2HZ   LYS  61          2HZ       LYS  61   2.132   7.525   2.627
  472   3HZ   LYS  61          1HZ       LYS  61   2.623   6.027   3.095
  473    H    VAL  62           HN       VAL  62   2.772   3.697   0.187
  474    HA   VAL  62           HA       VAL  62   5.468   3.598   1.473
  475    HB   VAL  62           HB       VAL  62   4.752   3.692  -1.491
  476   1HG1  VAL  62          1HG11     VAL  62   7.460   3.596  -0.098
  477   2HG1  VAL  62          2HG12     VAL  62   7.205   3.441  -1.848
  478   3HG1  VAL  62          3HG13     VAL  62   6.843   4.968  -1.045
  479   1HG2  VAL  62          3HG23     VAL  62   6.052   1.499   0.193
  480   2HG2  VAL  62          2HG22     VAL  62   4.439   1.427  -0.537
  481   3HG2  VAL  62          1HG21     VAL  62   5.869   1.473  -1.567
  482    H    ASP  63           HN       ASP  63   6.550   5.478   1.667
  483    HA   ASP  63           HA       ASP  63   5.059   7.997   1.227
  484   1HB   ASP  63          1HB       ASP  63   5.886   7.693   3.479
  485   2HB   ASP  63          2HB       ASP  63   7.522   7.387   2.879
  486    H    VAL  64           HN       VAL  64   5.447   8.759  -0.753
  487    HA   VAL  64           HA       VAL  64   7.549   8.155  -2.543
  488    HB   VAL  64           HB       VAL  64   5.704  10.570  -2.241
  489   1HG1  VAL  64          2HG22     VAL  64   7.535   9.869  -4.575
  490   2HG1  VAL  64          1HG21     VAL  64   6.189  11.023  -4.655
  491   3HG1  VAL  64          3HG23     VAL  64   7.568  11.356  -3.601
  492   1HG2  VAL  64          1HG11     VAL  64   4.657   8.331  -2.695
  493   2HG2  VAL  64          2HG12     VAL  64   4.443   9.463  -4.038
  494   3HG2  VAL  64          3HG13     VAL  64   5.686   8.188  -4.130
  495    H    ASP  65           HN       ASP  65   7.400  10.513   0.120
  496    HA   ASP  65           HA       ASP  65   9.663  12.101  -0.735
  497   1HB   ASP  65          2HB       ASP  65   8.486  11.771   2.030
  498   2HB   ASP  65          1HB       ASP  65   9.588  13.033   1.474
  499    H    ALA  66           HN       ALA  66   9.328   8.944   0.823
  500    HA   ALA  66           HA       ALA  66  12.037   9.066   2.023
  501   1HB   ALA  66          1HB       ALA  66  10.192   8.190   3.374
  502   2HB   ALA  66          3HB       ALA  66   9.873   6.939   2.160
  503   3HB   ALA  66          2HB       ALA  66  11.417   6.951   3.044
  504    H    VAL  67           HN       VAL  67  10.339   6.457   0.120
  505    HA   VAL  67           HA       VAL  67  13.009   5.716  -0.952
  506    HB   VAL  67           HB       VAL  67  11.810   3.889  -2.110
  507   1HG1  VAL  67          1HG11     VAL  67  11.770   3.972   0.902
  508   2HG1  VAL  67          2HG12     VAL  67  11.631   2.497  -0.091
  509   3HG1  VAL  67          3HG13     VAL  67  13.109   3.460  -0.142
  510   1HG2  VAL  67          2HG22     VAL  67   9.497   4.825  -2.042
  511   2HG2  VAL  67          1HG21     VAL  67   9.637   3.194  -1.365
  512   3HG2  VAL  67          3HG23     VAL  67   9.505   4.597  -0.277
  513    H    ALA  68           HN       ALA  68  12.920   8.030  -1.806
  514    HA   ALA  68           HA       ALA  68  11.532   8.828  -4.084
  515   1HB   ALA  68          1HB       ALA  68  14.486   9.257  -3.434
  516   2HB   ALA  68          2HB       ALA  68  13.526  10.204  -4.592
  517   3HB   ALA  68          3HB       ALA  68  13.127  10.252  -2.863
  518    H    ALA  69           HN       ALA  69  14.362   6.680  -3.838
  519    HA   ALA  69           HA       ALA  69  14.954   6.284  -6.558
  520   1HB   ALA  69          1HB       ALA  69  15.173   4.329  -4.227
  521   2HB   ALA  69          2HB       ALA  69  15.990   4.178  -5.797
  522   3HB   ALA  69          3HB       ALA  69  16.390   5.528  -4.719
  523    H    VAL  70           HN       VAL  70  12.695   4.400  -4.445
  524    HA   VAL  70           HA       VAL  70  11.949   2.553  -6.541
  525    HB   VAL  70           HB       VAL  70  10.482   3.279  -3.977
  526   1HG1  VAL  70          2HG22     VAL  70  10.207   0.872  -5.841
  527   2HG1  VAL  70          1HG21     VAL  70   9.401   1.081  -4.276
  528   3HG1  VAL  70          3HG23     VAL  70   8.998   2.150  -5.624
  529   1HG2  VAL  70          1HG11     VAL  70  12.777   2.323  -3.574
  530   2HG2  VAL  70          3HG13     VAL  70  11.490   1.204  -3.094
  531   3HG2  VAL  70          2HG12     VAL  70  12.358   0.952  -4.621
  532    H    ALA  71           HN       ALA  71  10.540   5.510  -5.148
  533    HA   ALA  71           HA       ALA  71   8.184   5.654  -6.680
  534   1HB   ALA  71          2HB       ALA  71   8.696   7.100  -4.742
  535   2HB   ALA  71          1HB       ALA  71   9.919   7.963  -5.694
  536   3HB   ALA  71          3HB       ALA  71   8.215   8.059  -6.154
  537    H    GLU  72           HN       GLU  72  11.395   7.188  -7.520
  538    HA   GLU  72           HA       GLU  72  10.374   8.136 -10.041
  539   1HB   GLU  72          2HB       GLU  72  12.603   8.827 -10.518
  540   2HB   GLU  72          1HB       GLU  72  12.246   9.188  -8.825
  541   1HG   GLU  72          1HG       GLU  72  13.506   7.068  -8.216
  542   2HG   GLU  72          2HG       GLU  72  13.990   6.930  -9.903
  543    H    ALA  73           HN       ALA  73  12.206   5.165  -9.083
  544    HA   ALA  73           HA       ALA  73  12.667   4.210 -11.712
  545   1HB   ALA  73          3HB       ALA  73  12.130   2.647  -9.144
  546   2HB   ALA  73          1HB       ALA  73  12.838   1.991 -10.634
  547   3HB   ALA  73          2HB       ALA  73  13.711   3.229  -9.712
  548    H    ALA  74           HN       ALA  74   9.882   3.690  -9.507
  549    HA   ALA  74           HA       ALA  74   8.348   2.111 -11.364
  550   1HB   ALA  74          3HB       ALA  74   7.685   3.640  -8.825
  551   2HB   ALA  74          2HB       ALA  74   6.485   2.688  -9.729
  552   3HB   ALA  74          1HB       ALA  74   7.914   1.901  -9.033
  553    H    GLY  75           HN       GLY  75   8.628   5.582 -10.733
  554   1HA   GLY  75          1HA       GLY  75   8.376   7.201 -12.448
  555   2HA   GLY  75          2HA       GLY  75   7.237   6.148 -13.304
  556    H    ILE  76           HN       ILE  76   7.378   7.291  -9.897
  557    HA   ILE  76           HA       ILE  76   4.507   7.988  -9.964
  558    HB   ILE  76           HB       ILE  76   6.649   7.884  -7.830
  559   1HG1  ILE  76          2HG12     ILE  76   5.401   6.141  -6.896
  560   2HG1  ILE  76          1HG11     ILE  76   3.931   6.540  -7.793
  561   1HG2  ILE  76          3HG23     ILE  76   3.839   9.050  -7.652
  562   2HG2  ILE  76          2HG22     ILE  76   4.712   8.433  -6.244
  563   3HG2  ILE  76          1HG21     ILE  76   5.363   9.801  -7.135
  564   1HD1  ILE  76          3HD13     ILE  76   6.408   5.363  -9.048
  565   2HD1  ILE  76          1HD11     ILE  76   4.976   4.450  -8.564
  566   3HD1  ILE  76          2HD12     ILE  76   4.839   5.650  -9.843
  567    H    THR  77           HN       THR  77   4.266   9.740 -11.305
  568    HA   THR  77           HA       THR  77   5.861  12.186 -10.865
  569    HB   THR  77           HB       THR  77   4.420  12.913 -12.833
  570    HG1  THR  77           HG1      THR  77   3.399  11.046 -13.884
  571   1HG2  THR  77          1HG21     THR  77   6.704  11.958 -13.138
  572   2HG2  THR  77          2HG22     THR  77   6.008  10.327 -13.218
  573   3HG2  THR  77          3HG23     THR  77   5.622  11.521 -14.473
  574    H    ALA  78           HN       ALA  78   2.418  11.658 -11.439
  575    HA   ALA  78           HA       ALA  78   1.659  13.853  -9.655
  576   1HB   ALA  78          2HB       ALA  78   0.002  11.892 -11.281
  577   2HB   ALA  78          3HB       ALA  78  -0.625  13.322 -10.433
  578   3HB   ALA  78          1HB       ALA  78   0.514  13.514 -11.780
  579    H    MET  79           HN       MET  79   2.727  12.736  -7.759
  580    HA   MET  79           HA       MET  79   1.323  10.571  -6.488
  581   1HB   MET  79          1HB       MET  79   2.506  11.042  -4.487
  582   2HB   MET  79          2HB       MET  79   3.609  11.191  -5.848
  583   1HG   MET  79          1HG       MET  79   2.327  13.520  -4.348
  584   2HG   MET  79          2HG       MET  79   3.948  12.901  -4.090
  585   1HE   MET  79          1HE       MET  79   6.026  13.402  -5.505
  586   2HE   MET  79          3HE       MET  79   5.286  12.480  -6.842
  587   3HE   MET  79          2HE       MET  79   5.953  14.096  -7.141
  588    HA   PRO  80           HA       PRO  80   0.316  10.043  -4.339
  589   1HB   PRO  80          2HB       PRO  80  -2.167   9.172  -3.679
  590   2HB   PRO  80          1HB       PRO  80  -1.291  10.401  -2.727
  591   1HG   PRO  80          1HG       PRO  80  -3.375  10.925  -4.852
  592   2HG   PRO  80          2HG       PRO  80  -3.291  11.565  -3.180
  593   1HD   PRO  80          2HD       PRO  80  -2.318  12.977  -5.330
  594   2HD   PRO  80          1HD       PRO  80  -1.507  13.034  -3.738
  595    H    THR  81           HN       THR  81   0.514   8.175  -5.423
  596    HA   THR  81           HA       THR  81  -1.009   7.711  -7.946
  597    HB   THR  81           HB       THR  81   1.933   7.325  -7.346
  598    HG1  THR  81           HG1      THR  81   0.549   9.425  -8.400
  599   1HG2  THR  81          3HG23     THR  81   0.355   6.787  -9.908
  600   2HG2  THR  81          2HG22     THR  81   2.123   6.786  -9.783
  601   3HG2  THR  81          1HG21     THR  81   1.178   5.586  -8.890
  602    H    PHE  82           HN       PHE  82  -1.614   5.609  -8.300
  603    HA   PHE  82           HA       PHE  82  -1.075   3.621  -6.137
  604   1HB   PHE  82          2HB       PHE  82  -3.647   4.261  -7.596
  605   2HB   PHE  82          1HB       PHE  82  -3.398   2.807  -6.635
  606    HD1  PHE  82           HD2      PHE  82  -3.755   6.506  -6.505
  607    HD2  PHE  82           HD1      PHE  82  -3.252   2.888  -4.198
  608    HE1  PHE  82           HE2      PHE  82  -3.981   7.802  -4.418
  609    HE2  PHE  82           HE1      PHE  82  -3.647   4.178  -2.120
  610    HZ   PHE  82           HZ       PHE  82  -3.777   6.642  -2.205
  611    H    HIS  83           HN       HIS  83  -0.001   1.916  -6.994
  612    HA   HIS  83           HA       HIS  83  -0.431   1.261  -9.909
  613   1HB   HIS  83          2HB       HIS  83   2.029   0.896  -8.201
  614   2HB   HIS  83          1HB       HIS  83   1.777   0.113  -9.755
  615    HD2  HIS  83           HD2      HIS  83   0.583   3.588 -10.326
  616    HE1  HIS  83           HE1      HIS  83   4.712   3.560 -11.220
  617    HE2  HIS  83           HE2      HIS  83   2.515   4.842 -11.550
  618    H    VAL  84           HN       VAL  84  -0.751  -0.883 -10.392
  619    HA   VAL  84           HA       VAL  84  -1.129  -2.746  -8.069
  620    HB   VAL  84           HB       VAL  84  -2.568  -2.922 -10.741
  621   1HG1  VAL  84          3HG23     VAL  84  -2.943  -4.220  -7.994
  622   2HG1  VAL  84          1HG21     VAL  84  -3.979  -4.471  -9.405
  623   3HG1  VAL  84          2HG22     VAL  84  -2.296  -5.020  -9.443
  624   1HG2  VAL  84          1HG11     VAL  84  -3.624  -1.761  -8.131
  625   2HG2  VAL  84          2HG12     VAL  84  -3.370  -0.862  -9.647
  626   3HG2  VAL  84          3HG13     VAL  84  -4.582  -2.146  -9.577
  627    H    TYR  85           HN       TYR  85   0.874  -3.744  -8.047
  628    HA   TYR  85           HA       TYR  85   2.087  -4.581 -10.625
  629   1HB   TYR  85          1HB       TYR  85   3.075  -4.672  -7.766
  630   2HB   TYR  85          2HB       TYR  85   3.886  -5.469  -9.115
  631    HD1  TYR  85           HD1      TYR  85   3.003  -2.200  -7.639
  632    HD2  TYR  85           HD2      TYR  85   5.121  -4.227 -10.796
  633    HE1  TYR  85           HE1      TYR  85   4.089  -0.060  -8.308
  634    HE2  TYR  85           HE2      TYR  85   6.161  -2.077 -11.476
  635    HH   TYR  85           HH       TYR  85   5.001   0.996 -10.172
  636    H    LYS  86           HN       LYS  86   1.160  -6.466 -11.423
  637    HA   LYS  86           HA       LYS  86  -0.022  -8.390  -9.461
  638   1HB   LYS  86          2HB       LYS  86  -1.325  -7.911 -11.465
  639   2HB   LYS  86          1HB       LYS  86   0.000  -8.476 -12.497
  640   1HG   LYS  86          2HG       LYS  86  -0.347 -10.677 -12.024
  641   2HG   LYS  86          1HG       LYS  86  -0.792 -10.403 -10.342
  642   1HD   LYS  86          1HD       LYS  86  -2.657  -9.700 -12.642
  643   2HD   LYS  86          2HD       LYS  86  -2.621 -11.292 -11.858
  644   1HE   LYS  86          2HE       LYS  86  -3.120 -10.302  -9.669
  645   2HE   LYS  86          1HE       LYS  86  -3.148  -8.674 -10.368
  646   1HZ   LYS  86          3HZ       LYS  86  -4.948 -10.867 -11.095
  647   2HZ   LYS  86          2HZ       LYS  86  -5.311  -9.597 -10.110
  648   3HZ   LYS  86          1HZ       LYS  86  -4.989  -9.334 -11.707
  649    H    ASP  87           HN       ASP  87   1.411  -9.719  -8.593
  650    HA   ASP  87           HA       ASP  87   3.104 -11.086  -8.143
  651   1HB   ASP  87          1HB       ASP  87   3.400 -11.328 -11.184
  652   2HB   ASP  87          2HB       ASP  87   4.097 -12.417  -9.991
  653    H    GLY  88           HN       GLY  88   4.168  -9.177 -10.893
  654   1HA   GLY  88          1HA       GLY  88   6.075  -7.622  -9.382
  655   2HA   GLY  88          2HA       GLY  88   6.899  -8.911 -10.284
  656    H    VAL  89           HN       VAL  89   3.963  -7.587 -11.776
  657    HA   VAL  89           HA       VAL  89   5.594  -5.718 -13.422
  658    HB   VAL  89           HB       VAL  89   5.524  -7.741 -14.697
  659   1HG1  VAL  89          3HG13     VAL  89   2.501  -7.804 -14.310
  660   2HG1  VAL  89          1HG11     VAL  89   3.419  -8.811 -15.442
  661   3HG1  VAL  89          2HG12     VAL  89   3.690  -8.984 -13.710
  662   1HG2  VAL  89          1HG21     VAL  89   5.162  -5.584 -15.881
  663   2HG2  VAL  89          3HG23     VAL  89   4.438  -6.968 -16.717
  664   3HG2  VAL  89          2HG22     VAL  89   3.406  -5.853 -15.807
  665    H    LYS  90           HN       LYS  90   4.598  -3.840 -13.809
  666    HA   LYS  90           HA       LYS  90   2.361  -3.015 -12.279
  667   1HB   LYS  90          2HB       LYS  90   4.254  -1.600 -13.195
  668   2HB   LYS  90          1HB       LYS  90   3.463  -1.665 -14.776
  669   1HG   LYS  90          1HG       LYS  90   1.365  -0.741 -13.588
  670   2HG   LYS  90          2HG       LYS  90   2.387  -0.490 -12.170
  671   1HD   LYS  90          2HD       LYS  90   2.667   0.809 -14.921
  672   2HD   LYS  90          1HD       LYS  90   2.158   1.572 -13.412
  673   1HE   LYS  90          1HE       LYS  90   4.440   1.088 -12.471
  674   2HE   LYS  90          2HE       LYS  90   4.945   0.489 -14.057
  675   1HZ   LYS  90          3HZ       LYS  90   3.903   3.185 -13.555
  676   2HZ   LYS  90          2HZ       LYS  90   5.503   2.807 -13.650
  677   3HZ   LYS  90          1HZ       LYS  90   4.526   2.618 -14.969
  678    H    ALA  91           HN       ALA  91   0.539  -4.255 -12.625
  679    HA   ALA  91           HA       ALA  91  -0.459  -4.862 -15.310
  680   1HB   ALA  91          1HB       ALA  91  -0.700  -6.459 -13.453
  681   2HB   ALA  91          2HB       ALA  91  -1.677  -5.283 -12.541
  682   3HB   ALA  91          3HB       ALA  91  -2.285  -5.954 -14.069
  683    H    ASP  92           HN       ASP  92  -0.936  -2.415 -12.799
  684    HA   ASP  92           HA       ASP  92  -2.535  -0.871 -14.681
  685   1HB   ASP  92          2HB       ASP  92  -3.969  -2.573 -13.094
  686   2HB   ASP  92          1HB       ASP  92  -3.908  -1.172 -12.024
  687    H    ASP  93           HN       ASP  93  -3.263   1.213 -13.618
  688    HA   ASP  93           HA       ASP  93  -1.321   2.309 -11.672
  689   1HB   ASP  93          1HB       ASP  93  -0.628   2.537 -14.207
  690   2HB   ASP  93          2HB       ASP  93  -1.824   3.820 -14.255
  691    H    LEU  94           HN       LEU  94  -2.011   4.777 -11.657
  692    HA   LEU  94           HA       LEU  94  -4.482   5.880 -12.098
  693   1HB   LEU  94          2HB       LEU  94  -5.748   4.302 -10.878
  694   2HB   LEU  94          1HB       LEU  94  -4.502   4.111  -9.641
  695    HG   LEU  94           HG       LEU  94  -5.084   6.430  -8.798
  696   1HD1  LEU  94          1HD11     LEU  94  -6.213   7.079 -11.104
  697   2HD1  LEU  94          3HD13     LEU  94  -7.604   6.210 -10.473
  698   3HD1  LEU  94          2HD12     LEU  94  -6.950   7.611  -9.594
  699   1HD2  LEU  94          1HD21     LEU  94  -7.352   4.420  -8.847
  700   2HD2  LEU  94          2HD22     LEU  94  -5.994   4.443  -7.711
  701   3HD2  LEU  94          3HD23     LEU  94  -7.164   5.771  -7.710
  702    H    VAL  95           HN       VAL  95  -4.507   8.010 -11.223
  703    HA   VAL  95           HA       VAL  95  -2.491   8.734  -9.211
  704    HB   VAL  95           HB       VAL  95  -2.040  10.801 -10.546
  705   1HG1  VAL  95          3HG13     VAL  95  -0.429   8.981 -10.464
  706   2HG1  VAL  95          1HG11     VAL  95  -1.213   8.166 -11.836
  707   3HG1  VAL  95          2HG12     VAL  95  -0.411   9.730 -12.069
  708   1HG2  VAL  95          1HG21     VAL  95  -3.987  10.728 -12.097
  709   2HG2  VAL  95          3HG23     VAL  95  -2.446  10.830 -12.956
  710   3HG2  VAL  95          2HG22     VAL  95  -3.305   9.283 -12.876
  711    H    GLY  96           HN       GLY  96  -3.121  10.444  -7.926
  712   1HA   GLY  96          1HA       GLY  96  -4.522  12.137  -7.122
  713   2HA   GLY  96          2HA       GLY  96  -5.682  11.835  -8.430
  714    H    ALA  97           HN       ALA  97  -6.679  12.241  -5.973
  715    HA   ALA  97           HA       ALA  97  -6.955   9.882  -4.333
  716   1HB   ALA  97          1HB       ALA  97  -7.010  12.291  -3.541
  717   2HB   ALA  97          3HB       ALA  97  -8.573  12.472  -4.352
  718   3HB   ALA  97          2HB       ALA  97  -8.402  11.332  -3.002
  719    H    SER  98           HN       SER  98  -7.774   9.028  -6.882
  720    HA   SER  98           HA       SER  98 -10.734   9.200  -6.991
  721   1HB   SER  98          2HB       SER  98  -9.249   9.125  -9.045
  722   2HB   SER  98          1HB       SER  98  -8.959   7.411  -8.666
  723    HG   SER  98           HG       SER  98 -10.765   7.769 -10.083
  724    H    GLN  99           HN       GLN  99 -10.735   8.408  -4.691
  725    HA   GLN  99           HA       GLN  99 -10.033   5.871  -3.821
  726   1HB   GLN  99          2HB       GLN  99 -11.846   6.051  -2.182
  727   2HB   GLN  99          1HB       GLN  99 -10.909   7.542  -2.341
  728   1HG   GLN  99          2HG       GLN  99 -12.719   8.545  -3.725
  729   2HG   GLN  99          1HG       GLN  99 -13.688   7.074  -3.521
  730   1HE2  GLN  99          2HE22     GLN  99 -14.409   7.716  -0.054
  731   2HE2  GLN  99          1HE21     GLN  99 -14.137   6.398  -1.183
  732    H    ASP 100           HN       ASP 100 -12.930   6.723  -5.711
  733    HA   ASP 100           HA       ASP 100 -14.242   4.205  -5.674
  734   1HB   ASP 100          1HB       ASP 100 -15.330   6.225  -6.514
  735   2HB   ASP 100          2HB       ASP 100 -14.133   6.384  -7.814
  736    H    LYS 101           HN       LYS 101 -11.792   5.548  -7.961
  737    HA   LYS 101           HA       LYS 101 -11.744   3.176  -9.563
  738   1HB   LYS 101          1HB       LYS 101 -11.031   5.470 -10.316
  739   2HB   LYS 101          2HB       LYS 101  -9.625   5.334  -9.259
  740   1HG   LYS 101          2HG       LYS 101  -9.101   4.846 -11.632
  741   2HG   LYS 101          1HG       LYS 101  -8.721   3.502 -10.556
  742   1HD   LYS 101          2HD       LYS 101  -9.711   2.782 -12.678
  743   2HD   LYS 101          1HD       LYS 101 -10.672   2.264 -11.295
  744   1HE   LYS 101          1HE       LYS 101 -12.287   4.124 -11.712
  745   2HE   LYS 101          2HE       LYS 101 -11.273   4.703 -13.049
  746   1HZ   LYS 101          2HZ       LYS 101 -11.688   2.627 -14.157
  747   2HZ   LYS 101          1HZ       LYS 101 -12.618   2.097 -12.901
  748   3HZ   LYS 101          3HZ       LYS 101 -13.104   3.390 -13.798
  749    H    LEU 102           HN       LEU 102  -9.869   4.333  -6.753
  750    HA   LEU 102           HA       LEU 102  -7.876   2.367  -6.648
  751   1HB   LEU 102          2HB       LEU 102  -8.615   4.465  -5.043
  752   2HB   LEU 102          1HB       LEU 102  -9.195   3.135  -4.054
  753    HG   LEU 102           HG       LEU 102  -6.382   3.788  -4.998
  754   1HD1  LEU 102          1HD11     LEU 102  -7.745   3.578  -2.267
  755   2HD1  LEU 102          3HD13     LEU 102  -6.036   3.939  -2.519
  756   3HD1  LEU 102          2HD12     LEU 102  -7.265   5.073  -3.102
  757   1HD2  LEU 102          3HD23     LEU 102  -7.269   1.322  -3.451
  758   2HD2  LEU 102          2HD22     LEU 102  -6.537   1.338  -5.077
  759   3HD2  LEU 102          1HD21     LEU 102  -5.587   1.867  -3.689
  760    H    LYS 103           HN       LYS 103 -11.156   2.343  -5.172
  761    HA   LYS 103           HA       LYS 103 -11.128  -0.305  -4.149
  762   1HB   LYS 103          1HB       LYS 103 -13.376   1.545  -5.063
  763   2HB   LYS 103          2HB       LYS 103 -13.646  -0.011  -4.275
  764   1HG   LYS 103          1HG       LYS 103 -12.499   0.692  -2.281
  765   2HG   LYS 103          2HG       LYS 103 -11.987   2.217  -3.023
  766   1HD   LYS 103          2HD       LYS 103 -14.381   2.874  -3.268
  767   2HD   LYS 103          1HD       LYS 103 -14.872   1.376  -2.464
  768   1HE   LYS 103          1HE       LYS 103 -13.129   3.577  -1.247
  769   2HE   LYS 103          2HE       LYS 103 -14.849   3.313  -0.906
  770   1HZ   LYS 103          2HZ       LYS 103 -14.275   1.158  -0.029
  771   2HZ   LYS 103          3HZ       LYS 103 -12.674   1.435  -0.303
  772   3HZ   LYS 103          1HZ       LYS 103 -13.495   2.362   0.781
  773    H    ALA 104           HN       ALA 104 -12.458   0.948  -7.267
  774    HA   ALA 104           HA       ALA 104 -13.347  -1.514  -8.282
  775   1HB   ALA 104          3HB       ALA 104 -13.844   0.698  -9.283
  776   2HB   ALA 104          2HB       ALA 104 -12.158   0.831  -9.828
  777   3HB   ALA 104          1HB       ALA 104 -13.206  -0.440 -10.488
  778    H    LEU 105           HN       LEU 105 -10.106  -0.005  -8.604
  779    HA   LEU 105           HA       LEU 105  -8.933  -1.959 -10.279
  780   1HB   LEU 105          1HB       LEU 105  -7.794  -0.045  -8.211
  781   2HB   LEU 105          2HB       LEU 105  -6.764  -1.137  -9.132
  782    HG   LEU 105           HG       LEU 105  -8.630   0.881 -10.454
  783   1HD1  LEU 105          3HD13     LEU 105  -6.896   2.007  -9.080
  784   2HD1  LEU 105          1HD11     LEU 105  -5.635   1.038  -9.874
  785   3HD1  LEU 105          2HD12     LEU 105  -6.587   2.201 -10.817
  786   1HD2  LEU 105          1HD21     LEU 105  -6.361  -0.857 -11.479
  787   2HD2  LEU 105          3HD23     LEU 105  -8.062  -0.922 -11.991
  788   3HD2  LEU 105          2HD22     LEU 105  -7.083   0.487 -12.393
  789    H    VAL 106           HN       VAL 106  -8.751  -1.636  -6.660
  790    HA   VAL 106           HA       VAL 106  -7.404  -4.118  -6.318
  791    HB   VAL 106           HB       VAL 106  -9.078  -2.329  -4.564
  792   1HG1  VAL 106          2HG12     VAL 106  -8.406  -5.212  -3.803
  793   2HG1  VAL 106          1HG11     VAL 106  -8.826  -3.933  -2.654
  794   3HG1  VAL 106          3HG13     VAL 106 -10.019  -4.453  -3.847
  795   1HG2  VAL 106          2HG22     VAL 106  -6.602  -2.158  -4.918
  796   2HG2  VAL 106          3HG23     VAL 106  -7.041  -2.474  -3.214
  797   3HG2  VAL 106          1HG21     VAL 106  -6.430  -3.798  -4.236
  798    H    ALA 107           HN       ALA 107 -10.895  -3.427  -6.440
  799    HA   ALA 107           HA       ALA 107 -11.672  -5.997  -5.795
  800   1HB   ALA 107          2HB       ALA 107 -13.244  -4.077  -5.908
  801   2HB   ALA 107          3HB       ALA 107 -13.112  -4.051  -7.680
  802   3HB   ALA 107          1HB       ALA 107 -13.861  -5.437  -6.866
  803    H    LYS 108           HN       LYS 108 -11.142  -4.693  -9.177
  804    HA   LYS 108           HA       LYS 108 -11.738  -7.231 -10.370
  805   1HB   LYS 108          1HB       LYS 108 -10.854  -6.316 -12.360
  806   2HB   LYS 108          2HB       LYS 108 -11.889  -5.117 -11.560
  807   1HG   LYS 108          1HG       LYS 108  -9.813  -3.954 -10.822
  808   2HG   LYS 108          2HG       LYS 108  -8.862  -5.144 -11.744
  809   1HD   LYS 108          2HD       LYS 108  -9.063  -3.073 -12.956
  810   2HD   LYS 108          1HD       LYS 108  -9.809  -4.409 -13.835
  811   1HE   LYS 108          2HE       LYS 108 -12.041  -3.631 -13.261
  812   2HE   LYS 108          1HE       LYS 108 -11.402  -2.508 -12.045
  813   1HZ   LYS 108          1HZ       LYS 108 -10.980  -2.326 -14.948
  814   2HZ   LYS 108          3HZ       LYS 108 -12.019  -1.404 -14.063
  815   3HZ   LYS 108          2HZ       LYS 108 -10.394  -1.271 -13.826
  816    H    HIS 109           HN       HIS 109  -8.627  -5.638  -9.595
  817    HA   HIS 109           HA       HIS 109  -7.027  -7.812 -10.597
  818   1HB   HIS 109          2HB       HIS 109  -6.392  -5.410  -8.840
  819   2HB   HIS 109          1HB       HIS 109  -5.200  -6.565  -9.413
  820    HD2  HIS 109           HD2      HIS 109  -7.147  -3.506 -10.805
  821    HE1  HIS 109           HE1      HIS 109  -4.829  -5.114 -13.928
  822    HE2  HIS 109           HE2      HIS 109  -6.256  -3.137 -13.236
  823    H    ALA 110           HN       ALA 110  -8.691  -7.452  -7.570
  824    HA   ALA 110           HA       ALA 110  -7.283  -8.631  -5.642
  825   1HB   ALA 110          2HB       ALA 110 -10.134  -9.320  -6.427
  826   2HB   ALA 110          1HB       ALA 110  -9.370  -9.699  -4.870
  827   3HB   ALA 110          3HB       ALA 110  -9.603  -8.011  -5.345
  828    H    ALA 111           HN       ALA 111  -8.731 -10.384  -8.386
  829    HA   ALA 111           HA       ALA 111  -8.515 -12.471  -9.226
  830   1HB   ALA 111          2HB       ALA 111  -6.093 -11.898  -9.252
  831   2HB   ALA 111          1HB       ALA 111  -5.890 -12.639  -7.655
  832   3HB   ALA 111          3HB       ALA 111  -6.396 -13.627  -9.040
  833    H    ALA 112           HN       ALA 112  -6.895 -14.411  -6.955
  834    HA   ALA 112           HA       ALA 112  -9.006 -14.779  -5.073
  835   1HB   ALA 112          3HB       ALA 112  -8.541 -16.870  -7.255
  836   2HB   ALA 112          2HB       ALA 112  -9.497 -17.111  -5.777
  837   3HB   ALA 112          1HB       ALA 112 -10.043 -15.949  -7.003
   
  No H/Q in entry =         837
  Start of MODEL    7
    1   1H    GLY   1          2HN       GLY   1  -4.257 -12.567   3.262
    2   2H    GLY   1          1HN       GLY   1  -4.464 -14.127   3.802
    3   3H    GLY   1          3HN       GLY   1  -5.393 -12.869   4.379
    4   1HA   GLY   1          1HA       GLY   1  -3.788 -13.437   6.030
    5   2HA   GLY   1          2HA       GLY   1  -2.509 -13.153   4.825
    6    H    GLY   2           HN       GLY   2  -2.903 -11.674   7.376
    7   1HA   GLY   2          1HA       GLY   2  -4.062  -9.078   6.755
    8   2HA   GLY   2          2HA       GLY   2  -3.150  -9.550   8.196
    9    H    SER   3           HN       SER   3  -2.314  -9.492   4.682
   10    HA   SER   3           HA       SER   3   0.324  -8.363   5.214
   11   1HB   SER   3          1HB       SER   3  -1.169  -8.994   2.643
   12   2HB   SER   3          2HB       SER   3   0.579  -8.701   2.810
   13    HG   SER   3           HG       SER   3   0.636 -10.575   4.170
   14    H    VAL   4           HN       VAL   4  -1.079  -6.593   6.298
   15    HA   VAL   4           HA       VAL   4  -2.096  -4.477   4.517
   16    HB   VAL   4           HB       VAL   4  -1.864  -4.899   7.548
   17   1HG1  VAL   4          1HG21     VAL   4  -3.001  -2.491   6.121
   18   2HG1  VAL   4          3HG23     VAL   4  -3.533  -2.989   7.736
   19   3HG1  VAL   4          2HG22     VAL   4  -1.847  -2.569   7.465
   20   1HG2  VAL   4          2HG12     VAL   4  -4.262  -5.083   5.672
   21   2HG2  VAL   4          1HG11     VAL   4  -3.521  -6.386   6.575
   22   3HG2  VAL   4          3HG13     VAL   4  -4.376  -5.102   7.427
   23    H    ILE   5           HN       ILE   5  -1.246  -2.101   5.229
   24    HA   ILE   5           HA       ILE   5   1.510  -2.163   4.526
   25    HB   ILE   5           HB       ILE   5   1.469   0.208   4.653
   26   1HG1  ILE   5          1HG11     ILE   5  -1.178  -0.084   6.168
   27   2HG1  ILE   5          2HG12     ILE   5   0.299   0.733   6.711
   28   1HG2  ILE   5          1HG21     ILE   5   0.237  -1.051   2.844
   29   2HG2  ILE   5          2HG22     ILE   5  -1.286  -0.647   3.649
   30   3HG2  ILE   5          3HG23     ILE   5  -0.219   0.644   3.022
   31   1HD1  ILE   5          2HD12     ILE   5  -0.020   2.471   4.994
   32   2HD1  ILE   5          1HD11     ILE   5  -1.586   1.734   4.564
   33   3HD1  ILE   5          3HD13     ILE   5  -1.319   2.382   6.187
   34    H    VAL   6           HN       VAL   6   3.188  -1.865   5.659
   35    HA   VAL   6           HA       VAL   6   3.322  -0.461   8.005
   36    HB   VAL   6           HB       VAL   6   2.539  -2.494   9.185
   37   1HG1  VAL   6          2HG12     VAL   6   3.080  -4.195   7.482
   38   2HG1  VAL   6          1HG11     VAL   6   4.798  -4.095   7.918
   39   3HG1  VAL   6          3HG13     VAL   6   3.612  -4.658   9.101
   40   1HG2  VAL   6          1HG21     VAL   6   4.303  -1.196  10.318
   41   2HG2  VAL   6          3HG23     VAL   6   4.256  -2.904  10.793
   42   3HG2  VAL   6          2HG22     VAL   6   5.524  -2.329   9.700
   43    H    ILE   7           HN       ILE   7   4.332   0.477   6.203
   44    HA   ILE   7           HA       ILE   7   7.155  -0.099   5.966
   45    HB   ILE   7           HB       ILE   7   6.147  -1.877   4.595
   46   1HG1  ILE   7          2HG12     ILE   7   7.143   0.182   2.574
   47   2HG1  ILE   7          1HG11     ILE   7   8.212  -0.560   3.767
   48   1HG2  ILE   7          2HG22     ILE   7   4.346   0.276   3.733
   49   2HG2  ILE   7          1HG21     ILE   7   4.843  -0.843   2.454
   50   3HG2  ILE   7          3HG23     ILE   7   4.070  -1.457   3.914
   51   1HD1  ILE   7          1HD11     ILE   7   6.447  -2.226   1.927
   52   2HD1  ILE   7          2HD12     ILE   7   8.147  -1.816   1.620
   53   3HD1  ILE   7          3HD13     ILE   7   7.670  -2.791   3.036
   54    H    ASP   8           HN       ASP   8   8.049   1.405   4.333
   55    HA   ASP   8           HA       ASP   8   6.622   3.775   3.541
   56   1HB   ASP   8          1HB       ASP   8   7.718   5.379   4.959
   57   2HB   ASP   8          2HB       ASP   8   6.960   4.201   6.034
   58    H    SER   9           HN       SER   9   9.721   2.311   4.417
   59    HA   SER   9           HA       SER   9  11.006   3.422   2.000
   60   1HB   SER   9          2HB       SER   9  12.128   2.482   4.674
   61   2HB   SER   9          1HB       SER   9  13.117   3.012   3.302
   62    HG   SER   9           HG       SER   9  11.233   4.578   4.749
   63    H    LYS  10           HN       LYS  10  12.548   2.295   0.897
   64    HA   LYS  10           HA       LYS  10  11.944   0.010  -0.366
   65   1HB   LYS  10          2HB       LYS  10  13.826   1.764  -0.693
   66   2HB   LYS  10          1HB       LYS  10  14.799   0.716   0.329
   67   1HG   LYS  10          1HG       LYS  10  14.262  -1.200  -1.284
   68   2HG   LYS  10          2HG       LYS  10  13.584   0.010  -2.378
   69   1HD   LYS  10          2HD       LYS  10  16.436  -0.028  -1.268
   70   2HD   LYS  10          1HD       LYS  10  15.960  -0.616  -2.869
   71   1HE   LYS  10          1HE       LYS  10  15.190   1.673  -3.479
   72   2HE   LYS  10          2HE       LYS  10  15.726   2.275  -1.896
   73   1HZ   LYS  10          1HZ       LYS  10  17.445   1.052  -3.933
   74   2HZ   LYS  10          2HZ       LYS  10  17.347   2.658  -3.578
   75   3HZ   LYS  10          3HZ       LYS  10  17.939   1.604  -2.460
   76    H    ALA  11           HN       ALA  11  13.843   0.246   2.580
   77    HA   ALA  11           HA       ALA  11  14.981  -2.232   2.839
   78   1HB   ALA  11          1HB       ALA  11  15.244  -0.361   4.473
   79   2HB   ALA  11          3HB       ALA  11  13.595  -0.658   5.075
   80   3HB   ALA  11          2HB       ALA  11  14.863  -1.882   5.302
   81    H    ALA  12           HN       ALA  12  11.484  -1.699   3.168
   82    HA   ALA  12           HA       ALA  12  11.226  -4.636   3.828
   83   1HB   ALA  12          3HB       ALA  12   9.411  -2.304   4.505
   84   2HB   ALA  12          2HB       ALA  12   9.026  -4.019   4.786
   85   3HB   ALA  12          1HB       ALA  12  10.393  -3.259   5.621
   86    H    TRP  13           HN       TRP  13  11.212  -2.717   1.187
   87    HA   TRP  13           HA       TRP  13   8.751  -3.191  -0.184
   88   1HB   TRP  13          1HB       TRP  13  10.449  -1.556  -0.901
   89   2HB   TRP  13          2HB       TRP  13  11.630  -2.839  -1.114
   90    HD1  TRP  13           HD1      TRP  13  11.948  -3.876  -3.345
   91    HE1  TRP  13           HE1      TRP  13  10.874  -3.636  -5.665
   92    HE3  TRP  13           HE3      TRP  13   7.905  -1.003  -2.084
   93    HZ2  TRP  13           HZ2      TRP  13   8.631  -2.356  -6.820
   94    HZ3  TRP  13           HZ3      TRP  13   6.376  -0.208  -3.854
   95    HH2  TRP  13           HH2      TRP  13   6.675  -0.919  -6.212
   96    H    ASP  14           HN       ASP  14  11.879  -4.867  -0.193
   97    HA   ASP  14           HA       ASP  14  11.160  -7.042  -1.911
   98   1HB   ASP  14          2HB       ASP  14  13.227  -8.035  -1.136
   99   2HB   ASP  14          1HB       ASP  14  13.448  -6.296  -1.411
  100    H    ALA  15           HN       ALA  15  11.401  -6.695   1.567
  101    HA   ALA  15           HA       ALA  15  10.600  -9.228   2.400
  102   1HB   ALA  15          1HB       ALA  15  11.416  -7.442   3.925
  103   2HB   ALA  15          2HB       ALA  15   9.838  -6.631   3.808
  104   3HB   ALA  15          3HB       ALA  15   9.954  -8.243   4.529
  105    H    GLN  16           HN       GLN  16   8.361  -6.456   2.012
  106    HA   GLN  16           HA       GLN  16   5.981  -7.941   2.519
  107   1HB   GLN  16          1HB       GLN  16   6.340  -5.344   2.383
  108   2HB   GLN  16          2HB       GLN  16   6.095  -5.556   0.654
  109   1HG   GLN  16          2HG       GLN  16   3.882  -5.278   1.151
  110   2HG   GLN  16          1HG       GLN  16   3.934  -6.965   1.630
  111   1HE2  GLN  16          1HE21     GLN  16   2.399  -4.803   4.377
  112   2HE2  GLN  16          2HE22     GLN  16   2.106  -4.767   2.672
  113    H    LEU  17           HN       LEU  17   7.607  -7.115  -0.619
  114    HA   LEU  17           HA       LEU  17   5.778  -8.392  -2.327
  115   1HB   LEU  17          2HB       LEU  17   8.796  -7.952  -2.427
  116   2HB   LEU  17          1HB       LEU  17   7.949  -8.773  -3.732
  117    HG   LEU  17           HG       LEU  17   7.147  -5.993  -2.802
  118   1HD1  LEU  17          1HD21     LEU  17   9.077  -6.802  -5.025
  119   2HD1  LEU  17          2HD22     LEU  17   8.440  -5.168  -4.753
  120   3HD1  LEU  17          3HD23     LEU  17   9.497  -5.918  -3.541
  121   1HD2  LEU  17          3HD13     LEU  17   6.702  -7.502  -5.426
  122   2HD2  LEU  17          1HD11     LEU  17   5.477  -7.232  -4.175
  123   3HD2  LEU  17          2HD12     LEU  17   6.145  -5.856  -5.056
  124    H    ALA  18           HN       ALA  18   8.737  -9.783  -0.876
  125    HA   ALA  18           HA       ALA  18   8.459 -12.385  -1.858
  126   1HB   ALA  18          1HB       ALA  18  10.499 -11.502  -0.825
  127   2HB   ALA  18          3HB       ALA  18   9.699 -11.418   0.758
  128   3HB   ALA  18          2HB       ALA  18   9.987 -12.995  -0.010
  129    H    LYS  19           HN       LYS  19   7.454 -11.239   1.476
  130    HA   LYS  19           HA       LYS  19   6.284 -13.786   2.078
  131   1HB   LYS  19          2HB       LYS  19   5.175 -12.743   3.922
  132   2HB   LYS  19          1HB       LYS  19   6.865 -12.246   3.864
  133   1HG   LYS  19          2HG       LYS  19   6.264 -10.045   3.226
  134   2HG   LYS  19          1HG       LYS  19   4.600 -10.486   2.811
  135   1HD   LYS  19          1HD       LYS  19   4.082 -10.980   5.131
  136   2HD   LYS  19          2HD       LYS  19   5.763 -10.742   5.630
  137   1HE   LYS  19          2HE       LYS  19   4.080  -8.542   4.350
  138   2HE   LYS  19          1HE       LYS  19   4.152  -8.804   6.099
  139   1HZ   LYS  19          3HZ       LYS  19   6.526  -8.308   4.454
  140   2HZ   LYS  19          2HZ       LYS  19   5.695  -7.148   5.271
  141   3HZ   LYS  19          1HZ       LYS  19   6.441  -8.371   6.098
  142    H    GLY  20           HN       GLY  20   5.027 -11.036   0.239
  143   1HA   GLY  20          1HA       GLY  20   2.286 -11.708   0.337
  144   2HA   GLY  20          2HA       GLY  20   3.128 -10.803  -0.946
  145    H    LYS  21           HN       LYS  21   4.919 -13.302  -1.456
  146    HA   LYS  21           HA       LYS  21   4.905 -14.905  -3.102
  147   1HB   LYS  21          1HB       LYS  21   2.165 -15.689  -2.011
  148   2HB   LYS  21          2HB       LYS  21   3.294 -16.697  -2.916
  149   1HG   LYS  21          2HG       LYS  21   3.706 -15.581  -0.109
  150   2HG   LYS  21          1HG       LYS  21   3.305 -17.246  -0.532
  151   1HD   LYS  21          1HD       LYS  21   5.467 -17.482  -1.739
  152   2HD   LYS  21          2HD       LYS  21   5.885 -15.808  -1.317
  153   1HE   LYS  21          2HE       LYS  21   5.717 -16.361   1.097
  154   2HE   LYS  21          1HE       LYS  21   5.405 -18.059   0.675
  155   1HZ   LYS  21          2HZ       LYS  21   7.814 -16.521  -0.012
  156   2HZ   LYS  21          1HZ       LYS  21   7.701 -17.663   1.172
  157   3HZ   LYS  21          3HZ       LYS  21   7.540 -18.098  -0.410
  158    H    GLU  22           HN       GLU  22   4.604 -12.767  -4.116
  159    HA   GLU  22           HA       GLU  22   2.690 -11.396  -5.297
  160   1HB   GLU  22          2HB       GLU  22   5.171 -12.340  -6.782
  161   2HB   GLU  22          1HB       GLU  22   4.292 -10.818  -6.999
  162   1HG   GLU  22          2HG       GLU  22   5.953  -9.985  -5.742
  163   2HG   GLU  22          1HG       GLU  22   4.978 -10.546  -4.382
  164    H    GLU  23           HN       GLU  23   3.445 -14.600  -6.450
  165    HA   GLU  23           HA       GLU  23   3.221 -15.013  -8.999
  166   1HB   GLU  23          2HB       GLU  23   1.711 -16.324  -6.728
  167   2HB   GLU  23          1HB       GLU  23   1.399 -16.844  -8.389
  168   1HG   GLU  23          1HG       GLU  23   3.099 -18.256  -7.352
  169   2HG   GLU  23          2HG       GLU  23   3.707 -17.405  -8.776
  170    H    HIS  24           HN       HIS  24   0.039 -14.715  -7.387
  171    HA   HIS  24           HA       HIS  24  -0.929 -13.033  -9.606
  172   1HB   HIS  24          1HB       HIS  24  -1.500 -15.335 -10.314
  173   2HB   HIS  24          2HB       HIS  24  -2.281 -15.635  -8.753
  174    HD2  HIS  24           HD2      HIS  24  -2.830 -12.343 -10.814
  175    HE1  HIS  24           HE1      HIS  24  -6.524 -14.371 -10.451
  176    HE2  HIS  24           HE2      HIS  24  -5.417 -12.206 -11.262
  177    H    LYS  25           HN       LYS  25  -0.194 -12.007  -7.275
  178    HA   LYS  25           HA       LYS  25  -2.700 -11.828  -5.630
  179   1HB   LYS  25          2HB       LYS  25   0.062 -11.083  -4.738
  180   2HB   LYS  25          1HB       LYS  25  -1.380 -11.352  -3.759
  181   1HG   LYS  25          2HG       LYS  25   0.190 -13.479  -5.284
  182   2HG   LYS  25          1HG       LYS  25   0.249 -13.156  -3.552
  183   1HD   LYS  25          2HD       LYS  25  -2.194 -13.693  -3.406
  184   2HD   LYS  25          1HD       LYS  25  -2.135 -14.207  -5.112
  185   1HE   LYS  25          1HE       LYS  25  -0.364 -15.862  -4.544
  186   2HE   LYS  25          2HE       LYS  25  -0.443 -15.362  -2.847
  187   1HZ   LYS  25          3HZ       LYS  25  -2.720 -16.079  -2.803
  188   2HZ   LYS  25          1HZ       LYS  25  -2.650 -16.545  -4.383
  189   3HZ   LYS  25          2HZ       LYS  25  -1.730 -17.316  -3.254
  190    HA   PRO  26           HA       PRO  26  -2.455  -7.495  -7.003
  191   1HB   PRO  26          1HB       PRO  26  -4.470  -6.432  -5.444
  192   2HB   PRO  26          2HB       PRO  26  -4.728  -7.315  -6.965
  193   1HG   PRO  26          1HG       PRO  26  -4.808  -8.433  -4.188
  194   2HG   PRO  26          2HG       PRO  26  -6.073  -8.597  -5.418
  195   1HD   PRO  26          2HD       PRO  26  -4.218 -10.510  -4.917
  196   2HD   PRO  26          1HD       PRO  26  -4.550 -10.179  -6.631
  197    H    ILE  27           HN       ILE  27  -0.357  -7.341  -6.115
  198    HA   ILE  27           HA       ILE  27  -0.103  -6.431  -3.329
  199    HB   ILE  27           HB       ILE  27   1.994  -6.492  -5.522
  200   1HG1  ILE  27          1HG11     ILE  27   0.877  -8.556  -3.633
  201   2HG1  ILE  27          2HG12     ILE  27   1.451  -8.735  -5.282
  202   1HG2  ILE  27          1HG21     ILE  27   2.389  -4.890  -3.663
  203   2HG2  ILE  27          3HG23     ILE  27   2.189  -6.207  -2.493
  204   3HG2  ILE  27          2HG22     ILE  27   3.542  -6.211  -3.644
  205   1HD1  ILE  27          3HD13     ILE  27   3.243  -8.366  -2.839
  206   2HD1  ILE  27          2HD12     ILE  27   2.882  -9.881  -3.653
  207   3HD1  ILE  27          1HD11     ILE  27   3.759  -8.609  -4.536
  208    H    VAL  28           HN       VAL  28  -1.272  -4.577  -3.142
  209    HA   VAL  28           HA       VAL  28  -1.176  -2.559  -5.308
  210    HB   VAL  28           HB       VAL  28  -3.400  -3.160  -4.597
  211   1HG1  VAL  28          1HG21     VAL  28  -2.734  -2.255  -1.808
  212   2HG1  VAL  28          3HG23     VAL  28  -4.345  -2.592  -2.457
  213   3HG1  VAL  28          2HG22     VAL  28  -3.162  -3.891  -2.341
  214   1HG2  VAL  28          3HG13     VAL  28  -2.961  -0.968  -5.470
  215   2HG2  VAL  28          1HG11     VAL  28  -4.238  -0.921  -4.250
  216   3HG2  VAL  28          2HG12     VAL  28  -2.594  -0.347  -3.855
  217    H    VAL  29           HN       VAL  29   0.147  -0.933  -5.145
  218    HA   VAL  29           HA       VAL  29   1.608  -0.481  -2.599
  219    HB   VAL  29           HB       VAL  29   2.294   0.453  -5.404
  220   1HG1  VAL  29          2HG22     VAL  29   3.867   0.198  -2.815
  221   2HG1  VAL  29          3HG23     VAL  29   4.521   0.707  -4.381
  222   3HG1  VAL  29          1HG21     VAL  29   3.345   1.725  -3.545
  223   1HG2  VAL  29          2HG12     VAL  29   3.175  -2.047  -3.912
  224   2HG2  VAL  29          3HG13     VAL  29   2.250  -1.979  -5.421
  225   3HG2  VAL  29          1HG11     VAL  29   3.930  -1.411  -5.391
  226    H    ASP  30           HN       ASP  30   0.918   1.178  -1.381
  227    HA   ASP  30           HA       ASP  30  -0.476   3.512  -2.632
  228   1HB   ASP  30          1HB       ASP  30  -1.467   2.800  -0.612
  229   2HB   ASP  30          2HB       ASP  30   0.070   2.731   0.252
  230    H    PHE  31           HN       PHE  31   1.203   4.405  -3.913
  231    HA   PHE  31           HA       PHE  31   3.704   5.290  -2.555
  232   1HB   PHE  31          1HB       PHE  31   2.637   5.558  -5.380
  233   2HB   PHE  31          2HB       PHE  31   4.058   6.383  -4.814
  234    HD1  PHE  31           HD2      PHE  31   6.116   5.136  -4.156
  235    HD2  PHE  31           HD1      PHE  31   2.737   3.222  -6.035
  236    HE1  PHE  31           HE2      PHE  31   7.622   3.417  -5.113
  237    HE2  PHE  31           HE1      PHE  31   4.272   1.558  -7.057
  238    HZ   PHE  31           HZ       PHE  31   6.706   1.640  -6.593
  239    H    THR  32           HN       THR  32   3.137   6.895  -1.060
  240    HA   THR  32           HA       THR  32   1.578   9.216  -2.102
  241    HB   THR  32           HB       THR  32   0.092   7.858  -0.705
  242    HG1  THR  32           HG1      THR  32  -0.584   9.599   0.473
  243   1HG2  THR  32          1HG21     THR  32   1.767   6.826   0.821
  244   2HG2  THR  32          3HG23     THR  32   2.074   8.415   1.561
  245   3HG2  THR  32          2HG22     THR  32   0.480   7.649   1.711
  246    H    ALA  33           HN       ALA  33   1.859  11.048  -0.445
  247    HA   ALA  33           HA       ALA  33   4.794  11.375   0.136
  248   1HB   ALA  33          2HB       ALA  33   2.881  13.334  -1.186
  249   2HB   ALA  33          3HB       ALA  33   4.481  13.759  -0.539
  250   3HB   ALA  33          1HB       ALA  33   4.341  12.601  -1.875
  251    H    THR  34           HN       THR  34   4.854  11.288   2.313
  252    HA   THR  34           HA       THR  34   2.864  11.530   4.181
  253    HB   THR  34           HB       THR  34   5.001  12.245   5.619
  254    HG1  THR  34           HG1      THR  34   6.750  11.248   3.979
  255   1HG2  THR  34          1HG21     THR  34   4.021   9.984   5.535
  256   2HG2  THR  34          2HG22     THR  34   4.902   9.653   4.023
  257   3HG2  THR  34          3HG23     THR  34   5.795   9.930   5.540
  258    H    TRP  35           HN       TRP  35   5.119  14.114   3.213
  259    HA   TRP  35           HA       TRP  35   4.066  16.146   4.868
  260   1HB   TRP  35          2HB       TRP  35   5.207  17.688   3.310
  261   2HB   TRP  35          1HB       TRP  35   6.213  16.345   3.835
  262    HD1  TRP  35           HD1      TRP  35   7.110  14.676   2.017
  263    HE1  TRP  35           HE1      TRP  35   7.410  14.951  -0.535
  264    HE3  TRP  35           HE3      TRP  35   3.706  18.421   1.135
  265    HZ2  TRP  35           HZ2      TRP  35   6.117  16.323  -2.682
  266    HZ3  TRP  35           HZ3      TRP  35   3.208  19.122  -1.184
  267    HH2  TRP  35           HH2      TRP  35   4.406  18.087  -3.098
  268    H    CYS  36           HN       CYS  36   2.816  14.933   1.762
  269    HA   CYS  36           HA       CYS  36   1.060  17.283   1.366
  270   1HB   CYS  36          1HB       CYS  36   1.815  16.231  -0.652
  271   2HB   CYS  36          2HB       CYS  36   1.357  14.637  -0.059
  272    H    GLY  37           HN       GLY  37   0.182  17.174   3.512
  273   1HA   GLY  37          1HA       GLY  37  -1.101  15.366   4.964
  274   2HA   GLY  37          2HA       GLY  37  -1.877  16.927   4.649
  275    HA   PRO  38           HA       PRO  38  -5.219  15.197   2.339
  276   1HB   PRO  38          1HB       PRO  38  -4.030  16.141  -0.286
  277   2HB   PRO  38          2HB       PRO  38  -5.722  16.275   0.276
  278   1HG   PRO  38          2HG       PRO  38  -4.093  18.426   0.460
  279   2HG   PRO  38          1HG       PRO  38  -5.108  17.985   1.867
  280   1HD   PRO  38          1HD       PRO  38  -2.183  17.366   1.411
  281   2HD   PRO  38          2HD       PRO  38  -2.981  17.989   2.883
  282    H    CYS  39           HN       CYS  39  -2.074  14.533   0.833
  283    HA   CYS  39           HA       CYS  39  -2.971  12.177  -0.641
  284   1HB   CYS  39          2HB       CYS  39  -0.114  12.902   0.099
  285   2HB   CYS  39          1HB       CYS  39  -0.673  11.824  -1.160
  286    H    LYS  40           HN       LYS  40  -1.383  12.975   2.445
  287    HA   LYS  40           HA       LYS  40  -0.778  10.282   3.204
  288   1HB   LYS  40          1HB       LYS  40   0.334  12.270   4.140
  289   2HB   LYS  40          2HB       LYS  40  -1.179  12.760   4.925
  290   1HG   LYS  40          2HG       LYS  40  -1.163  10.766   6.338
  291   2HG   LYS  40          1HG       LYS  40   0.194  10.090   5.435
  292   1HD   LYS  40          2HD       LYS  40   0.888  11.035   7.620
  293   2HD   LYS  40          1HD       LYS  40   1.710  11.786   6.251
  294   1HE   LYS  40          2HE       LYS  40   1.055  13.434   7.956
  295   2HE   LYS  40          1HE       LYS  40   0.311  13.772   6.395
  296   1HZ   LYS  40          2HZ       LYS  40  -1.005  12.421   8.653
  297   2HZ   LYS  40          3HZ       LYS  40  -1.242  13.986   8.195
  298   3HZ   LYS  40          1HZ       LYS  40  -1.702  12.760   7.197
  299    H    MET  41           HN       MET  41  -3.598  12.369   3.769
  300    HA   MET  41           HA       MET  41  -5.009  10.799   5.673
  301   1HB   MET  41          2HB       MET  41  -5.968  12.572   3.380
  302   2HB   MET  41          1HB       MET  41  -7.080  11.847   4.537
  303   1HG   MET  41          2HG       MET  41  -4.790  13.699   5.294
  304   2HG   MET  41          1HG       MET  41  -6.466  14.168   5.055
  305   1HE   MET  41          1HE       MET  41  -8.429  13.271   6.541
  306   2HE   MET  41          3HE       MET  41  -7.949  11.556   6.659
  307   3HE   MET  41          2HE       MET  41  -8.221  12.505   8.134
  308    H    ILE  42           HN       ILE  42  -4.722  10.312   2.218
  309    HA   ILE  42           HA       ILE  42  -6.782   8.304   2.032
  310    HB   ILE  42           HB       ILE  42  -4.263   8.698   0.364
  311   1HG1  ILE  42          1HG11     ILE  42  -5.409  10.763   0.269
  312   2HG1  ILE  42          2HG12     ILE  42  -5.851   9.916  -1.201
  313   1HG2  ILE  42          3HG23     ILE  42  -6.876   7.205  -0.141
  314   2HG2  ILE  42          2HG22     ILE  42  -5.696   7.597  -1.413
  315   3HG2  ILE  42          1HG21     ILE  42  -5.237   6.530  -0.077
  316   1HD1  ILE  42          2HD12     ILE  42  -8.030   9.288  -0.209
  317   2HD1  ILE  42          1HD11     ILE  42  -7.611  10.210   1.261
  318   3HD1  ILE  42          3HD13     ILE  42  -7.768  11.045  -0.278
  319    H    ALA  43           HN       ALA  43  -3.443   8.137   3.169
  320    HA   ALA  43           HA       ALA  43  -2.996   5.394   2.842
  321   1HB   ALA  43          2HB       ALA  43  -1.229   6.943   3.507
  322   2HB   ALA  43          1HB       ALA  43  -1.969   7.182   5.102
  323   3HB   ALA  43          3HB       ALA  43  -1.349   5.594   4.655
  324    HA   PRO  44           HA       PRO  44  -4.897   4.363   7.133
  325   1HB   PRO  44          1HB       PRO  44  -6.836   6.054   8.195
  326   2HB   PRO  44          2HB       PRO  44  -5.116   6.016   8.672
  327   1HG   PRO  44          1HG       PRO  44  -6.447   7.839   6.674
  328   2HG   PRO  44          2HG       PRO  44  -5.307   8.293   7.974
  329   1HD   PRO  44          2HD       PRO  44  -4.388   8.001   5.476
  330   2HD   PRO  44          1HD       PRO  44  -3.464   7.303   6.822
  331    H    LEU  45           HN       LEU  45  -6.850   6.173   4.755
  332    HA   LEU  45           HA       LEU  45  -9.193   4.480   4.975
  333   1HB   LEU  45          2HB       LEU  45  -8.104   5.929   2.512
  334   2HB   LEU  45          1HB       LEU  45  -9.667   5.163   2.641
  335    HG   LEU  45           HG       LEU  45  -8.675   7.596   4.202
  336   1HD1  LEU  45          2HD12     LEU  45  -9.282   7.973   1.826
  337   2HD1  LEU  45          1HD11     LEU  45 -10.880   7.261   2.136
  338   3HD1  LEU  45          3HD13     LEU  45 -10.408   8.779   2.934
  339   1HD2  LEU  45          3HD23     LEU  45 -11.337   6.116   4.406
  340   2HD2  LEU  45          2HD22     LEU  45 -10.153   6.369   5.712
  341   3HD2  LEU  45          1HD21     LEU  45 -11.037   7.745   5.049
  342    H    PHE  46           HN       PHE  46  -6.359   4.393   2.804
  343    HA   PHE  46           HA       PHE  46  -6.900   1.941   1.511
  344   1HB   PHE  46          1HB       PHE  46  -5.239   3.544   0.804
  345   2HB   PHE  46          2HB       PHE  46  -4.276   3.288   2.245
  346    HD1  PHE  46           HD1      PHE  46  -5.563   1.342  -0.765
  347    HD2  PHE  46           HD2      PHE  46  -2.568   1.635   2.324
  348    HE1  PHE  46           HE1      PHE  46  -3.969   0.167  -2.187
  349    HE2  PHE  46           HE2      PHE  46  -1.002   0.341   0.914
  350    HZ   PHE  46           HZ       PHE  46  -1.619  -0.267  -1.380
  351    H    GLU  47           HN       GLU  47  -5.176   2.568   4.596
  352    HA   GLU  47           HA       GLU  47  -4.455  -0.081   5.244
  353   1HB   GLU  47          2HB       GLU  47  -3.724   2.081   6.307
  354   2HB   GLU  47          1HB       GLU  47  -5.246   2.115   7.197
  355   1HG   GLU  47          1HG       GLU  47  -3.261  -0.197   7.337
  356   2HG   GLU  47          2HG       GLU  47  -3.185   1.211   8.398
  357    H    THR  48           HN       THR  48  -7.480   1.744   5.937
  358    HA   THR  48           HA       THR  48  -8.760  -0.301   7.454
  359    HB   THR  48           HB       THR  48 -10.100   1.742   5.615
  360    HG1  THR  48           HG1      THR  48  -8.619   2.705   7.120
  361   1HG2  THR  48          3HG23     THR  48 -11.044   0.334   8.148
  362   2HG2  THR  48          1HG21     THR  48 -11.928   1.592   7.263
  363   3HG2  THR  48          2HG22     THR  48 -11.640   0.017   6.502
  364    H    LEU  49           HN       LEU  49  -8.841   0.436   3.914
  365    HA   LEU  49           HA       LEU  49 -10.429  -1.854   3.243
  366   1HB   LEU  49          1HB       LEU  49  -8.558  -0.045   1.697
  367   2HB   LEU  49          2HB       LEU  49  -9.148  -1.520   0.949
  368    HG   LEU  49           HG       LEU  49 -10.424   0.495   0.430
  369   1HD1  LEU  49          2HD12     LEU  49 -11.404  -1.729   0.105
  370   2HD1  LEU  49          3HD13     LEU  49 -12.023  -1.752   1.763
  371   3HD1  LEU  49          1HD11     LEU  49 -12.664  -0.591   0.606
  372   1HD2  LEU  49          3HD23     LEU  49 -10.502   1.643   2.587
  373   2HD2  LEU  49          1HD21     LEU  49 -12.132   1.368   1.975
  374   3HD2  LEU  49          2HD22     LEU  49 -11.512   0.346   3.275
  375    H    SER  50           HN       SER  50  -6.966  -1.432   3.682
  376    HA   SER  50           HA       SER  50  -6.122  -3.971   2.746
  377   1HB   SER  50          2HB       SER  50  -4.950  -2.732   5.230
  378   2HB   SER  50          1HB       SER  50  -4.172  -3.750   4.008
  379    HG   SER  50           HG       SER  50  -5.152  -1.341   3.086
  380    H    ASN  51           HN       ASN  51  -7.411  -3.066   5.935
  381    HA   ASN  51           HA       ASN  51  -7.220  -5.748   7.031
  382   1HB   ASN  51          2HB       ASN  51  -8.961  -3.359   7.799
  383   2HB   ASN  51          1HB       ASN  51  -9.000  -4.917   8.621
  384   1HD2  ASN  51          2HD22     ASN  51  -5.690  -2.497   9.118
  385   2HD2  ASN  51          1HD21     ASN  51  -6.689  -2.267   7.702
  386    H    ASP  52           HN       ASP  52  -9.863  -3.885   5.454
  387    HA   ASP  52           HA       ASP  52 -11.891  -5.801   5.483
  388   1HB   ASP  52          1HB       ASP  52 -12.103  -3.463   4.565
  389   2HB   ASP  52          2HB       ASP  52 -11.196  -3.985   3.129
  390    H    TYR  53           HN       TYR  53  -9.160  -5.522   3.196
  391    HA   TYR  53           HA       TYR  53  -9.996  -8.041   1.802
  392   1HB   TYR  53          2HB       TYR  53  -8.241  -5.700   1.072
  393   2HB   TYR  53          1HB       TYR  53  -8.265  -7.178   0.120
  394    HD1  TYR  53           HD2      TYR  53 -10.485  -8.024  -0.826
  395    HD2  TYR  53           HD1      TYR  53  -9.665  -3.951   0.312
  396    HE1  TYR  53           HE2      TYR  53 -11.843  -7.214  -2.723
  397    HE2  TYR  53           HE1      TYR  53 -10.867  -3.154  -1.686
  398    HH   TYR  53           HH       TYR  53 -11.823  -3.845  -3.790
  399    H    ALA  54           HN       ALA  54  -8.833  -8.283   4.449
  400    HA   ALA  54           HA       ALA  54  -6.008  -8.822   4.137
  401   1HB   ALA  54          3HB       ALA  54  -8.024  -9.692   6.252
  402   2HB   ALA  54          1HB       ALA  54  -6.263  -9.863   6.389
  403   3HB   ALA  54          2HB       ALA  54  -6.983  -8.250   6.294
  404    H    GLY  55           HN       GLY  55  -7.192 -10.112   1.991
  405   1HA   GLY  55          1HA       GLY  55  -7.344 -13.047   2.603
  406   2HA   GLY  55          2HA       GLY  55  -8.087 -12.223   1.228
  407    H    LYS  56           HN       LYS  56  -6.990 -13.099  -0.519
  408    HA   LYS  56           HA       LYS  56  -4.085 -13.524  -0.486
  409   1HB   LYS  56          1HB       LYS  56  -4.474 -14.305  -2.782
  410   2HB   LYS  56          2HB       LYS  56  -5.503 -15.134  -1.628
  411   1HG   LYS  56          2HG       LYS  56  -7.460 -14.166  -2.387
  412   2HG   LYS  56          1HG       LYS  56  -6.682 -12.707  -3.000
  413   1HD   LYS  56          1HD       LYS  56  -6.400 -15.446  -4.307
  414   2HD   LYS  56          2HD       LYS  56  -7.590 -14.215  -4.763
  415   1HE   LYS  56          1HE       LYS  56  -5.694 -12.596  -5.190
  416   2HE   LYS  56          2HE       LYS  56  -4.559 -13.932  -4.963
  417   1HZ   LYS  56          1HZ       LYS  56  -5.713 -15.070  -6.762
  418   2HZ   LYS  56          3HZ       LYS  56  -6.648 -13.727  -7.000
  419   3HZ   LYS  56          2HZ       LYS  56  -5.009 -13.655  -7.220
  420    H    VAL  57           HN       VAL  57  -4.455 -10.872   0.111
  421    HA   VAL  57           HA       VAL  57  -3.764  -9.384  -2.375
  422    HB   VAL  57           HB       VAL  57  -5.628  -8.462  -0.155
  423   1HG1  VAL  57          3HG13     VAL  57  -4.388  -6.595  -1.117
  424   2HG1  VAL  57          1HG11     VAL  57  -4.905  -7.004  -2.737
  425   3HG1  VAL  57          2HG12     VAL  57  -6.100  -6.522  -1.548
  426   1HG2  VAL  57          1HG21     VAL  57  -6.362  -9.418  -2.942
  427   2HG2  VAL  57          3HG23     VAL  57  -6.905 -10.055  -1.384
  428   3HG2  VAL  57          2HG22     VAL  57  -7.435  -8.457  -1.909
  429    H    ILE  58           HN       ILE  58  -2.259  -7.635  -1.943
  430    HA   ILE  58           HA       ILE  58  -1.262  -7.515   0.878
  431    HB   ILE  58           HB       ILE  58   0.450  -7.790  -1.624
  432   1HG1  ILE  58          2HG12     ILE  58   1.380  -9.621   0.157
  433   2HG1  ILE  58          1HG11     ILE  58  -0.312  -9.630   0.621
  434   1HG2  ILE  58          2HG22     ILE  58   1.257  -7.174   1.244
  435   2HG2  ILE  58          3HG23     ILE  58   2.366  -7.582  -0.084
  436   3HG2  ILE  58          1HG21     ILE  58   1.427  -6.096  -0.151
  437   1HD1  ILE  58          1HD11     ILE  58  -0.879 -10.053  -1.840
  438   2HD1  ILE  58          2HD12     ILE  58   0.862 -10.282  -2.099
  439   3HD1  ILE  58          3HD13     ILE  58  -0.020 -11.350  -0.997
  440    H    PHE  59           HN       PHE  59  -1.049  -5.498   1.603
  441    HA   PHE  59           HA       PHE  59  -1.279  -3.253  -0.355
  442   1HB   PHE  59          1HB       PHE  59  -2.286  -3.441   2.489
  443   2HB   PHE  59          2HB       PHE  59  -2.233  -1.977   1.545
  444    HD1  PHE  59           HD1      PHE  59  -3.664  -5.481   1.353
  445    HD2  PHE  59           HD2      PHE  59  -4.239  -1.280   0.636
  446    HE1  PHE  59           HE1      PHE  59  -5.977  -5.908   0.654
  447    HE2  PHE  59           HE2      PHE  59  -6.516  -1.721  -0.208
  448    HZ   PHE  59           HZ       PHE  59  -7.403  -4.038  -0.206
  449    H    LEU  60           HN       LEU  60   0.418  -1.799  -0.287
  450    HA   LEU  60           HA       LEU  60   2.191  -1.886   2.123
  451   1HB   LEU  60          2HB       LEU  60   3.879  -2.916   1.106
  452   2HB   LEU  60          1HB       LEU  60   2.590  -3.468   0.006
  453    HG   LEU  60           HG       LEU  60   3.176  -1.605  -1.547
  454   1HD1  LEU  60          3HD23     LEU  60   4.728  -0.281   0.047
  455   2HD1  LEU  60          2HD22     LEU  60   5.830  -1.664  -0.033
  456   3HD1  LEU  60          1HD21     LEU  60   5.466  -0.762  -1.490
  457   1HD2  LEU  60          2HD12     LEU  60   5.128  -3.816  -0.868
  458   2HD2  LEU  60          1HD11     LEU  60   3.668  -3.953  -1.873
  459   3HD2  LEU  60          3HD13     LEU  60   5.040  -2.970  -2.437
  460    H    LYS  61           HN       LYS  61   2.657   0.119   2.780
  461    HA   LYS  61           HA       LYS  61   2.124   2.360   0.890
  462   1HB   LYS  61          2HB       LYS  61   1.261   2.443   3.153
  463   2HB   LYS  61          1HB       LYS  61   2.910   2.376   3.816
  464   1HG   LYS  61          1HG       LYS  61   3.432   4.562   2.838
  465   2HG   LYS  61          2HG       LYS  61   1.937   4.531   1.884
  466   1HD   LYS  61          1HD       LYS  61   1.644   6.024   3.746
  467   2HD   LYS  61          2HD       LYS  61   0.594   4.611   3.931
  468   1HE   LYS  61          1HE       LYS  61   2.189   3.631   5.579
  469   2HE   LYS  61          2HE       LYS  61   3.312   4.973   5.307
  470   1HZ   LYS  61          3HZ       LYS  61   1.646   6.447   6.180
  471   2HZ   LYS  61          2HZ       LYS  61   0.605   5.192   6.421
  472   3HZ   LYS  61          1HZ       LYS  61   2.013   5.268   7.272
  473    H    VAL  62           HN       VAL  62   3.603   3.833   0.097
  474    HA   VAL  62           HA       VAL  62   6.470   3.461   0.829
  475    HB   VAL  62           HB       VAL  62   5.413   3.894  -1.991
  476   1HG1  VAL  62          3HG13     VAL  62   8.233   3.522  -0.880
  477   2HG1  VAL  62          2HG12     VAL  62   7.822   3.544  -2.603
  478   3HG1  VAL  62          1HG11     VAL  62   7.589   5.000  -1.631
  479   1HG2  VAL  62          1HG21     VAL  62   6.671   1.437  -0.714
  480   2HG2  VAL  62          2HG22     VAL  62   5.009   1.603  -1.334
  481   3HG2  VAL  62          3HG23     VAL  62   6.376   1.661  -2.454
  482    H    ASP  63           HN       ASP  63   7.446   5.327   1.316
  483    HA   ASP  63           HA       ASP  63   5.938   7.871   1.134
  484   1HB   ASP  63          1HB       ASP  63   7.139   7.295   3.207
  485   2HB   ASP  63          2HB       ASP  63   8.667   7.220   2.321
  486    H    VAL  64           HN       VAL  64   5.917   8.453  -1.003
  487    HA   VAL  64           HA       VAL  64   7.860   8.017  -2.983
  488    HB   VAL  64           HB       VAL  64   5.750  10.180  -2.575
  489   1HG1  VAL  64          2HG22     VAL  64   7.452   9.723  -5.058
  490   2HG1  VAL  64          1HG21     VAL  64   5.962  10.688  -5.002
  491   3HG1  VAL  64          3HG23     VAL  64   7.370  11.206  -4.084
  492   1HG2  VAL  64          3HG13     VAL  64   5.041   7.784  -2.909
  493   2HG2  VAL  64          1HG11     VAL  64   4.510   8.851  -4.221
  494   3HG2  VAL  64          2HG12     VAL  64   5.914   7.785  -4.452
  495    H    ASP  65           HN       ASP  65   7.596  10.697  -0.647
  496    HA   ASP  65           HA       ASP  65   9.476  12.447  -1.841
  497   1HB   ASP  65          1HB       ASP  65   7.829  12.905   0.066
  498   2HB   ASP  65          2HB       ASP  65   9.015  12.183   1.160
  499    H    ALA  66           HN       ALA  66   9.852   9.954   0.689
  500    HA   ALA  66           HA       ALA  66  12.730  10.269   0.901
  501   1HB   ALA  66          2HB       ALA  66  11.343   9.446   2.765
  502   2HB   ALA  66          1HB       ALA  66  10.890   8.013   1.820
  503   3HB   ALA  66          3HB       ALA  66  12.578   8.254   2.313
  504    H    VAL  67           HN       VAL  67  10.662   7.633  -0.473
  505    HA   VAL  67           HA       VAL  67  13.048   6.385  -1.654
  506    HB   VAL  67           HB       VAL  67  10.201   5.427  -2.044
  507   1HG1  VAL  67          2HG22     VAL  67  12.262   4.412  -3.181
  508   2HG1  VAL  67          3HG23     VAL  67  12.843   3.951  -1.581
  509   3HG1  VAL  67          1HG21     VAL  67  11.317   3.273  -2.189
  510   1HG2  VAL  67          3HG13     VAL  67  11.925   4.966   0.424
  511   2HG2  VAL  67          2HG12     VAL  67  10.319   5.726   0.394
  512   3HG2  VAL  67          1HG11     VAL  67  10.482   4.028  -0.041
  513    H    ALA  68           HN       ALA  68  12.999   8.745  -2.747
  514    HA   ALA  68           HA       ALA  68  11.422   9.319  -4.976
  515   1HB   ALA  68          1HB       ALA  68  13.047  10.877  -3.985
  516   2HB   ALA  68          2HB       ALA  68  14.397   9.875  -4.565
  517   3HB   ALA  68          3HB       ALA  68  13.334  10.697  -5.728
  518    H    ALA  69           HN       ALA  69  14.423   7.376  -4.861
  519    HA   ALA  69           HA       ALA  69  14.782   6.870  -7.582
  520   1HB   ALA  69          1HB       ALA  69  15.361   5.038  -5.209
  521   2HB   ALA  69          3HB       ALA  69  16.052   4.883  -6.839
  522   3HB   ALA  69          2HB       ALA  69  16.426   6.309  -5.852
  523    H    VAL  70           HN       VAL  70  12.986   4.768  -5.247
  524    HA   VAL  70           HA       VAL  70  12.195   2.888  -7.285
  525    HB   VAL  70           HB       VAL  70  10.868   3.420  -4.596
  526   1HG1  VAL  70          1HG21     VAL  70  10.826   0.952  -6.385
  527   2HG1  VAL  70          3HG23     VAL  70  10.123   1.072  -4.761
  528   3HG1  VAL  70          2HG22     VAL  70   9.456   2.041  -6.081
  529   1HG2  VAL  70          2HG12     VAL  70  13.327   2.856  -4.388
  530   2HG2  VAL  70          3HG13     VAL  70  12.282   1.562  -3.780
  531   3HG2  VAL  70          1HG11     VAL  70  13.045   1.417  -5.381
  532    H    ALA  71           HN       ALA  71  10.628   5.733  -5.763
  533    HA   ALA  71           HA       ALA  71   8.127   5.529  -7.058
  534   1HB   ALA  71          3HB       ALA  71   8.613   7.110  -5.239
  535   2HB   ALA  71          1HB       ALA  71   9.667   8.058  -6.307
  536   3HB   ALA  71          2HB       ALA  71   7.932   7.953  -6.642
  537    H    GLU  72           HN       GLU  72  11.002   7.435  -8.240
  538    HA   GLU  72           HA       GLU  72   9.661   8.129 -10.684
  539   1HB   GLU  72          2HB       GLU  72  11.738   9.039 -11.415
  540   2HB   GLU  72          1HB       GLU  72  11.513   9.426  -9.706
  541   1HG   GLU  72          2HG       GLU  72  13.063   7.469  -9.184
  542   2HG   GLU  72          1HG       GLU  72  13.416   7.370 -10.913
  543    H    ALA  73           HN       ALA  73  11.939   5.442  -9.862
  544    HA   ALA  73           HA       ALA  73  12.188   4.455 -12.521
  545   1HB   ALA  73          2HB       ALA  73  13.654   3.772 -10.658
  546   2HB   ALA  73          1HB       ALA  73  12.288   2.956  -9.863
  547   3HB   ALA  73          3HB       ALA  73  12.896   2.362 -11.422
  548    H    ALA  74           HN       ALA  74   9.847   3.675  -9.935
  549    HA   ALA  74           HA       ALA  74   8.435   1.619 -11.314
  550   1HB   ALA  74          2HB       ALA  74   7.582   3.473  -9.054
  551   2HB   ALA  74          3HB       ALA  74   6.726   2.009  -9.561
  552   3HB   ALA  74          1HB       ALA  74   8.354   1.882  -8.889
  553    H    GLY  75           HN       GLY  75   7.827   5.107 -10.918
  554   1HA   GLY  75          1HA       GLY  75   7.052   6.367 -12.889
  555   2HA   GLY  75          2HA       GLY  75   5.955   5.034 -13.279
  556    H    ILE  76           HN       ILE  76   6.734   7.325 -10.665
  557    HA   ILE  76           HA       ILE  76   3.876   7.450  -9.810
  558    HB   ILE  76           HB       ILE  76   6.539   8.090  -8.535
  559   1HG1  ILE  76          1HG11     ILE  76   5.748   6.744  -6.741
  560   2HG1  ILE  76          2HG12     ILE  76   4.074   6.824  -7.285
  561   1HG2  ILE  76          1HG21     ILE  76   3.843   9.212  -7.644
  562   2HG2  ILE  76          2HG22     ILE  76   5.302   9.153  -6.643
  563   3HG2  ILE  76          3HG23     ILE  76   5.293  10.143  -8.101
  564   1HD1  ILE  76          3HD13     ILE  76   6.221   5.354  -8.842
  565   2HD1  ILE  76          1HD11     ILE  76   5.186   4.611  -7.643
  566   3HD1  ILE  76          2HD12     ILE  76   4.460   5.308  -9.081
  567    H    THR  77           HN       THR  77   2.785   9.411  -9.804
  568    HA   THR  77           HA       THR  77   4.088  11.742 -11.128
  569    HB   THR  77           HB       THR  77   2.025  12.019 -12.535
  570    HG1  THR  77           HG1      THR  77   1.597   9.276 -11.918
  571   1HG2  THR  77          2HG22     THR  77   4.123  11.079 -13.500
  572   2HG2  THR  77          3HG23     THR  77   3.565   9.439 -13.113
  573   3HG2  THR  77          1HG21     THR  77   2.665  10.431 -14.274
  574    H    ALA  78           HN       ALA  78   0.674  11.210 -10.518
  575    HA   ALA  78           HA       ALA  78   0.663  13.467  -8.576
  576   1HB   ALA  78          1HB       ALA  78  -1.598  11.924  -9.907
  577   2HB   ALA  78          3HB       ALA  78  -1.784  13.316  -8.821
  578   3HB   ALA  78          2HB       ALA  78  -0.973  13.515 -10.388
  579    H    MET  79           HN       MET  79   1.119  12.873  -6.496
  580    HA   MET  79           HA       MET  79   0.586  10.196  -5.528
  581   1HB   MET  79          2HB       MET  79   1.414  12.691  -3.993
  582   2HB   MET  79          1HB       MET  79   1.365  11.036  -3.372
  583   1HG   MET  79          2HG       MET  79   3.606  11.307  -3.889
  584   2HG   MET  79          1HG       MET  79   2.967  10.402  -5.259
  585   1HE   MET  79          2HE       MET  79   3.210  14.216  -4.172
  586   2HE   MET  79          1HE       MET  79   4.863  13.559  -4.042
  587   3HE   MET  79          3HE       MET  79   4.479  14.759  -5.293
  588    HA   PRO  80           HA       PRO  80  -0.260   9.101  -3.652
  589   1HB   PRO  80          2HB       PRO  80  -3.018   7.978  -3.689
  590   2HB   PRO  80          1HB       PRO  80  -1.759   7.779  -2.441
  591   1HG   PRO  80          1HG       PRO  80  -3.893   9.397  -2.040
  592   2HG   PRO  80          2HG       PRO  80  -2.266   9.946  -1.549
  593   1HD   PRO  80          2HD       PRO  80  -3.745  10.602  -4.124
  594   2HD   PRO  80          1HD       PRO  80  -2.966  11.730  -2.985
  595    H    THR  81           HN       THR  81   0.357   7.416  -5.006
  596    HA   THR  81           HA       THR  81  -1.124   6.979  -7.565
  597    HB   THR  81           HB       THR  81   1.845   7.007  -6.974
  598    HG1  THR  81           HG1      THR  81   0.325   8.890  -7.840
  599   1HG2  THR  81          3HG23     THR  81   0.326   5.920  -9.389
  600   2HG2  THR  81          1HG21     THR  81   2.049   6.309  -9.420
  601   3HG2  THR  81          2HG22     THR  81   1.465   5.046  -8.336
  602    H    PHE  82           HN       PHE  82  -1.859   4.925  -7.823
  603    HA   PHE  82           HA       PHE  82  -0.983   2.892  -5.822
  604   1HB   PHE  82          1HB       PHE  82  -3.633   3.158  -7.247
  605   2HB   PHE  82          2HB       PHE  82  -3.167   1.877  -6.162
  606    HD1  PHE  82           HD2      PHE  82  -2.526   2.392  -3.751
  607    HD2  PHE  82           HD1      PHE  82  -4.395   5.322  -6.314
  608    HE1  PHE  82           HE2      PHE  82  -3.084   3.783  -1.776
  609    HE2  PHE  82           HE1      PHE  82  -4.927   6.702  -4.338
  610    HZ   PHE  82           HZ       PHE  82  -4.153   5.976  -2.056
  611    H    HIS  83           HN       HIS  83   0.215   1.246  -6.667
  612    HA   HIS  83           HA       HIS  83  -0.054   0.594  -9.596
  613   1HB   HIS  83          1HB       HIS  83   2.309   0.485  -7.704
  614   2HB   HIS  83          2HB       HIS  83   2.244  -0.387  -9.235
  615    HD2  HIS  83           HD2      HIS  83   0.887   3.113  -9.852
  616    HE1  HIS  83           HE1      HIS  83   5.007   3.182 -10.735
  617    HE2  HIS  83           HE2      HIS  83   2.868   4.464 -10.993
  618    H    VAL  84           HN       VAL  84  -0.355  -1.653 -10.023
  619    HA   VAL  84           HA       VAL  84  -0.649  -3.412  -7.615
  620    HB   VAL  84           HB       VAL  84  -2.021  -3.801 -10.289
  621   1HG1  VAL  84          3HG23     VAL  84  -1.778  -5.751  -8.740
  622   2HG1  VAL  84          1HG21     VAL  84  -2.544  -4.804  -7.446
  623   3HG1  VAL  84          2HG22     VAL  84  -3.470  -5.243  -8.897
  624   1HG2  VAL  84          1HG11     VAL  84  -3.075  -2.340  -7.831
  625   2HG2  VAL  84          2HG12     VAL  84  -2.855  -1.657  -9.460
  626   3HG2  VAL  84          3HG13     VAL  84  -4.065  -2.913  -9.189
  627    H    TYR  85           HN       TYR  85   1.279  -4.537  -7.456
  628    HA   TYR  85           HA       TYR  85   2.646  -5.382  -9.975
  629   1HB   TYR  85          1HB       TYR  85   3.586  -5.262  -7.111
  630   2HB   TYR  85          2HB       TYR  85   4.476  -6.061  -8.407
  631    HD1  TYR  85           HD2      TYR  85   3.228  -2.778  -7.258
  632    HD2  TYR  85           HD1      TYR  85   5.716  -4.868 -10.077
  633    HE1  TYR  85           HE2      TYR  85   4.282  -0.631  -7.936
  634    HE2  TYR  85           HE1      TYR  85   6.608  -2.699 -10.894
  635    HH   TYR  85           HH       TYR  85   5.172   0.387  -9.853
  636    H    LYS  86           HN       LYS  86   1.539  -7.200 -10.715
  637    HA   LYS  86           HA       LYS  86   1.095  -9.456  -8.782
  638   1HB   LYS  86          2HB       LYS  86   0.165  -9.217 -11.667
  639   2HB   LYS  86          1HB       LYS  86  -0.188 -10.529 -10.520
  640   1HG   LYS  86          2HG       LYS  86  -1.177  -8.740  -8.970
  641   2HG   LYS  86          1HG       LYS  86  -1.026  -7.627 -10.323
  642   1HD   LYS  86          1HD       LYS  86  -2.816 -10.091 -10.088
  643   2HD   LYS  86          2HD       LYS  86  -3.276  -8.400 -10.256
  644   1HE   LYS  86          1HE       LYS  86  -2.092  -8.460 -12.545
  645   2HE   LYS  86          2HE       LYS  86  -2.135 -10.226 -12.393
  646   1HZ   LYS  86          3HZ       LYS  86  -4.439  -8.394 -12.290
  647   2HZ   LYS  86          2HZ       LYS  86  -4.022  -9.339 -13.574
  648   3HZ   LYS  86          1HZ       LYS  86  -4.549 -10.031 -12.180
  649    H    ASP  87           HN       ASP  87   2.277 -11.257  -8.994
  650    HA   ASP  87           HA       ASP  87   3.961 -12.704  -9.445
  651   1HB   ASP  87          1HB       ASP  87   3.089 -12.727 -11.768
  652   2HB   ASP  87          2HB       ASP  87   4.144 -11.385 -12.205
  653    H    GLY  88           HN       GLY  88   4.816  -9.731 -11.002
  654   1HA   GLY  88          1HA       GLY  88   6.519  -8.541  -9.137
  655   2HA   GLY  88          2HA       GLY  88   7.567  -9.550 -10.162
  656    H    VAL  89           HN       VAL  89   4.550  -8.042 -11.413
  657    HA   VAL  89           HA       VAL  89   6.126  -5.997 -12.868
  658    HB   VAL  89           HB       VAL  89   4.173  -7.972 -14.138
  659   1HG1  VAL  89          1HG21     VAL  89   5.924  -5.788 -15.353
  660   2HG1  VAL  89          2HG22     VAL  89   4.952  -6.958 -16.269
  661   3HG1  VAL  89          3HG23     VAL  89   4.149  -5.767 -15.242
  662   1HG2  VAL  89          1HG11     VAL  89   7.210  -7.848 -14.348
  663   2HG2  VAL  89          3HG13     VAL  89   6.241  -9.182 -13.677
  664   3HG2  VAL  89          2HG12     VAL  89   6.155  -8.815 -15.399
  665    H    LYS  90           HN       LYS  90   5.020  -4.120 -13.027
  666    HA   LYS  90           HA       LYS  90   2.608  -3.585 -11.622
  667   1HB   LYS  90          1HB       LYS  90   4.324  -1.895 -12.176
  668   2HB   LYS  90          2HB       LYS  90   3.947  -2.065 -13.894
  669   1HG   LYS  90          2HG       LYS  90   1.643  -1.212 -13.480
  670   2HG   LYS  90          1HG       LYS  90   1.952  -1.181 -11.752
  671   1HD   LYS  90          1HD       LYS  90   2.233   1.072 -12.547
  672   2HD   LYS  90          2HD       LYS  90   3.834   0.455 -12.140
  673   1HE   LYS  90          1HE       LYS  90   3.820   1.763 -14.229
  674   2HE   LYS  90          2HE       LYS  90   4.340   0.102 -14.522
  675   1HZ   LYS  90          3HZ       LYS  90   1.609   1.115 -14.974
  676   2HZ   LYS  90          2HZ       LYS  90   2.755   0.918 -16.145
  677   3HZ   LYS  90          1HZ       LYS  90   2.168  -0.391 -15.341
  678    H    ALA  91           HN       ALA  91   0.927  -4.941 -12.232
  679    HA   ALA  91           HA       ALA  91   0.341  -5.519 -15.041
  680   1HB   ALA  91          3HB       ALA  91  -0.015  -7.176 -13.248
  681   2HB   ALA  91          1HB       ALA  91  -1.217  -6.104 -12.489
  682   3HB   ALA  91          2HB       ALA  91  -1.528  -6.792 -14.100
  683    H    ASP  92           HN       ASP  92  -0.701  -3.189 -12.612
  684    HA   ASP  92           HA       ASP  92  -2.209  -1.689 -14.549
  685   1HB   ASP  92          1HB       ASP  92  -3.782  -3.557 -13.789
  686   2HB   ASP  92          2HB       ASP  92  -3.684  -2.890 -12.148
  687    H    ASP  93           HN       ASP  93  -3.176   0.298 -13.329
  688    HA   ASP  93           HA       ASP  93  -2.033   0.951 -10.803
  689   1HB   ASP  93          2HB       ASP  93  -0.564   2.827 -11.580
  690   2HB   ASP  93          1HB       ASP  93   0.033   1.246 -12.052
  691    H    LEU  94           HN       LEU  94  -2.274   3.392 -10.429
  692    HA   LEU  94           HA       LEU  94  -4.515   4.742 -11.736
  693   1HB   LEU  94          2HB       LEU  94  -5.687   3.023 -10.495
  694   2HB   LEU  94          1HB       LEU  94  -4.631   3.245  -9.105
  695    HG   LEU  94           HG       LEU  94  -5.681   5.463  -8.656
  696   1HD1  LEU  94          1HD11     LEU  94  -7.445   4.514 -10.965
  697   2HD1  LEU  94          2HD12     LEU  94  -7.862   5.875  -9.902
  698   3HD1  LEU  94          3HD13     LEU  94  -6.460   5.974 -10.970
  699   1HD2  LEU  94          2HD22     LEU  94  -7.477   3.016  -8.796
  700   2HD2  LEU  94          1HD21     LEU  94  -6.372   3.459  -7.485
  701   3HD2  LEU  94          3HD23     LEU  94  -7.785   4.461  -7.814
  702    H    VAL  95           HN       VAL  95  -4.857   6.907 -10.614
  703    HA   VAL  95           HA       VAL  95  -2.723   7.719  -8.768
  704    HB   VAL  95           HB       VAL  95  -2.355   9.756 -10.102
  705   1HG1  VAL  95          3HG23     VAL  95  -0.809   7.860 -10.352
  706   2HG1  VAL  95          1HG21     VAL  95  -1.776   7.233 -11.708
  707   3HG1  VAL  95          2HG22     VAL  95  -0.960   8.796 -11.848
  708   1HG2  VAL  95          3HG13     VAL  95  -4.491   9.827 -11.372
  709   2HG2  VAL  95          2HG12     VAL  95  -3.083   9.912 -12.438
  710   3HG2  VAL  95          1HG11     VAL  95  -3.986   8.396 -12.296
  711    H    GLY  96           HN       GLY  96  -3.193   9.619  -7.607
  712   1HA   GLY  96          1HA       GLY  96  -4.473  11.339  -6.740
  713   2HA   GLY  96          2HA       GLY  96  -5.787  10.967  -7.879
  714    H    ALA  97           HN       ALA  97  -6.679  11.486  -5.476
  715    HA   ALA  97           HA       ALA  97  -6.770   9.226  -3.639
  716   1HB   ALA  97          3HB       ALA  97  -8.380  11.813  -3.811
  717   2HB   ALA  97          2HB       ALA  97  -8.382  10.685  -2.446
  718   3HB   ALA  97          1HB       ALA  97  -6.895  11.563  -2.865
  719    H    SER  98           HN       SER  98  -7.534   8.347  -6.196
  720    HA   SER  98           HA       SER  98 -10.407   8.325  -6.594
  721   1HB   SER  98          2HB       SER  98  -8.173   6.689  -7.828
  722   2HB   SER  98          1HB       SER  98  -9.774   7.019  -8.537
  723    HG   SER  98           HG       SER  98  -7.542   8.456  -8.794
  724    H    GLN  99           HN       GLN  99 -10.338   7.513  -4.113
  725    HA   GLN  99           HA       GLN  99  -9.614   4.902  -3.464
  726   1HB   GLN  99          2HB       GLN  99 -11.046   5.088  -1.547
  727   2HB   GLN  99          1HB       GLN  99 -10.188   6.601  -1.832
  728   1HG   GLN  99          1HG       GLN  99 -12.256   7.598  -2.798
  729   2HG   GLN  99          2HG       GLN  99 -13.111   6.066  -2.543
  730   1HE2  GLN  99          2HE22     GLN  99 -12.204   8.414   0.721
  731   2HE2  GLN  99          1HE21     GLN  99 -11.376   8.690  -0.803
  732    H    ASP 100           HN       ASP 100 -12.547   5.953  -5.156
  733    HA   ASP 100           HA       ASP 100 -14.089   3.549  -4.875
  734   1HB   ASP 100          2HB       ASP 100 -15.332   4.408  -6.786
  735   2HB   ASP 100          1HB       ASP 100 -15.059   5.692  -5.604
  736    H    LYS 101           HN       LYS 101 -11.875   4.751  -7.420
  737    HA   LYS 101           HA       LYS 101 -12.007   2.341  -8.963
  738   1HB   LYS 101          2HB       LYS 101 -11.398   4.614  -9.825
  739   2HB   LYS 101          1HB       LYS 101  -9.875   4.518  -8.943
  740   1HG   LYS 101          2HG       LYS 101  -9.616   4.000 -11.325
  741   2HG   LYS 101          1HG       LYS 101  -9.147   2.619 -10.312
  742   1HD   LYS 101          1HD       LYS 101 -11.229   1.458 -10.861
  743   2HD   LYS 101          2HD       LYS 101 -11.864   2.904 -11.672
  744   1HE   LYS 101          1HE       LYS 101 -11.059   1.251 -13.301
  745   2HE   LYS 101          2HE       LYS 101 -10.081   2.724 -13.387
  746   1HZ   LYS 101          2HZ       LYS 101  -9.336   0.263 -11.959
  747   2HZ   LYS 101          3HZ       LYS 101  -8.756   0.733 -13.426
  748   3HZ   LYS 101          1HZ       LYS 101  -8.411   1.620 -12.086
  749    H    LEU 102           HN       LEU 102  -9.883   3.490  -6.346
  750    HA   LEU 102           HA       LEU 102  -7.913   1.483  -6.489
  751   1HB   LEU 102          1HB       LEU 102  -7.871   3.565  -5.116
  752   2HB   LEU 102          2HB       LEU 102  -9.043   2.840  -4.004
  753    HG   LEU 102           HG       LEU 102  -7.504   1.184  -3.242
  754   1HD1  LEU 102          2HD22     LEU 102  -5.691   2.254  -5.431
  755   2HD1  LEU 102          1HD21     LEU 102  -5.087   1.317  -4.047
  756   3HD1  LEU 102          3HD23     LEU 102  -6.231   0.578  -5.171
  757   1HD2  LEU 102          2HD12     LEU 102  -6.425   4.028  -3.434
  758   2HD2  LEU 102          3HD13     LEU 102  -7.438   3.343  -2.152
  759   3HD2  LEU 102          1HD11     LEU 102  -5.755   2.817  -2.346
  760    H    LYS 103           HN       LYS 103 -10.991   1.528  -4.593
  761    HA   LYS 103           HA       LYS 103 -10.786  -1.062  -3.471
  762   1HB   LYS 103          1HB       LYS 103 -13.175   0.588  -4.385
  763   2HB   LYS 103          2HB       LYS 103 -13.315  -0.886  -3.428
  764   1HG   LYS 103          2HG       LYS 103 -12.279   0.062  -1.535
  765   2HG   LYS 103          1HG       LYS 103 -11.544   1.372  -2.449
  766   1HD   LYS 103          1HD       LYS 103 -13.860   2.254  -2.949
  767   2HD   LYS 103          2HD       LYS 103 -14.511   1.068  -1.802
  768   1HE   LYS 103          1HE       LYS 103 -13.194   2.096   0.017
  769   2HE   LYS 103          2HE       LYS 103 -12.374   3.159  -1.142
  770   1HZ   LYS 103          2HZ       LYS 103 -14.520   4.130  -1.637
  771   2HZ   LYS 103          1HZ       LYS 103 -15.219   3.229  -0.447
  772   3HZ   LYS 103          3HZ       LYS 103 -14.069   4.357  -0.076
  773    H    ALA 104           HN       ALA 104 -12.139   0.065  -6.587
  774    HA   ALA 104           HA       ALA 104 -12.970  -2.460  -7.560
  775   1HB   ALA 104          2HB       ALA 104 -13.667  -0.264  -8.497
  776   2HB   ALA 104          1HB       ALA 104 -12.046  -0.067  -9.196
  777   3HB   ALA 104          3HB       ALA 104 -13.080  -1.397  -9.731
  778    H    LEU 105           HN       LEU 105  -9.739  -0.822  -7.862
  779    HA   LEU 105           HA       LEU 105  -8.541  -2.661  -9.643
  780   1HB   LEU 105          2HB       LEU 105  -7.297  -1.279  -7.217
  781   2HB   LEU 105          1HB       LEU 105  -6.397  -2.252  -8.359
  782    HG   LEU 105           HG       LEU 105  -7.814   0.326  -9.111
  783   1HD1  LEU 105          2HD22     LEU 105  -4.912  -0.345  -8.414
  784   2HD1  LEU 105          1HD21     LEU 105  -5.443   1.170  -9.144
  785   3HD1  LEU 105          3HD23     LEU 105  -5.988   0.741  -7.518
  786   1HD2  LEU 105          3HD13     LEU 105  -5.734  -1.368 -10.568
  787   2HD2  LEU 105          2HD12     LEU 105  -7.440  -1.183 -11.053
  788   3HD2  LEU 105          1HD11     LEU 105  -6.345   0.210 -11.098
  789    H    VAL 106           HN       VAL 106  -8.625  -2.709  -6.044
  790    HA   VAL 106           HA       VAL 106  -7.333  -5.222  -5.792
  791    HB   VAL 106           HB       VAL 106  -9.383  -3.974  -3.902
  792   1HG1  VAL 106          2HG22     VAL 106  -7.224  -6.106  -3.541
  793   2HG1  VAL 106          3HG23     VAL 106  -8.131  -5.364  -2.208
  794   3HG1  VAL 106          1HG21     VAL 106  -8.968  -6.366  -3.402
  795   1HG2  VAL 106          3HG13     VAL 106  -6.343  -3.753  -3.981
  796   2HG2  VAL 106          1HG11     VAL 106  -7.483  -2.437  -4.323
  797   3HG2  VAL 106          2HG12     VAL 106  -7.401  -3.122  -2.700
  798    H    ALA 107           HN       ALA 107 -10.810  -4.447  -5.879
  799    HA   ALA 107           HA       ALA 107 -11.820  -7.048  -5.657
  800   1HB   ALA 107          2HB       ALA 107 -13.251  -4.990  -5.715
  801   2HB   ALA 107          1HB       ALA 107 -12.941  -4.842  -7.455
  802   3HB   ALA 107          3HB       ALA 107 -13.827  -6.240  -6.829
  803    H    LYS 108           HN       LYS 108 -10.948  -5.369  -8.711
  804    HA   LYS 108           HA       LYS 108 -11.475  -7.509 -10.520
  805   1HB   LYS 108          1HB       LYS 108 -11.045  -5.170 -11.200
  806   2HB   LYS 108          2HB       LYS 108  -9.378  -5.304 -10.660
  807   1HG   LYS 108          2HG       LYS 108  -9.230  -7.381 -12.260
  808   2HG   LYS 108          1HG       LYS 108 -10.736  -6.782 -12.936
  809   1HD   LYS 108          1HD       LYS 108  -9.626  -4.786 -13.760
  810   2HD   LYS 108          2HD       LYS 108  -8.253  -5.060 -12.696
  811   1HE   LYS 108          2HE       LYS 108  -7.708  -7.164 -13.874
  812   2HE   LYS 108          1HE       LYS 108  -9.106  -6.940 -14.933
  813   1HZ   LYS 108          3HZ       LYS 108  -6.788  -5.131 -14.752
  814   2HZ   LYS 108          1HZ       LYS 108  -7.070  -6.216 -15.959
  815   3HZ   LYS 108          2HZ       LYS 108  -8.082  -4.931 -15.754
  816    H    HIS 109           HN       HIS 109  -8.336  -6.421  -9.276
  817    HA   HIS 109           HA       HIS 109  -6.916  -8.594 -10.474
  818   1HB   HIS 109          2HB       HIS 109  -6.166  -6.464  -8.458
  819   2HB   HIS 109          1HB       HIS 109  -5.027  -7.647  -9.122
  820    HD2  HIS 109           HD2      HIS 109  -7.021  -4.479 -10.342
  821    HE1  HIS 109           HE1      HIS 109  -4.649  -5.805 -13.529
  822    HE2  HIS 109           HE2      HIS 109  -6.043  -3.866 -12.660
  823    H    ALA 110           HN       ALA 110  -8.496  -8.406  -7.316
  824    HA   ALA 110           HA       ALA 110  -7.074 -10.631  -6.153
  825   1HB   ALA 110          1HB       ALA 110  -9.915  -9.614  -5.703
  826   2HB   ALA 110          3HB       ALA 110  -9.057 -10.786  -4.680
  827   3HB   ALA 110          2HB       ALA 110  -8.463  -9.120  -4.797
  828    H    ALA 111           HN       ALA 111  -9.773 -10.345  -8.469
  829    HA   ALA 111           HA       ALA 111 -10.363 -13.241  -8.339
  830   1HB   ALA 111          2HB       ALA 111 -12.224 -11.628  -8.447
  831   2HB   ALA 111          3HB       ALA 111 -11.596 -10.987  -9.979
  832   3HB   ALA 111          1HB       ALA 111 -12.173 -12.663  -9.889
  833    H    ALA 112           HN       ALA 112  -9.261 -10.791 -10.685
  834    HA   ALA 112           HA       ALA 112  -7.710 -12.806 -12.183
  835   1HB   ALA 112          2HB       ALA 112  -9.873 -11.055 -13.434
  836   2HB   ALA 112          3HB       ALA 112  -8.680 -12.026 -14.323
  837   3HB   ALA 112          1HB       ALA 112  -9.896 -12.829 -13.308
   
  No H/Q in entry =         837
  Start of MODEL    8
    1   1H    GLY   1          1HN       GLY   1   2.094 -14.122   2.054
    2   2H    GLY   1          3HN       GLY   1   3.530 -13.973   2.796
    3   3H    GLY   1          2HN       GLY   1   2.867 -15.470   2.635
    4   1HA   GLY   1          1HA       GLY   1   1.252 -15.075   4.252
    5   2HA   GLY   1          2HA       GLY   1   2.747 -14.361   4.903
    6    H    GLY   2           HN       GLY   2   1.111 -13.035   6.172
    7   1HA   GLY   2          1HA       GLY   2  -0.721 -11.263   4.891
    8   2HA   GLY   2          2HA       GLY   2  -0.207 -11.255   6.584
    9    H    SER   3           HN       SER   3   1.261 -10.505   3.389
   10    HA   SER   3           HA       SER   3   2.738  -8.193   4.478
   11   1HB   SER   3          2HB       SER   3   2.453  -9.510   1.766
   12   2HB   SER   3          1HB       SER   3   3.284  -7.976   1.970
   13    HG   SER   3           HG       SER   3   4.782  -9.562   2.207
   14    H    VAL   4           HN       VAL   4   0.543  -7.519   5.302
   15    HA   VAL   4           HA       VAL   4  -0.848  -5.667   3.408
   16    HB   VAL   4           HB       VAL   4  -1.958  -7.880   3.903
   17   1HG1  VAL   4          2HG22     VAL   4  -1.160  -8.122   6.268
   18   2HG1  VAL   4          1HG21     VAL   4  -2.249  -6.821   6.750
   19   3HG1  VAL   4          3HG23     VAL   4  -2.907  -8.323   6.085
   20   1HG2  VAL   4          2HG12     VAL   4  -3.332  -5.856   3.348
   21   2HG2  VAL   4          3HG13     VAL   4  -4.137  -7.147   4.243
   22   3HG2  VAL   4          1HG11     VAL   4  -3.628  -5.697   5.110
   23    H    ILE   5           HN       ILE   5   1.429  -5.049   5.077
   24    HA   ILE   5           HA       ILE   5   0.187  -3.539   7.350
   25    HB   ILE   5           HB       ILE   5   2.233  -3.984   8.643
   26   1HG1  ILE   5          1HG11     ILE   5   2.915  -6.101   6.556
   27   2HG1  ILE   5          2HG12     ILE   5   3.717  -4.521   6.646
   28   1HG2  ILE   5          1HG21     ILE   5   0.123  -5.345   8.842
   29   2HG2  ILE   5          3HG23     ILE   5   0.825  -6.543   7.737
   30   3HG2  ILE   5          2HG22     ILE   5   1.574  -6.231   9.314
   31   1HD1  ILE   5          3HD13     ILE   5   4.423  -5.029   8.978
   32   2HD1  ILE   5          2HD12     ILE   5   3.738  -6.663   8.802
   33   3HD1  ILE   5          1HD11     ILE   5   5.079  -6.149   7.768
   34    H    VAL   6           HN       VAL   6   1.132  -1.724   8.064
   35    HA   VAL   6           HA       VAL   6   2.076   0.018   5.962
   36    HB   VAL   6           HB       VAL   6   1.272   0.372   8.878
   37   1HG1  VAL   6          2HG12     VAL   6   2.319   2.483   6.961
   38   2HG1  VAL   6          3HG13     VAL   6   1.351   2.850   8.404
   39   3HG1  VAL   6          1HG11     VAL   6   2.930   2.080   8.574
   40   1HG2  VAL   6          3HG23     VAL   6   0.030   1.251   6.232
   41   2HG2  VAL   6          1HG21     VAL   6  -0.562  -0.049   7.287
   42   3HG2  VAL   6          2HG22     VAL   6  -0.607   1.633   7.842
   43    H    ILE   7           HN       ILE   7   4.089   0.708   5.619
   44    HA   ILE   7           HA       ILE   7   6.055   1.094   7.582
   45    HB   ILE   7           HB       ILE   7   6.220  -1.412   7.298
   46   1HG1  ILE   7          2HG12     ILE   7   8.861  -0.411   6.297
   47   2HG1  ILE   7          1HG11     ILE   7   8.206   0.377   7.737
   48   1HG2  ILE   7          1HG21     ILE   7   5.688  -1.500   4.863
   49   2HG2  ILE   7          3HG23     ILE   7   7.273  -0.797   4.493
   50   3HG2  ILE   7          2HG22     ILE   7   7.168  -2.374   5.288
   51   1HD1  ILE   7          2HD12     ILE   7   8.418  -2.640   7.486
   52   2HD1  ILE   7          1HD11     ILE   7   9.631  -1.594   8.260
   53   3HD1  ILE   7          3HD13     ILE   7   7.988  -1.695   8.921
   54    H    ASP   8           HN       ASP   8   8.204   1.195   5.603
   55    HA   ASP   8           HA       ASP   8   7.219   2.580   3.250
   56   1HB   ASP   8          2HB       ASP   8   7.028   4.481   4.708
   57   2HB   ASP   8          1HB       ASP   8   8.551   4.100   5.533
   58    H    SER   9           HN       SER   9  10.047   2.353   5.391
   59    HA   SER   9           HA       SER   9  12.165   2.690   4.004
   60   1HB   SER   9          1HB       SER   9  11.895   0.127   5.597
   61   2HB   SER   9          2HB       SER   9  13.291   1.222   5.484
   62    HG   SER   9           HG       SER   9  12.070   1.585   7.418
   63    H    LYS  10           HN       LYS  10  12.871   2.178   2.007
   64    HA   LYS  10           HA       LYS  10  11.900   0.498   0.182
   65   1HB   LYS  10          2HB       LYS  10  14.073   0.581  -0.949
   66   2HB   LYS  10          1HB       LYS  10  13.529   2.121  -0.262
   67   1HG   LYS  10          1HG       LYS  10  15.143   1.765   1.671
   68   2HG   LYS  10          2HG       LYS  10  15.729   0.326   0.822
   69   1HD   LYS  10          1HD       LYS  10  17.219   2.157   0.380
   70   2HD   LYS  10          2HD       LYS  10  16.417   1.643  -1.104
   71   1HE   LYS  10          2HE       LYS  10  16.640   4.106  -0.921
   72   2HE   LYS  10          1HE       LYS  10  14.953   3.615  -1.060
   73   1HZ   LYS  10          3HZ       LYS  10  16.341   4.313   1.440
   74   2HZ   LYS  10          2HZ       LYS  10  15.287   5.277   0.622
   75   3HZ   LYS  10          1HZ       LYS  10  14.754   3.882   1.314
   76    H    ALA  11           HN       ALA  11  14.593  -0.614   2.321
   77    HA   ALA  11           HA       ALA  11  14.748  -3.245   1.357
   78   1HB   ALA  11          3HB       ALA  11  16.353  -2.262   2.955
   79   2HB   ALA  11          1HB       ALA  11  15.108  -2.256   4.226
   80   3HB   ALA  11          2HB       ALA  11  15.705  -3.796   3.571
   81    H    ALA  12           HN       ALA  12  12.464  -1.848   3.711
   82    HA   ALA  12           HA       ALA  12  11.297  -4.409   4.475
   83   1HB   ALA  12          3HB       ALA  12  11.347  -2.470   6.030
   84   2HB   ALA  12          1HB       ALA  12  10.256  -1.591   4.926
   85   3HB   ALA  12          2HB       ALA  12   9.715  -3.089   5.699
   86    H    TRP  13           HN       TRP  13  10.634  -1.773   2.132
   87    HA   TRP  13           HA       TRP  13   8.040  -2.691   1.307
   88   1HB   TRP  13          2HB       TRP  13   8.233  -0.762   0.222
   89   2HB   TRP  13          1HB       TRP  13   9.956  -0.693   0.456
   90    HD1  TRP  13           HD1      TRP  13  11.527  -1.502  -1.577
   91    HE1  TRP  13           HE1      TRP  13  11.149  -1.794  -4.062
   92    HE3  TRP  13           HE3      TRP  13   6.399  -1.249  -1.664
   93    HZ2  TRP  13           HZ2      TRP  13   8.982  -1.701  -5.896
   94    HZ3  TRP  13           HZ3      TRP  13   5.246  -1.136  -3.864
   95    HH2  TRP  13           HH2      TRP  13   6.498  -1.454  -5.965
   96    H    ASP  14           HN       ASP  14  11.306  -3.322  -0.029
   97    HA   ASP  14           HA       ASP  14  10.554  -5.255  -1.955
   98   1HB   ASP  14          2HB       ASP  14  13.149  -4.998  -0.363
   99   2HB   ASP  14          1HB       ASP  14  12.928  -6.029  -1.783
  100    H    ALA  15           HN       ALA  15  11.702  -5.733   1.384
  101    HA   ALA  15           HA       ALA  15  11.469  -8.537   1.468
  102   1HB   ALA  15          2HB       ALA  15  12.589  -7.172   3.216
  103   2HB   ALA  15          1HB       ALA  15  11.001  -6.571   3.748
  104   3HB   ALA  15          3HB       ALA  15  11.401  -8.292   3.907
  105    H    GLN  16           HN       GLN  16   9.025  -6.055   2.247
  106    HA   GLN  16           HA       GLN  16   7.003  -7.862   3.081
  107   1HB   GLN  16          2HB       GLN  16   6.910  -5.480   3.629
  108   2HB   GLN  16          1HB       GLN  16   6.619  -5.064   1.921
  109   1HG   GLN  16          1HG       GLN  16   4.549  -6.268   1.913
  110   2HG   GLN  16          2HG       GLN  16   4.899  -7.046   3.465
  111   1HE2  GLN  16          2HE22     GLN  16   3.943  -3.207   4.275
  112   2HE2  GLN  16          1HE21     GLN  16   5.456  -3.545   3.408
  113    H    LEU  17           HN       LEU  17   7.788  -6.527  -0.249
  114    HA   LEU  17           HA       LEU  17   5.642  -7.801  -1.566
  115   1HB   LEU  17          2HB       LEU  17   8.487  -7.580  -2.674
  116   2HB   LEU  17          1HB       LEU  17   6.976  -7.804  -3.526
  117    HG   LEU  17           HG       LEU  17   8.105  -5.301  -2.321
  118   1HD1  LEU  17          2HD22     LEU  17   8.622  -5.912  -4.657
  119   2HD1  LEU  17          3HD23     LEU  17   6.885  -5.945  -5.030
  120   3HD1  LEU  17          1HD21     LEU  17   7.664  -4.426  -4.553
  121   1HD2  LEU  17          1HD11     LEU  17   5.188  -5.748  -3.081
  122   2HD2  LEU  17          3HD13     LEU  17   5.828  -5.287  -1.482
  123   3HD2  LEU  17          2HD12     LEU  17   5.962  -4.164  -2.844
  124    H    ALA  18           HN       ALA  18   8.981  -8.988  -1.051
  125    HA   ALA  18           HA       ALA  18   8.661 -11.518  -2.212
  126   1HB   ALA  18          2HB       ALA  18  10.820 -10.491  -1.617
  127   2HB   ALA  18          3HB       ALA  18  10.461 -10.680   0.111
  128   3HB   ALA  18          1HB       ALA  18  10.680 -12.118  -0.913
  129    H    LYS  19           HN       LYS  19   8.433 -10.800   1.359
  130    HA   LYS  19           HA       LYS  19   7.705 -13.513   1.944
  131   1HB   LYS  19          2HB       LYS  19   7.409 -12.779   4.180
  132   2HB   LYS  19          1HB       LYS  19   8.786 -11.893   3.514
  133   1HG   LYS  19          2HG       LYS  19   7.183  -9.970   3.105
  134   2HG   LYS  19          1HG       LYS  19   5.926 -10.921   3.876
  135   1HD   LYS  19          1HD       LYS  19   6.699  -9.398   5.513
  136   2HD   LYS  19          2HD       LYS  19   7.248 -11.014   5.981
  137   1HE   LYS  19          2HE       LYS  19   9.526 -10.482   5.095
  138   2HE   LYS  19          1HE       LYS  19   8.942  -8.886   4.585
  139   1HZ   LYS  19          3HZ       LYS  19   8.500  -8.385   6.869
  140   2HZ   LYS  19          1HZ       LYS  19   9.034  -9.872   7.344
  141   3HZ   LYS  19          2HZ       LYS  19  10.082  -8.799   6.662
  142    H    GLY  20           HN       GLY  20   5.836 -11.072   0.372
  143   1HA   GLY  20          1HA       GLY  20   3.259 -11.637   1.481
  144   2HA   GLY  20          2HA       GLY  20   3.633 -10.971  -0.126
  145    H    LYS  21           HN       LYS  21   5.386 -13.170  -0.917
  146    HA   LYS  21           HA       LYS  21   5.255 -15.050  -2.166
  147   1HB   LYS  21          1HB       LYS  21   3.363 -16.025   0.020
  148   2HB   LYS  21          2HB       LYS  21   4.112 -17.025  -1.210
  149   1HG   LYS  21          2HG       LYS  21   5.574 -15.401   0.905
  150   2HG   LYS  21          1HG       LYS  21   5.308 -17.144   0.953
  151   1HD   LYS  21          1HD       LYS  21   7.101 -15.564  -0.942
  152   2HD   LYS  21          2HD       LYS  21   7.584 -16.711   0.295
  153   1HE   LYS  21          2HE       LYS  21   6.140 -17.365  -2.313
  154   2HE   LYS  21          1HE       LYS  21   7.813 -17.731  -1.895
  155   1HZ   LYS  21          3HZ       LYS  21   7.014 -19.167  -0.161
  156   2HZ   LYS  21          1HZ       LYS  21   5.447 -18.832  -0.555
  157   3HZ   LYS  21          2HZ       LYS  21   6.414 -19.624  -1.627
  158    H    GLU  22           HN       GLU  22   4.368 -13.692  -3.682
  159    HA   GLU  22           HA       GLU  22   1.526 -13.464  -4.161
  160   1HB   GLU  22          2HB       GLU  22   3.504 -11.861  -4.813
  161   2HB   GLU  22          1HB       GLU  22   3.656 -12.871  -6.252
  162   1HG   GLU  22          1HG       GLU  22   1.181 -11.370  -5.282
  163   2HG   GLU  22          2HG       GLU  22   2.250 -10.868  -6.599
  164    H    GLU  23           HN       GLU  23   1.505 -15.913  -3.875
  165    HA   GLU  23           HA       GLU  23   2.083 -17.562  -6.199
  166   1HB   GLU  23          2HB       GLU  23  -0.039 -18.137  -4.082
  167   2HB   GLU  23          1HB       GLU  23   0.815 -19.277  -5.127
  168   1HG   GLU  23          2HG       GLU  23   1.915 -17.734  -2.747
  169   2HG   GLU  23          1HG       GLU  23   1.774 -19.474  -2.949
  170    H    HIS  24           HN       HIS  24  -0.795 -15.918  -4.970
  171    HA   HIS  24           HA       HIS  24  -1.875 -15.240  -7.497
  172   1HB   HIS  24          2HB       HIS  24  -2.495 -17.630  -7.660
  173   2HB   HIS  24          1HB       HIS  24  -3.264 -17.556  -6.070
  174    HD2  HIS  24           HD2      HIS  24  -3.988 -14.649  -8.603
  175    HE1  HIS  24           HE1      HIS  24  -7.416 -17.106  -8.349
  176    HE2  HIS  24           HE2      HIS  24  -6.508 -14.907  -9.264
  177    H    LYS  25           HN       LYS  25  -1.387 -13.463  -5.844
  178    HA   LYS  25           HA       LYS  25  -3.840 -12.751  -4.348
  179   1HB   LYS  25          2HB       LYS  25  -1.018 -12.415  -3.270
  180   2HB   LYS  25          1HB       LYS  25  -2.512 -12.007  -2.430
  181   1HG   LYS  25          1HG       LYS  25  -1.595 -14.821  -3.175
  182   2HG   LYS  25          2HG       LYS  25  -1.361 -14.074  -1.610
  183   1HD   LYS  25          2HD       LYS  25  -3.639 -14.074  -1.052
  184   2HD   LYS  25          1HD       LYS  25  -4.188 -14.340  -2.702
  185   1HE   LYS  25          2HE       LYS  25  -2.686 -16.367  -0.978
  186   2HE   LYS  25          1HE       LYS  25  -4.427 -16.346  -1.308
  187   1HZ   LYS  25          2HZ       LYS  25  -3.862 -16.535  -3.669
  188   2HZ   LYS  25          1HZ       LYS  25  -2.291 -16.791  -3.258
  189   3HZ   LYS  25          3HZ       LYS  25  -3.445 -17.857  -2.767
  190    HA   PRO  26           HA       PRO  26  -2.631  -9.094  -6.768
  191   1HB   PRO  26          1HB       PRO  26  -4.435  -7.258  -5.916
  192   2HB   PRO  26          2HB       PRO  26  -4.928  -8.670  -6.900
  193   1HG   PRO  26          1HG       PRO  26  -5.009  -8.423  -3.882
  194   2HG   PRO  26          2HG       PRO  26  -6.367  -8.866  -4.940
  195   1HD   PRO  26          2HD       PRO  26  -4.825 -10.762  -3.716
  196   2HD   PRO  26          1HD       PRO  26  -5.345 -11.030  -5.407
  197    H    ILE  27           HN       ILE  27  -1.068  -7.544  -6.386
  198    HA   ILE  27           HA       ILE  27  -0.623  -6.760  -3.565
  199    HB   ILE  27           HB       ILE  27   1.581  -7.011  -3.635
  200   1HG1  ILE  27          2HG12     ILE  27   1.613  -6.491  -6.603
  201   2HG1  ILE  27          1HG11     ILE  27   2.077  -5.361  -5.315
  202   1HG2  ILE  27          1HG21     ILE  27   0.528  -9.231  -4.280
  203   2HG2  ILE  27          3HG23     ILE  27   1.000  -8.884  -5.959
  204   3HG2  ILE  27          2HG22     ILE  27   2.230  -9.066  -4.690
  205   1HD1  ILE  27          1HD11     ILE  27   3.842  -7.059  -4.597
  206   2HD1  ILE  27          3HD13     ILE  27   3.548  -7.879  -6.148
  207   3HD1  ILE  27          2HD12     ILE  27   4.137  -6.212  -6.120
  208    H    VAL  28           HN       VAL  28  -1.035  -4.745  -3.141
  209    HA   VAL  28           HA       VAL  28  -1.315  -2.806  -5.398
  210    HB   VAL  28           HB       VAL  28  -2.950  -2.893  -2.830
  211   1HG1  VAL  28          1HG11     VAL  28  -2.824  -0.706  -4.012
  212   2HG1  VAL  28          3HG13     VAL  28  -3.395  -1.484  -5.500
  213   3HG1  VAL  28          2HG12     VAL  28  -4.452  -1.399  -4.078
  214   1HG2  VAL  28          2HG22     VAL  28  -3.623  -4.125  -5.523
  215   2HG2  VAL  28          3HG23     VAL  28  -3.522  -4.949  -3.954
  216   3HG2  VAL  28          1HG21     VAL  28  -4.811  -3.786  -4.258
  217    H    VAL  29           HN       VAL  29  -0.056  -0.962  -5.115
  218    HA   VAL  29           HA       VAL  29   1.062  -0.533  -2.363
  219    HB   VAL  29           HB       VAL  29   2.867  -1.220  -3.705
  220   1HG1  VAL  29          3HG13     VAL  29   2.015   0.784  -5.792
  221   2HG1  VAL  29          1HG11     VAL  29   3.510  -0.191  -5.805
  222   3HG1  VAL  29          2HG12     VAL  29   1.948  -0.995  -5.939
  223   1HG2  VAL  29          1HG21     VAL  29   3.274   0.768  -2.256
  224   2HG2  VAL  29          2HG22     VAL  29   4.308   0.796  -3.683
  225   3HG2  VAL  29          3HG23     VAL  29   2.906   1.844  -3.615
  226    H    ASP  30           HN       ASP  30   0.863   1.335  -1.428
  227    HA   ASP  30           HA       ASP  30  -0.633   3.522  -2.815
  228   1HB   ASP  30          2HB       ASP  30  -1.610   2.582  -0.721
  229   2HB   ASP  30          1HB       ASP  30  -0.163   3.032   0.158
  230    H    PHE  31           HN       PHE  31   1.023   4.587  -3.854
  231    HA   PHE  31           HA       PHE  31   3.522   5.302  -2.410
  232   1HB   PHE  31          1HB       PHE  31   2.524   5.755  -5.243
  233   2HB   PHE  31          2HB       PHE  31   4.036   6.371  -4.637
  234    HD1  PHE  31           HD1      PHE  31   5.723   4.633  -3.612
  235    HD2  PHE  31           HD2      PHE  31   2.523   3.643  -6.332
  236    HE1  PHE  31           HE1      PHE  31   6.971   2.623  -4.363
  237    HE2  PHE  31           HE2      PHE  31   3.877   1.764  -7.216
  238    HZ   PHE  31           HZ       PHE  31   6.045   1.185  -6.174
  239    H    THR  32           HN       THR  32   2.715   6.719  -0.824
  240    HA   THR  32           HA       THR  32   1.249   9.154  -1.758
  241    HB   THR  32           HB       THR  32  -0.151   7.768  -0.305
  242    HG1  THR  32           HG1      THR  32  -0.640   9.350   1.144
  243   1HG2  THR  32          1HG21     THR  32   2.114   7.959   1.743
  244   2HG2  THR  32          2HG22     THR  32   0.484   7.331   2.056
  245   3HG2  THR  32          3HG23     THR  32   1.546   6.482   0.931
  246    H    ALA  33           HN       ALA  33   1.596  10.835   0.268
  247    HA   ALA  33           HA       ALA  33   4.530  11.142   0.694
  248   1HB   ALA  33          2HB       ALA  33   2.819  13.132  -0.818
  249   2HB   ALA  33          3HB       ALA  33   4.399  13.509  -0.093
  250   3HB   ALA  33          1HB       ALA  33   4.281  12.286  -1.368
  251    H    THR  34           HN       THR  34   4.630  11.319   2.839
  252    HA   THR  34           HA       THR  34   2.798  11.751   4.781
  253    HB   THR  34           HB       THR  34   4.859  12.897   5.984
  254    HG1  THR  34           HG1      THR  34   6.785  12.332   4.661
  255   1HG2  THR  34          3HG23     THR  34   4.972  10.097   4.783
  256   2HG2  THR  34          1HG21     THR  34   6.057  10.696   6.054
  257   3HG2  THR  34          2HG22     THR  34   4.313  10.575   6.353
  258    H    TRP  35           HN       TRP  35   4.749  14.409   3.436
  259    HA   TRP  35           HA       TRP  35   3.467  16.479   4.906
  260   1HB   TRP  35          2HB       TRP  35   4.596  17.982   3.275
  261   2HB   TRP  35          1HB       TRP  35   5.647  16.795   4.034
  262    HD1  TRP  35           HD1      TRP  35   6.984  15.190   2.513
  263    HE1  TRP  35           HE1      TRP  35   7.412  15.064   0.001
  264    HE3  TRP  35           HE3      TRP  35   3.182  18.230   0.875
  265    HZ2  TRP  35           HZ2      TRP  35   6.147  15.968  -2.423
  266    HZ3  TRP  35           HZ3      TRP  35   2.805  18.538  -1.550
  267    HH2  TRP  35           HH2      TRP  35   4.276  17.419  -3.206
  268    H    CYS  36           HN       CYS  36   2.383  14.897   1.933
  269    HA   CYS  36           HA       CYS  36   0.718  17.199   1.109
  270   1HB   CYS  36          1HB       CYS  36   1.544  15.916  -0.701
  271   2HB   CYS  36          2HB       CYS  36   1.114  14.402   0.081
  272    H    GLY  37           HN       GLY  37  -0.464  17.493   3.021
  273   1HA   GLY  37          1HA       GLY  37  -1.886  16.199   4.739
  274   2HA   GLY  37          2HA       GLY  37  -2.707  17.450   3.790
  275    HA   PRO  38           HA       PRO  38  -5.633  14.547   2.310
  276   1HB   PRO  38          1HB       PRO  38  -5.739  14.672  -0.450
  277   2HB   PRO  38          2HB       PRO  38  -6.373  15.930   0.645
  278   1HG   PRO  38          2HG       PRO  38  -3.692  15.872  -0.746
  279   2HG   PRO  38          1HG       PRO  38  -4.847  17.232  -0.650
  280   1HD   PRO  38          1HD       PRO  38  -2.723  17.098   1.011
  281   2HD   PRO  38          2HD       PRO  38  -4.303  17.642   1.636
  282    H    CYS  39           HN       CYS  39  -2.496  14.208   0.690
  283    HA   CYS  39           HA       CYS  39  -2.928  11.508  -0.288
  284   1HB   CYS  39          1HB       CYS  39  -0.242  12.694   0.461
  285   2HB   CYS  39          2HB       CYS  39  -0.611  11.409  -0.671
  286    H    LYS  40           HN       LYS  40  -1.636  13.054   2.633
  287    HA   LYS  40           HA       LYS  40  -0.840  10.709   4.020
  288   1HB   LYS  40          1HB       LYS  40  -0.381  13.257   4.450
  289   2HB   LYS  40          2HB       LYS  40  -1.863  13.216   5.406
  290   1HG   LYS  40          2HG       LYS  40   0.602  11.473   5.836
  291   2HG   LYS  40          1HG       LYS  40   0.205  12.961   6.699
  292   1HD   LYS  40          1HD       LYS  40  -1.962  11.829   7.474
  293   2HD   LYS  40          2HD       LYS  40  -1.344  10.328   6.760
  294   1HE   LYS  40          1HE       LYS  40  -0.866  10.296   9.115
  295   2HE   LYS  40          2HE       LYS  40   0.660  10.445   8.229
  296   1HZ   LYS  40          3HZ       LYS  40  -0.807  12.654   9.502
  297   2HZ   LYS  40          1HZ       LYS  40   0.529  11.912  10.115
  298   3HZ   LYS  40          2HZ       LYS  40   0.639  12.784   8.723
  299    H    MET  41           HN       MET  41  -3.847  12.639   4.107
  300    HA   MET  41           HA       MET  41  -5.291  10.999   5.898
  301   1HB   MET  41          1HB       MET  41  -5.941  13.311   5.125
  302   2HB   MET  41          2HB       MET  41  -6.392  12.631   3.558
  303   1HG   MET  41          2HG       MET  41  -8.349  12.991   4.999
  304   2HG   MET  41          1HG       MET  41  -8.156  11.300   4.562
  305   1HE   MET  41          2HE       MET  41  -7.872  13.995   7.330
  306   2HE   MET  41          3HE       MET  41  -7.431  13.050   8.772
  307   3HE   MET  41          1HE       MET  41  -6.236  13.300   7.481
  308    H    ILE  42           HN       ILE  42  -4.832  10.561   2.411
  309    HA   ILE  42           HA       ILE  42  -6.706   8.386   2.189
  310    HB   ILE  42           HB       ILE  42  -4.283   9.285   0.597
  311   1HG1  ILE  42          2HG12     ILE  42  -6.548  10.532   0.625
  312   2HG1  ILE  42          1HG11     ILE  42  -5.821  10.148  -0.930
  313   1HG2  ILE  42          2HG22     ILE  42  -6.017   6.849   0.035
  314   2HG2  ILE  42          3HG23     ILE  42  -5.019   7.677  -1.182
  315   3HG2  ILE  42          1HG21     ILE  42  -4.252   6.930   0.224
  316   1HD1  ILE  42          2HD12     ILE  42  -7.991   8.440   0.349
  317   2HD1  ILE  42          3HD13     ILE  42  -8.300   9.749  -0.793
  318   3HD1  ILE  42          1HD11     ILE  42  -7.369   8.341  -1.320
  319    H    ALA  43           HN       ALA  43  -3.448   8.505   3.578
  320    HA   ALA  43           HA       ALA  43  -2.744   5.819   3.207
  321   1HB   ALA  43          2HB       ALA  43  -1.218   7.650   3.941
  322   2HB   ALA  43          3HB       ALA  43  -1.948   7.610   5.555
  323   3HB   ALA  43          1HB       ALA  43  -1.082   6.207   4.953
  324    HA   PRO  44           HA       PRO  44  -4.663   4.556   7.415
  325   1HB   PRO  44          2HB       PRO  44  -6.735   6.042   8.484
  326   2HB   PRO  44          1HB       PRO  44  -5.018   6.235   8.937
  327   1HG   PRO  44          1HG       PRO  44  -6.574   7.830   6.885
  328   2HG   PRO  44          2HG       PRO  44  -5.545   8.460   8.205
  329   1HD   PRO  44          1HD       PRO  44  -4.550   8.235   5.742
  330   2HD   PRO  44          2HD       PRO  44  -3.555   7.714   7.121
  331    H    LEU  45           HN       LEU  45  -6.610   6.215   4.933
  332    HA   LEU  45           HA       LEU  45  -8.859   4.375   5.148
  333   1HB   LEU  45          2HB       LEU  45  -7.909   6.346   3.059
  334   2HB   LEU  45          1HB       LEU  45  -9.099   5.123   2.630
  335    HG   LEU  45           HG       LEU  45 -10.021   7.351   3.285
  336   1HD1  LEU  45          2HD22     LEU  45 -11.392   5.295   3.238
  337   2HD1  LEU  45          3HD23     LEU  45 -11.011   4.994   4.946
  338   3HD1  LEU  45          1HD21     LEU  45 -11.928   6.435   4.482
  339   1HD2  LEU  45          3HD13     LEU  45  -8.539   7.815   5.223
  340   2HD2  LEU  45          2HD12     LEU  45 -10.258   7.949   5.620
  341   3HD2  LEU  45          1HD11     LEU  45  -9.344   6.523   6.140
  342    H    PHE  46           HN       PHE  46  -5.929   4.507   3.054
  343    HA   PHE  46           HA       PHE  46  -6.333   2.035   1.726
  344   1HB   PHE  46          1HB       PHE  46  -4.574   3.629   1.119
  345   2HB   PHE  46          2HB       PHE  46  -3.738   3.351   2.630
  346    HD1  PHE  46           HD1      PHE  46  -4.756   1.636  -0.545
  347    HD2  PHE  46           HD2      PHE  46  -2.289   1.442   2.974
  348    HE1  PHE  46           HE1      PHE  46  -3.290  -0.017  -1.663
  349    HE2  PHE  46           HE2      PHE  46  -0.749  -0.110   1.809
  350    HZ   PHE  46           HZ       PHE  46  -1.223  -0.796  -0.543
  351    H    GLU  47           HN       GLU  47  -4.752   2.726   4.892
  352    HA   GLU  47           HA       GLU  47  -4.091   0.059   5.567
  353   1HB   GLU  47          2HB       GLU  47  -3.355   2.153   6.743
  354   2HB   GLU  47          1HB       GLU  47  -4.964   2.246   7.490
  355   1HG   GLU  47          1HG       GLU  47  -4.621   0.088   8.599
  356   2HG   GLU  47          2HG       GLU  47  -3.077  -0.129   7.757
  357    H    THR  48           HN       THR  48  -7.146   1.884   6.087
  358    HA   THR  48           HA       THR  48  -8.513  -0.133   7.550
  359    HB   THR  48           HB       THR  48  -9.727   1.913   5.635
  360    HG1  THR  48           HG1      THR  48  -8.369   2.829   7.285
  361   1HG2  THR  48          1HG21     THR  48 -10.874   0.446   8.046
  362   2HG2  THR  48          2HG22     THR  48 -11.678   1.742   7.139
  363   3HG2  THR  48          3HG23     THR  48 -11.345   0.190   6.350
  364    H    LEU  49           HN       LEU  49  -8.295   0.475   3.983
  365    HA   LEU  49           HA       LEU  49  -9.920  -1.796   3.294
  366   1HB   LEU  49          2HB       LEU  49  -7.964  -0.061   1.782
  367   2HB   LEU  49          1HB       LEU  49  -8.503  -1.605   1.102
  368    HG   LEU  49           HG       LEU  49 -10.825  -0.987   1.317
  369   1HD1  LEU  49          1HD21     LEU  49  -9.808   1.769   2.132
  370   2HD1  LEU  49          3HD23     LEU  49 -11.480   1.382   1.693
  371   3HD1  LEU  49          2HD22     LEU  49 -10.775   0.672   3.148
  372   1HD2  LEU  49          3HD13     LEU  49  -9.590  -0.591  -0.786
  373   2HD2  LEU  49          2HD12     LEU  49 -10.828   0.656  -0.547
  374   3HD2  LEU  49          1HD11     LEU  49  -9.127   1.027  -0.216
  375    H    SER  50           HN       SER  50  -6.441  -1.414   3.824
  376    HA   SER  50           HA       SER  50  -5.495  -3.982   3.099
  377   1HB   SER  50          1HB       SER  50  -4.516  -2.549   5.613
  378   2HB   SER  50          2HB       SER  50  -3.636  -3.625   4.559
  379    HG   SER  50           HG       SER  50  -4.623  -1.163   3.616
  380    H    ASN  51           HN       ASN  51  -6.752  -2.860   6.270
  381    HA   ASN  51           HA       ASN  51  -6.818  -5.419   7.534
  382   1HB   ASN  51          2HB       ASN  51  -6.930  -3.375   8.814
  383   2HB   ASN  51          1HB       ASN  51  -8.413  -2.861   8.006
  384   1HD2  ASN  51          2HD22     ASN  51 -10.556  -4.921   9.965
  385   2HD2  ASN  51          1HD21     ASN  51 -10.443  -3.946   8.510
  386    H    ASP  52           HN       ASP  52  -9.372  -3.609   5.783
  387    HA   ASP  52           HA       ASP  52 -11.577  -5.226   6.173
  388   1HB   ASP  52          1HB       ASP  52 -11.587  -3.049   4.960
  389   2HB   ASP  52          2HB       ASP  52 -10.769  -3.817   3.579
  390    H    TYR  53           HN       TYR  53  -9.268  -5.499   3.421
  391    HA   TYR  53           HA       TYR  53 -10.500  -8.017   2.548
  392   1HB   TYR  53          1HB       TYR  53  -8.146  -6.344   1.678
  393   2HB   TYR  53          2HB       TYR  53  -8.518  -7.928   0.973
  394    HD1  TYR  53           HD1      TYR  53  -9.710  -4.413   1.238
  395    HD2  TYR  53           HD2      TYR  53 -10.305  -8.280  -0.572
  396    HE1  TYR  53           HE1      TYR  53 -11.053  -3.369  -0.550
  397    HE2  TYR  53           HE2      TYR  53 -11.652  -7.236  -2.354
  398    HH   TYR  53           HH       TYR  53 -12.451  -5.260  -3.235
  399    H    ALA  54           HN       ALA  54  -7.597  -7.033   4.385
  400    HA   ALA  54           HA       ALA  54  -6.252  -8.146   5.762
  401   1HB   ALA  54          1HB       ALA  54  -8.402  -9.312   6.462
  402   2HB   ALA  54          2HB       ALA  54  -7.934 -10.668   5.412
  403   3HB   ALA  54          3HB       ALA  54  -6.914 -10.205   6.782
  404    H    GLY  55           HN       GLY  55  -5.082 -10.519   5.859
  405   1HA   GLY  55          1HA       GLY  55  -2.928 -10.420   4.301
  406   2HA   GLY  55          2HA       GLY  55  -3.556 -11.939   4.968
  407    H    LYS  56           HN       LYS  56  -5.961 -11.771   2.997
  408    HA   LYS  56           HA       LYS  56  -4.653 -13.373   0.983
  409   1HB   LYS  56          1HB       LYS  56  -6.781 -13.669   0.011
  410   2HB   LYS  56          2HB       LYS  56  -6.954 -13.737   1.767
  411   1HG   LYS  56          1HG       LYS  56  -7.800 -11.331   1.693
  412   2HG   LYS  56          2HG       LYS  56  -7.628 -11.385  -0.064
  413   1HD   LYS  56          2HD       LYS  56  -9.921 -11.791   0.338
  414   2HD   LYS  56          1HD       LYS  56  -9.195 -13.316  -0.175
  415   1HE   LYS  56          2HE       LYS  56 -10.661 -13.817   1.637
  416   2HE   LYS  56          1HE       LYS  56  -9.033 -13.965   2.292
  417   1HZ   LYS  56          2HZ       LYS  56  -9.315 -11.677   3.148
  418   2HZ   LYS  56          3HZ       LYS  56 -10.864 -11.683   2.611
  419   3HZ   LYS  56          1HZ       LYS  56 -10.402 -12.745   3.781
  420    H    VAL  57           HN       VAL  57  -5.091  -9.918   1.297
  421    HA   VAL  57           HA       VAL  57  -4.182  -9.626  -1.550
  422    HB   VAL  57           HB       VAL  57  -5.087  -7.412  -1.585
  423   1HG1  VAL  57          3HG23     VAL  57  -6.525  -9.393  -2.281
  424   2HG1  VAL  57          1HG21     VAL  57  -7.327  -9.268  -0.707
  425   3HG1  VAL  57          2HG22     VAL  57  -7.418  -7.922  -1.849
  426   1HG2  VAL  57          3HG13     VAL  57  -6.294  -7.986   1.145
  427   2HG2  VAL  57          2HG12     VAL  57  -5.032  -6.794   0.815
  428   3HG2  VAL  57          1HG11     VAL  57  -6.645  -6.591   0.121
  429    H    ILE  58           HN       ILE  58  -2.308  -8.463  -1.815
  430    HA   ILE  58           HA       ILE  58  -0.740  -8.042   0.673
  431    HB   ILE  58           HB       ILE  58   0.063  -8.215  -2.253
  432   1HG1  ILE  58          1HG11     ILE  58  -0.515 -10.378  -1.811
  433   2HG1  ILE  58          2HG12     ILE  58   1.209 -10.351  -1.443
  434   1HG2  ILE  58          3HG23     ILE  58   1.590  -6.806  -0.881
  435   2HG2  ILE  58          1HG21     ILE  58   1.824  -8.177   0.197
  436   3HG2  ILE  58          2HG22     ILE  58   2.360  -8.281  -1.483
  437   1HD1  ILE  58          2HD12     ILE  58   0.512 -10.090   1.036
  438   2HD1  ILE  58          1HD11     ILE  58  -1.127 -10.482   0.501
  439   3HD1  ILE  58          3HD13     ILE  58   0.177 -11.645   0.255
  440    H    PHE  59           HN       PHE  59  -0.462  -5.952   1.389
  441    HA   PHE  59           HA       PHE  59  -1.058  -3.713  -0.492
  442   1HB   PHE  59          2HB       PHE  59  -2.376  -4.260   2.172
  443   2HB   PHE  59          1HB       PHE  59  -1.930  -2.621   1.806
  444    HD1  PHE  59           HD1      PHE  59  -3.514  -5.223  -0.485
  445    HD2  PHE  59           HD2      PHE  59  -3.831  -1.374   1.429
  446    HE1  PHE  59           HE1      PHE  59  -5.860  -5.010  -1.226
  447    HE2  PHE  59           HE2      PHE  59  -6.201  -1.283   0.878
  448    HZ   PHE  59           HZ       PHE  59  -7.322  -3.291  -0.129
  449    H    LEU  60           HN       LEU  60   0.474  -2.399  -0.636
  450    HA   LEU  60           HA       LEU  60   2.637  -2.400   1.423
  451   1HB   LEU  60          1HB       LEU  60   2.699  -1.741  -1.537
  452   2HB   LEU  60          2HB       LEU  60   4.073  -1.920  -0.446
  453    HG   LEU  60           HG       LEU  60   3.974  -3.764  -1.789
  454   1HD1  LEU  60          3HD13     LEU  60   4.370  -4.300   0.590
  455   2HD1  LEU  60          2HD12     LEU  60   2.668  -4.793   0.749
  456   3HD1  LEU  60          1HD11     LEU  60   3.748  -5.682  -0.336
  457   1HD2  LEU  60          1HD21     LEU  60   1.814  -3.588  -2.776
  458   2HD2  LEU  60          2HD22     LEU  60   2.329  -5.227  -2.409
  459   3HD2  LEU  60          3HD23     LEU  60   1.106  -4.462  -1.393
  460    H    LYS  61           HN       LYS  61   2.365  -0.597   2.721
  461    HA   LYS  61           HA       LYS  61   1.513   1.979   1.517
  462   1HB   LYS  61          2HB       LYS  61   0.907   1.413   3.840
  463   2HB   LYS  61          1HB       LYS  61   2.622   1.259   4.238
  464   1HG   LYS  61          1HG       LYS  61   1.712   3.385   5.044
  465   2HG   LYS  61          2HG       LYS  61   3.041   3.603   3.923
  466   1HD   LYS  61          1HD       LYS  61   1.200   5.222   3.598
  467   2HD   LYS  61          2HD       LYS  61   1.504   4.281   2.144
  468   1HE   LYS  61          1HE       LYS  61  -0.907   4.623   2.653
  469   2HE   LYS  61          2HE       LYS  61  -0.465   2.926   2.500
  470   1HZ   LYS  61          3HZ       LYS  61  -0.685   4.296   5.086
  471   2HZ   LYS  61          1HZ       LYS  61  -1.923   3.459   4.393
  472   3HZ   LYS  61          2HZ       LYS  61  -0.528   2.684   4.815
  473    H    VAL  62           HN       VAL  62   2.992   3.475   0.549
  474    HA   VAL  62           HA       VAL  62   5.824   3.318   1.433
  475    HB   VAL  62           HB       VAL  62   4.890   3.301  -1.483
  476   1HG1  VAL  62          3HG13     VAL  62   7.639   3.440  -0.166
  477   2HG1  VAL  62          1HG11     VAL  62   7.387   3.187  -1.904
  478   3HG1  VAL  62          2HG12     VAL  62   6.917   4.720  -1.166
  479   1HG2  VAL  62          3HG23     VAL  62   6.439   1.230   0.129
  480   2HG2  VAL  62          2HG22     VAL  62   4.788   1.039  -0.498
  481   3HG2  VAL  62          1HG21     VAL  62   6.140   1.193  -1.621
  482    H    ASP  63           HN       ASP  63   6.788   5.273   1.676
  483    HA   ASP  63           HA       ASP  63   5.137   7.693   1.146
  484   1HB   ASP  63          2HB       ASP  63   5.777   7.472   3.460
  485   2HB   ASP  63          1HB       ASP  63   7.481   7.264   3.014
  486    H    VAL  64           HN       VAL  64   5.547   8.197  -0.855
  487    HA   VAL  64           HA       VAL  64   7.681   7.919  -2.583
  488    HB   VAL  64           HB       VAL  64   5.581  10.110  -2.225
  489   1HG1  VAL  64          3HG23     VAL  64   7.374   9.685  -4.618
  490   2HG1  VAL  64          1HG21     VAL  64   5.881  10.640  -4.620
  491   3HG1  VAL  64          2HG22     VAL  64   7.238  11.144  -3.607
  492   1HG2  VAL  64          1HG11     VAL  64   4.822   7.713  -2.677
  493   2HG2  VAL  64          2HG12     VAL  64   4.338   8.879  -3.907
  494   3HG2  VAL  64          3HG13     VAL  64   5.724   7.799  -4.196
  495    H    ASP  65           HN       ASP  65   7.072  10.543  -0.237
  496    HA   ASP  65           HA       ASP  65   9.162  12.278  -0.990
  497   1HB   ASP  65          2HB       ASP  65   7.287  12.811   0.568
  498   2HB   ASP  65          1HB       ASP  65   8.071  11.849   1.824
  499    H    ALA  66           HN       ALA  66   9.155   9.750   1.600
  500    HA   ALA  66           HA       ALA  66  11.946  10.010   2.173
  501   1HB   ALA  66          1HB       ALA  66   9.965   7.759   2.704
  502   2HB   ALA  66          3HB       ALA  66  11.591   7.874   3.410
  503   3HB   ALA  66          2HB       ALA  66  10.370   9.101   3.794
  504    H    VAL  67           HN       VAL  67  10.200   7.310   0.431
  505    HA   VAL  67           HA       VAL  67  12.857   6.304  -0.428
  506    HB   VAL  67           HB       VAL  67  11.705   4.450  -1.362
  507   1HG1  VAL  67          3HG13     VAL  67  12.497   4.368   0.941
  508   2HG1  VAL  67          2HG12     VAL  67  10.960   5.034   1.523
  509   3HG1  VAL  67          1HG11     VAL  67  11.001   3.436   0.754
  510   1HG2  VAL  67          3HG23     VAL  67   9.447   5.710  -1.789
  511   2HG2  VAL  67          1HG21     VAL  67   9.474   4.028  -1.243
  512   3HG2  VAL  67          2HG22     VAL  67   9.126   5.335  -0.085
  513    H    ALA  68           HN       ALA  68  12.818   8.673  -1.466
  514    HA   ALA  68           HA       ALA  68  11.638   9.267  -3.889
  515   1HB   ALA  68          3HB       ALA  68  13.159  10.768  -2.671
  516   2HB   ALA  68          1HB       ALA  68  14.546   9.738  -3.090
  517   3HB   ALA  68          2HB       ALA  68  13.661  10.605  -4.365
  518    H    ALA  69           HN       ALA  69  14.467   7.157  -3.373
  519    HA   ALA  69           HA       ALA  69  15.173   6.630  -6.054
  520   1HB   ALA  69          3HB       ALA  69  16.561   6.017  -4.125
  521   2HB   ALA  69          1HB       ALA  69  15.358   4.813  -3.612
  522   3HB   ALA  69          2HB       ALA  69  16.235   4.601  -5.142
  523    H    VAL  70           HN       VAL  70  12.795   4.975  -3.925
  524    HA   VAL  70           HA       VAL  70  12.184   2.891  -5.869
  525    HB   VAL  70           HB       VAL  70  10.616   3.820  -3.425
  526   1HG1  VAL  70          2HG22     VAL  70  10.515   1.208  -4.999
  527   2HG1  VAL  70          3HG23     VAL  70   9.611   1.565  -3.513
  528   3HG1  VAL  70          1HG21     VAL  70   9.261   2.461  -4.996
  529   1HG2  VAL  70          1HG11     VAL  70  12.660   1.573  -3.725
  530   2HG2  VAL  70          3HG13     VAL  70  12.915   3.068  -2.805
  531   3HG2  VAL  70          2HG12     VAL  70  11.686   1.908  -2.277
  532    H    ALA  71           HN       ALA  71  10.795   5.998  -4.805
  533    HA   ALA  71           HA       ALA  71   8.462   5.971  -6.384
  534   1HB   ALA  71          1HB       ALA  71   8.925   7.633  -4.617
  535   2HB   ALA  71          2HB       ALA  71  10.168   8.388  -5.632
  536   3HB   ALA  71          3HB       ALA  71   8.481   8.407  -6.154
  537    H    GLU  72           HN       GLU  72  11.695   7.400  -7.272
  538    HA   GLU  72           HA       GLU  72  10.794   8.060  -9.926
  539   1HB   GLU  72          1HB       GLU  72  13.083   8.528 -10.455
  540   2HB   GLU  72          2HB       GLU  72  12.689   9.179  -8.861
  541   1HG   GLU  72          1HG       GLU  72  13.817   7.185  -7.839
  542   2HG   GLU  72          2HG       GLU  72  14.336   6.675  -9.452
  543    H    ALA  73           HN       ALA  73  12.460   5.134  -8.596
  544    HA   ALA  73           HA       ALA  73  12.865   3.843 -11.085
  545   1HB   ALA  73          2HB       ALA  73  13.844   3.067  -8.961
  546   2HB   ALA  73          3HB       ALA  73  12.232   2.618  -8.360
  547   3HB   ALA  73          1HB       ALA  73  12.930   1.768  -9.753
  548    H    ALA  74           HN       ALA  74  10.035   3.732  -8.877
  549    HA   ALA  74           HA       ALA  74   8.442   1.982 -10.501
  550   1HB   ALA  74          2HB       ALA  74   8.068   2.326  -8.087
  551   2HB   ALA  74          1HB       ALA  74   7.636   4.022  -8.381
  552   3HB   ALA  74          3HB       ALA  74   6.611   2.718  -9.016
  553    H    GLY  75           HN       GLY  75   8.894   5.483 -10.364
  554   1HA   GLY  75          1HA       GLY  75   8.667   6.935 -12.202
  555   2HA   GLY  75          2HA       GLY  75   7.554   5.803 -12.992
  556    H    ILE  76           HN       ILE  76   7.594   7.222  -9.682
  557    HA   ILE  76           HA       ILE  76   4.729   7.871  -9.899
  558    HB   ILE  76           HB       ILE  76   6.706   8.574  -7.686
  559   1HG1  ILE  76          1HG11     ILE  76   6.749   6.185  -7.999
  560   2HG1  ILE  76          2HG12     ILE  76   5.907   6.562  -6.508
  561   1HG2  ILE  76          2HG22     ILE  76   3.666   8.480  -7.828
  562   2HG2  ILE  76          3HG23     ILE  76   4.564   8.527  -6.301
  563   3HG2  ILE  76          1HG21     ILE  76   4.696   9.869  -7.435
  564   1HD1  ILE  76          2HD12     ILE  76   4.570   5.804  -9.155
  565   2HD1  ILE  76          3HD13     ILE  76   4.909   4.715  -7.818
  566   3HD1  ILE  76          1HD11     ILE  76   3.769   6.051  -7.579
  567    H    THR  77           HN       THR  77   3.868   9.963  -9.772
  568    HA   THR  77           HA       THR  77   5.667  12.216 -10.588
  569    HB   THR  77           HB       THR  77   3.760  12.955 -12.038
  570    HG1  THR  77           HG1      THR  77   2.284  11.170 -12.587
  571   1HG2  THR  77          1HG21     THR  77   5.717  11.703 -12.973
  572   2HG2  THR  77          2HG22     THR  77   4.834  10.180 -12.749
  573   3HG2  THR  77          3HG23     THR  77   4.223  11.404 -13.879
  574    H    ALA  78           HN       ALA  78   2.200  12.046 -10.057
  575    HA   ALA  78           HA       ALA  78   2.408  13.971  -7.777
  576   1HB   ALA  78          1HB       ALA  78   0.824  14.496  -9.614
  577   2HB   ALA  78          3HB       ALA  78  -0.037  12.977  -9.297
  578   3HB   ALA  78          2HB       ALA  78  -0.004  14.252  -8.067
  579    H    MET  79           HN       MET  79   0.526  13.371  -6.071
  580    HA   MET  79           HA       MET  79   0.649  10.497  -5.425
  581   1HB   MET  79          2HB       MET  79   1.403  12.731  -3.481
  582   2HB   MET  79          1HB       MET  79   1.297  11.016  -3.104
  583   1HG   MET  79          2HG       MET  79   3.554  11.328  -3.343
  584   2HG   MET  79          1HG       MET  79   3.073  10.610  -4.874
  585   1HE   MET  79          3HE       MET  79   3.893  14.003  -3.043
  586   2HE   MET  79          1HE       MET  79   4.259  15.070  -4.415
  587   3HE   MET  79          2HE       MET  79   2.585  14.565  -4.119
  588    HA   PRO  80           HA       PRO  80  -0.098   9.382  -3.618
  589   1HB   PRO  80          2HB       PRO  80  -2.096   7.717  -2.932
  590   2HB   PRO  80          1HB       PRO  80  -1.533   9.033  -1.863
  591   1HG   PRO  80          1HG       PRO  80  -3.938   9.042  -3.677
  592   2HG   PRO  80          2HG       PRO  80  -3.788   9.611  -1.979
  593   1HD   PRO  80          1HD       PRO  80  -3.670  11.258  -4.209
  594   2HD   PRO  80          2HD       PRO  80  -2.873  11.647  -2.669
  595    H    THR  81           HN       THR  81   0.424   7.667  -4.911
  596    HA   THR  81           HA       THR  81  -1.118   7.289  -7.449
  597    HB   THR  81           HB       THR  81   1.853   7.253  -6.858
  598    HG1  THR  81           HG1      THR  81   1.259   9.231  -7.577
  599   1HG2  THR  81          3HG23     THR  81   0.347   6.116  -9.257
  600   2HG2  THR  81          1HG21     THR  81   2.064   6.559  -9.289
  601   3HG2  THR  81          2HG22     THR  81   1.505   5.292  -8.180
  602    H    PHE  82           HN       PHE  82  -1.766   5.252  -7.916
  603    HA   PHE  82           HA       PHE  82  -1.221   3.135  -5.876
  604   1HB   PHE  82          2HB       PHE  82  -3.760   3.963  -7.291
  605   2HB   PHE  82          1HB       PHE  82  -3.574   2.383  -6.551
  606    HD1  PHE  82           HD2      PHE  82  -2.885   2.244  -4.086
  607    HD2  PHE  82           HD1      PHE  82  -4.276   5.911  -5.895
  608    HE1  PHE  82           HE2      PHE  82  -3.403   3.170  -1.853
  609    HE2  PHE  82           HE1      PHE  82  -4.730   6.838  -3.654
  610    HZ   PHE  82           HZ       PHE  82  -4.173   5.482  -1.606
  611    H    HIS  83           HN       HIS  83  -0.029   1.566  -6.769
  612    HA   HIS  83           HA       HIS  83  -0.472   0.855  -9.663
  613   1HB   HIS  83          2HB       HIS  83   1.905   0.299  -7.938
  614   2HB   HIS  83          1HB       HIS  83   1.677  -0.286  -9.582
  615    HD2  HIS  83           HD2      HIS  83   0.873   3.402  -9.269
  616    HE1  HIS  83           HE1      HIS  83   4.844   3.083 -10.685
  617    HE2  HIS  83           HE2      HIS  83   2.863   4.684 -10.425
  618    H    VAL  84           HN       VAL  84  -0.636  -1.340 -10.114
  619    HA   VAL  84           HA       VAL  84  -0.925  -3.220  -7.827
  620    HB   VAL  84           HB       VAL  84  -2.773  -2.537 -10.011
  621   1HG1  VAL  84          2HG12     VAL  84  -2.015  -5.365 -10.083
  622   2HG1  VAL  84          3HG13     VAL  84  -3.515  -4.611 -10.694
  623   3HG1  VAL  84          1HG11     VAL  84  -1.987  -4.038 -11.314
  624   1HG2  VAL  84          2HG22     VAL  84  -3.278  -2.850  -7.529
  625   2HG2  VAL  84          1HG21     VAL  84  -4.315  -3.847  -8.574
  626   3HG2  VAL  84          3HG23     VAL  84  -2.923  -4.586  -7.747
  627    H    TYR  85           HN       TYR  85   0.272  -5.144  -8.038
  628    HA   TYR  85           HA       TYR  85   1.722  -5.475 -10.621
  629   1HB   TYR  85          1HB       TYR  85   3.019  -5.323  -7.880
  630   2HB   TYR  85          2HB       TYR  85   3.811  -6.028  -9.281
  631    HD1  TYR  85           HD2      TYR  85   2.542  -2.858  -7.819
  632    HD2  TYR  85           HD1      TYR  85   5.090  -4.751 -10.729
  633    HE1  TYR  85           HE2      TYR  85   3.816  -0.748  -8.129
  634    HE2  TYR  85           HE1      TYR  85   6.174  -2.574 -11.203
  635    HH   TYR  85           HH       TYR  85   4.974   0.440  -9.806
  636    H    LYS  86           HN       LYS  86   0.072  -7.203 -10.882
  637    HA   LYS  86           HA       LYS  86   0.411  -9.566  -9.160
  638   1HB   LYS  86          2HB       LYS  86  -0.936  -9.324 -11.889
  639   2HB   LYS  86          1HB       LYS  86  -0.942 -10.730 -10.811
  640   1HG   LYS  86          1HG       LYS  86  -1.906  -9.077  -9.015
  641   2HG   LYS  86          2HG       LYS  86  -2.216  -8.022 -10.393
  642   1HD   LYS  86          1HD       LYS  86  -4.246  -9.187 -10.036
  643   2HD   LYS  86          2HD       LYS  86  -3.530  -9.997 -11.432
  644   1HE   LYS  86          1HE       LYS  86  -2.783 -11.861 -10.000
  645   2HE   LYS  86          2HE       LYS  86  -3.252 -10.968  -8.539
  646   1HZ   LYS  86          3HZ       LYS  86  -5.524 -11.062  -9.297
  647   2HZ   LYS  86          1HZ       LYS  86  -5.094 -11.984 -10.595
  648   3HZ   LYS  86          2HZ       LYS  86  -4.885 -12.558  -9.078
  649    H    ASP  87           HN       ASP  87   1.465 -11.428  -9.819
  650    HA   ASP  87           HA       ASP  87   3.086 -12.782 -10.609
  651   1HB   ASP  87          2HB       ASP  87   2.305 -12.358 -12.901
  652   2HB   ASP  87          1HB       ASP  87   3.279 -10.896 -13.024
  653    H    GLY  88           HN       GLY  88   3.975  -9.553 -11.526
  654   1HA   GLY  88          1HA       GLY  88   5.529  -8.547  -9.556
  655   2HA   GLY  88          2HA       GLY  88   6.679  -9.647 -10.351
  656    H    VAL  89           HN       VAL  89   4.047  -7.786 -11.979
  657    HA   VAL  89           HA       VAL  89   6.002  -5.948 -13.202
  658    HB   VAL  89           HB       VAL  89   4.061  -7.721 -14.772
  659   1HG1  VAL  89          1HG21     VAL  89   6.037  -5.594 -15.709
  660   2HG1  VAL  89          3HG23     VAL  89   5.135  -6.690 -16.772
  661   3HG1  VAL  89          2HG22     VAL  89   4.262  -5.501 -15.804
  662   1HG2  VAL  89          2HG12     VAL  89   7.108  -7.763 -14.673
  663   2HG2  VAL  89          3HG13     VAL  89   6.010  -9.058 -14.144
  664   3HG2  VAL  89          1HG11     VAL  89   6.116  -8.642 -15.854
  665    H    LYS  90           HN       LYS  90   4.967  -3.974 -13.729
  666    HA   LYS  90           HA       LYS  90   2.750  -3.214 -12.180
  667   1HB   LYS  90          1HB       LYS  90   4.557  -1.766 -13.240
  668   2HB   LYS  90          2HB       LYS  90   3.628  -1.833 -14.748
  669   1HG   LYS  90          1HG       LYS  90   1.640  -0.924 -13.442
  670   2HG   LYS  90          2HG       LYS  90   2.695  -0.768 -12.033
  671   1HD   LYS  90          1HD       LYS  90   2.989   0.691 -14.702
  672   2HD   LYS  90          2HD       LYS  90   2.441   1.373 -13.167
  673   1HE   LYS  90          2HE       LYS  90   4.705   0.802 -12.189
  674   2HE   LYS  90          1HE       LYS  90   5.247   0.365 -13.816
  675   1HZ   LYS  90          1HZ       LYS  90   4.167   2.986 -13.066
  676   2HZ   LYS  90          2HZ       LYS  90   5.769   2.633 -13.181
  677   3HZ   LYS  90          3HZ       LYS  90   4.808   2.569 -14.524
  678    H    ALA  91           HN       ALA  91   0.902  -4.258 -12.348
  679    HA   ALA  91           HA       ALA  91  -0.157  -5.398 -14.825
  680   1HB   ALA  91          1HB       ALA  91  -0.641  -5.533 -11.897
  681   2HB   ALA  91          2HB       ALA  91  -2.119  -5.654 -12.873
  682   3HB   ALA  91          3HB       ALA  91  -0.780  -6.797 -13.104
  683    H    ASP  92           HN       ASP  92  -0.900  -2.721 -12.638
  684    HA   ASP  92           HA       ASP  92  -2.556  -1.353 -14.575
  685   1HB   ASP  92          2HB       ASP  92  -4.007  -3.171 -13.421
  686   2HB   ASP  92          1HB       ASP  92  -3.832  -2.233 -11.940
  687    H    ASP  93           HN       ASP  93  -3.201   0.803 -13.524
  688    HA   ASP  93           HA       ASP  93  -1.907   1.487 -11.103
  689   1HB   ASP  93          1HB       ASP  93   0.111   1.454 -12.413
  690   2HB   ASP  93          2HB       ASP  93  -0.660   2.339 -13.752
  691    H    LEU  94           HN       LEU  94  -2.095   3.884 -10.843
  692    HA   LEU  94           HA       LEU  94  -3.605   5.601 -12.472
  693   1HB   LEU  94          1HB       LEU  94  -5.706   5.890 -11.310
  694   2HB   LEU  94          2HB       LEU  94  -5.544   4.233 -11.857
  695    HG   LEU  94           HG       LEU  94  -4.686   3.767  -9.395
  696   1HD1  LEU  94          1HD11     LEU  94  -6.335   6.337  -9.048
  697   2HD1  LEU  94          3HD13     LEU  94  -5.972   5.196  -7.745
  698   3HD1  LEU  94          2HD12     LEU  94  -4.668   6.103  -8.496
  699   1HD2  LEU  94          1HD21     LEU  94  -7.569   4.390 -10.101
  700   2HD2  LEU  94          2HD22     LEU  94  -6.720   2.868 -10.439
  701   3HD2  LEU  94          3HD23     LEU  94  -7.044   3.343  -8.760
  702    H    VAL  95           HN       VAL  95  -3.928   7.740 -11.435
  703    HA   VAL  95           HA       VAL  95  -2.228   8.168  -9.053
  704    HB   VAL  95           HB       VAL  95  -2.445   9.877 -11.547
  705   1HG1  VAL  95          2HG12     VAL  95  -0.769  10.192  -9.036
  706   2HG1  VAL  95          1HG11     VAL  95  -0.544  11.119 -10.535
  707   3HG1  VAL  95          3HG13     VAL  95  -2.053  11.270  -9.620
  708   1HG2  VAL  95          3HG23     VAL  95  -0.140   8.119 -10.582
  709   2HG2  VAL  95          2HG22     VAL  95  -1.100   7.863 -12.053
  710   3HG2  VAL  95          1HG21     VAL  95  -0.044   9.273 -11.925
  711    H    GLY  96           HN       GLY  96  -3.286   9.319  -7.472
  712   1HA   GLY  96          1HA       GLY  96  -4.584  11.463  -7.247
  713   2HA   GLY  96          2HA       GLY  96  -5.860  10.671  -8.191
  714    H    ALA  97           HN       ALA  97  -6.325  11.622  -5.628
  715    HA   ALA  97           HA       ALA  97  -6.257   9.493  -3.639
  716   1HB   ALA  97          1HB       ALA  97  -6.127  11.895  -3.068
  717   2HB   ALA  97          3HB       ALA  97  -7.726  12.166  -3.794
  718   3HB   ALA  97          2HB       ALA  97  -7.569  11.175  -2.340
  719    H    SER  98           HN       SER  98  -7.475   8.549  -6.063
  720    HA   SER  98           HA       SER  98 -10.369   8.729  -5.866
  721   1HB   SER  98          1HB       SER  98  -8.678   6.884  -7.596
  722   2HB   SER  98          2HB       SER  98 -10.321   7.505  -7.894
  723    HG   SER  98           HG       SER  98  -9.370   9.606  -8.025
  724    H    GLN  99           HN       GLN  99 -10.196   7.948  -3.552
  725    HA   GLN  99           HA       GLN  99  -9.556   5.425  -2.677
  726   1HB   GLN  99          1HB       GLN  99 -10.470   7.379  -1.342
  727   2HB   GLN  99          2HB       GLN  99 -12.081   6.972  -1.922
  728   1HG   GLN  99          1HG       GLN  99 -11.699   6.111   0.348
  729   2HG   GLN  99          2HG       GLN  99 -11.998   4.795  -0.789
  730   1HE2  GLN  99          2HE22     GLN  99  -8.030   5.195   0.292
  731   2HE2  GLN  99          1HE21     GLN  99  -8.904   6.614  -0.263
  732    H    ASP 100           HN       ASP 100 -12.486   6.307  -4.484
  733    HA   ASP 100           HA       ASP 100 -13.898   3.813  -4.244
  734   1HB   ASP 100          2HB       ASP 100 -15.195   4.675  -6.125
  735   2HB   ASP 100          1HB       ASP 100 -14.954   5.959  -4.936
  736    H    LYS 101           HN       LYS 101 -11.615   5.166  -6.640
  737    HA   LYS 101           HA       LYS 101 -11.766   2.908  -8.392
  738   1HB   LYS 101          1HB       LYS 101 -10.804   5.446  -8.629
  739   2HB   LYS 101          2HB       LYS 101  -9.279   4.574  -8.426
  740   1HG   LYS 101          1HG       LYS 101 -11.495   4.166 -10.458
  741   2HG   LYS 101          2HG       LYS 101  -9.877   4.807 -10.784
  742   1HD   LYS 101          1HD       LYS 101  -9.036   2.452  -9.963
  743   2HD   LYS 101          2HD       LYS 101 -10.697   1.927 -10.184
  744   1HE   LYS 101          1HE       LYS 101  -8.913   3.151 -12.333
  745   2HE   LYS 101          2HE       LYS 101  -9.341   1.442 -12.169
  746   1HZ   LYS 101          1HZ       LYS 101 -11.631   2.039 -12.507
  747   2HZ   LYS 101          3HZ       LYS 101 -11.231   3.631 -12.677
  748   3HZ   LYS 101          2HZ       LYS 101 -10.703   2.526 -13.779
  749    H    LEU 102           HN       LEU 102  -9.584   3.866  -5.764
  750    HA   LEU 102           HA       LEU 102  -7.683   1.769  -5.856
  751   1HB   LEU 102          2HB       LEU 102  -7.418   3.545  -4.264
  752   2HB   LEU 102          1HB       LEU 102  -8.966   3.245  -3.534
  753    HG   LEU 102           HG       LEU 102  -8.229   1.128  -2.569
  754   1HD1  LEU 102          1HD21     LEU 102  -5.547   1.797  -3.840
  755   2HD1  LEU 102          3HD23     LEU 102  -5.800   0.548  -2.600
  756   3HD1  LEU 102          2HD22     LEU 102  -6.549   0.382  -4.193
  757   1HD2  LEU 102          2HD12     LEU 102  -7.981   3.334  -1.421
  758   2HD2  LEU 102          3HD13     LEU 102  -6.888   2.076  -0.853
  759   3HD2  LEU 102          1HD11     LEU 102  -6.285   3.364  -1.930
  760    H    LYS 103           HN       LYS 103 -10.677   1.921  -3.941
  761    HA   LYS 103           HA       LYS 103 -10.816  -0.731  -3.074
  762   1HB   LYS 103          2HB       LYS 103 -12.323   1.331  -2.619
  763   2HB   LYS 103          1HB       LYS 103 -13.289   0.813  -3.989
  764   1HG   LYS 103          2HG       LYS 103 -12.649  -0.914  -1.545
  765   2HG   LYS 103          1HG       LYS 103 -14.089   0.104  -1.712
  766   1HD   LYS 103          1HD       LYS 103 -14.669  -1.133  -3.826
  767   2HD   LYS 103          2HD       LYS 103 -13.368  -2.285  -3.463
  768   1HE   LYS 103          2HE       LYS 103 -15.752  -1.723  -1.647
  769   2HE   LYS 103          1HE       LYS 103 -15.555  -3.129  -2.705
  770   1HZ   LYS 103          2HZ       LYS 103 -13.581  -3.701  -1.480
  771   2HZ   LYS 103          3HZ       LYS 103 -13.809  -2.434  -0.452
  772   3HZ   LYS 103          1HZ       LYS 103 -14.907  -3.659  -0.500
  773    H    ALA 104           HN       ALA 104 -12.193   0.624  -6.092
  774    HA   ALA 104           HA       ALA 104 -13.088  -1.791  -7.229
  775   1HB   ALA 104          1HB       ALA 104 -13.629   0.479  -8.090
  776   2HB   ALA 104          3HB       ALA 104 -11.981   0.603  -8.740
  777   3HB   ALA 104          2HB       ALA 104 -13.079  -0.637  -9.357
  778    H    LEU 105           HN       LEU 105  -9.738  -0.390  -7.361
  779    HA   LEU 105           HA       LEU 105  -8.696  -2.306  -9.215
  780   1HB   LEU 105          2HB       LEU 105  -7.317  -0.818  -6.931
  781   2HB   LEU 105          1HB       LEU 105  -6.492  -1.918  -8.006
  782    HG   LEU 105           HG       LEU 105  -7.838   0.637  -8.931
  783   1HD1  LEU 105          2HD22     LEU 105  -4.931  -0.098  -8.322
  784   2HD1  LEU 105          3HD23     LEU 105  -5.430   1.388  -9.135
  785   3HD1  LEU 105          1HD21     LEU 105  -5.924   1.094  -7.460
  786   1HD2  LEU 105          3HD13     LEU 105  -5.959  -1.322 -10.333
  787   2HD2  LEU 105          1HD11     LEU 105  -7.666  -1.034 -10.753
  788   3HD2  LEU 105          2HD12     LEU 105  -6.471   0.248 -10.978
  789    H    VAL 106           HN       VAL 106  -8.865  -2.268  -5.605
  790    HA   VAL 106           HA       VAL 106  -7.536  -4.768  -5.304
  791    HB   VAL 106           HB       VAL 106  -9.731  -3.702  -3.474
  792   1HG1  VAL 106          1HG21     VAL 106  -7.351  -5.584  -3.060
  793   2HG1  VAL 106          3HG23     VAL 106  -8.418  -5.011  -1.769
  794   3HG1  VAL 106          2HG22     VAL 106  -9.052  -6.058  -3.049
  795   1HG2  VAL 106          2HG12     VAL 106  -7.865  -1.993  -3.832
  796   2HG2  VAL 106          3HG13     VAL 106  -8.047  -2.579  -2.190
  797   3HG2  VAL 106          1HG11     VAL 106  -6.737  -3.202  -3.213
  798    H    ALA 107           HN       ALA 107 -11.017  -4.037  -5.566
  799    HA   ALA 107           HA       ALA 107 -11.983  -6.711  -5.474
  800   1HB   ALA 107          1HB       ALA 107 -13.445  -4.723  -5.367
  801   2HB   ALA 107          3HB       ALA 107 -13.093  -4.350  -7.066
  802   3HB   ALA 107          2HB       ALA 107 -13.967  -5.835  -6.647
  803    H    LYS 108           HN       LYS 108 -11.251  -4.753  -8.382
  804    HA   LYS 108           HA       LYS 108 -11.600  -6.554 -10.488
  805   1HB   LYS 108          2HB       LYS 108 -11.158  -4.230 -10.821
  806   2HB   LYS 108          1HB       LYS 108  -9.558  -4.353 -10.072
  807   1HG   LYS 108          2HG       LYS 108  -8.785  -5.856 -11.848
  808   2HG   LYS 108          1HG       LYS 108 -10.397  -5.844 -12.576
  809   1HD   LYS 108          1HD       LYS 108 -10.141  -3.382 -12.996
  810   2HD   LYS 108          2HD       LYS 108  -8.548  -3.440 -12.240
  811   1HE   LYS 108          1HE       LYS 108  -8.015  -5.321 -13.920
  812   2HE   LYS 108          2HE       LYS 108  -9.511  -4.887 -14.748
  813   1HZ   LYS 108          3HZ       LYS 108  -7.278  -3.019 -14.257
  814   2HZ   LYS 108          1HZ       LYS 108  -7.587  -3.778 -15.690
  815   3HZ   LYS 108          2HZ       LYS 108  -8.663  -2.689 -15.082
  816    H    HIS 109           HN       HIS 109  -8.492  -5.903  -8.828
  817    HA   HIS 109           HA       HIS 109  -7.233  -8.083 -10.265
  818   1HB   HIS 109          1HB       HIS 109  -6.265  -6.151  -8.130
  819   2HB   HIS 109          2HB       HIS 109  -5.235  -7.326  -8.954
  820    HD2  HIS 109           HD2      HIS 109  -6.788  -3.846  -9.641
  821    HE1  HIS 109           HE1      HIS 109  -5.421  -5.246 -13.348
  822    HE2  HIS 109           HE2      HIS 109  -6.257  -3.215 -12.117
  823    H    ALA 110           HN       ALA 110  -8.840  -7.900  -7.114
  824    HA   ALA 110           HA       ALA 110  -7.681 -10.386  -6.147
  825   1HB   ALA 110          2HB       ALA 110 -10.345  -9.038  -5.508
  826   2HB   ALA 110          3HB       ALA 110  -9.636 -10.413  -4.642
  827   3HB   ALA 110          1HB       ALA 110  -8.823  -8.839  -4.609
  828    H    ALA 111           HN       ALA 111 -10.643  -9.462  -7.978
  829    HA   ALA 111           HA       ALA 111 -11.380 -12.268  -8.474
  830   1HB   ALA 111          1HB       ALA 111 -13.087 -10.519  -8.089
  831   2HB   ALA 111          3HB       ALA 111 -12.514  -9.639  -9.523
  832   3HB   ALA 111          2HB       ALA 111 -13.250 -11.247  -9.700
  833    H    ALA 112           HN       ALA 112  -8.911 -12.316  -9.366
  834    HA   ALA 112           HA       ALA 112  -9.037 -12.664 -12.186
  835   1HB   ALA 112          1HB       ALA 112  -8.707 -10.177 -12.183
  836   2HB   ALA 112          3HB       ALA 112  -7.280 -10.389 -11.143
  837   3HB   ALA 112          2HB       ALA 112  -7.281 -11.031 -12.797
   
  No H/Q in entry =         837
  Start of MODEL    9
    1   1H    GLY   1          1HN       GLY   1  -0.515  -9.726   3.731
    2   2H    GLY   1          2HN       GLY   1  -1.494 -10.982   3.931
    3   3H    GLY   1          3HN       GLY   1  -1.527  -9.866   5.065
    4   1HA   GLY   1          1HA       GLY   1  -0.380 -11.825   5.847
    5   2HA   GLY   1          2HA       GLY   1   0.643 -11.764   4.400
    6    H    GLY   2           HN       GLY   2  -0.154  -9.967   7.426
    7   1HA   GLY   2          1HA       GLY   2   1.242  -8.865   8.868
    8   2HA   GLY   2          2HA       GLY   2   2.637  -9.365   7.895
    9    H    SER   3           HN       SER   3   2.488  -8.249   5.529
   10    HA   SER   3           HA       SER   3   2.818  -5.405   5.943
   11   1HB   SER   3          2HB       SER   3   3.225  -5.725   3.350
   12   2HB   SER   3          1HB       SER   3   4.380  -6.324   4.545
   13    HG   SER   3           HG       SER   3   3.953  -8.307   4.023
   14    H    VAL   4           HN       VAL   4   0.443  -5.452   6.731
   15    HA   VAL   4           HA       VAL   4  -1.209  -4.203   4.635
   16    HB   VAL   4           HB       VAL   4  -3.125  -5.271   6.034
   17   1HG1  VAL   4          2HG12     VAL   4  -2.657  -5.938   3.705
   18   2HG1  VAL   4          1HG11     VAL   4  -1.465  -7.123   4.281
   19   3HG1  VAL   4          3HG13     VAL   4  -3.183  -7.307   4.689
   20   1HG2  VAL   4          1HG21     VAL   4  -1.631  -6.070   7.874
   21   2HG2  VAL   4          2HG22     VAL   4  -2.740  -7.285   7.222
   22   3HG2  VAL   4          3HG23     VAL   4  -1.031  -7.324   6.764
   23    H    ILE   5           HN       ILE   5   0.703  -3.161   6.434
   24    HA   ILE   5           HA       ILE   5  -0.877  -1.434   8.244
   25    HB   ILE   5           HB       ILE   5   0.829  -1.770  10.022
   26   1HG1  ILE   5          1HG11     ILE   5   1.926  -3.997   8.239
   27   2HG1  ILE   5          2HG12     ILE   5   2.730  -2.465   8.597
   28   1HG2  ILE   5          3HG23     ILE   5  -1.318  -3.125   9.897
   29   2HG2  ILE   5          2HG22     ILE   5  -0.352  -4.462   9.236
   30   3HG2  ILE   5          1HG21     ILE   5  -0.025  -3.838  10.863
   31   1HD1  ILE   5          2HD12     ILE   5   2.732  -3.065  11.026
   32   2HD1  ILE   5          1HD11     ILE   5   2.095  -4.670  10.585
   33   3HD1  ILE   5          3HD13     ILE   5   3.680  -4.154   9.993
   34    H    VAL   6           HN       VAL   6   1.102   0.110   9.239
   35    HA   VAL   6           HA       VAL   6   2.143   1.532   6.917
   36    HB   VAL   6           HB       VAL   6   2.584   2.032   9.896
   37   1HG1  VAL   6          2HG22     VAL   6   4.195   3.227   8.407
   38   2HG1  VAL   6          1HG21     VAL   6   2.836   3.876   7.471
   39   3HG1  VAL   6          3HG23     VAL   6   3.059   4.347   9.167
   40   1HG2  VAL   6          2HG12     VAL   6   0.462   3.199   8.045
   41   2HG2  VAL   6          1HG11     VAL   6   0.157   2.091   9.399
   42   3HG2  VAL   6          3HG13     VAL   6   0.788   3.710   9.710
   43    H    ILE   7           HN       ILE   7   3.252  -0.434   6.241
   44    HA   ILE   7           HA       ILE   7   5.504  -1.451   7.732
   45    HB   ILE   7           HB       ILE   7   4.007  -2.794   6.255
   46   1HG1  ILE   7          1HG11     ILE   7   5.774  -4.052   5.006
   47   2HG1  ILE   7          2HG12     ILE   7   6.943  -2.797   5.437
   48   1HG2  ILE   7          2HG22     ILE   7   3.746  -1.096   4.404
   49   2HG2  ILE   7          1HG21     ILE   7   5.419  -1.426   3.911
   50   3HG2  ILE   7          3HG23     ILE   7   4.198  -2.706   3.841
   51   1HD1  ILE   7          3HD13     ILE   7   5.357  -4.490   7.429
   52   2HD1  ILE   7          2HD12     ILE   7   7.015  -4.830   6.903
   53   3HD1  ILE   7          1HD11     ILE   7   6.675  -3.362   7.829
   54    H    ASP   8           HN       ASP   8   7.738  -1.232   7.223
   55    HA   ASP   8           HA       ASP   8   8.384   1.439   6.260
   56   1HB   ASP   8          1HB       ASP   8   9.411   0.509   8.329
   57   2HB   ASP   8          2HB       ASP   8  10.158  -0.790   7.379
   58    H    SER   9           HN       SER   9   7.466   0.641   4.197
   59    HA   SER   9           HA       SER   9   7.838   0.075   1.889
   60   1HB   SER   9          2HB       SER   9   8.155   2.483   2.422
   61   2HB   SER   9          1HB       SER   9   9.870   2.191   2.659
   62    HG   SER   9           HG       SER   9   8.359   1.810   0.263
   63    H    LYS  10           HN       LYS  10  10.776   0.947   1.275
   64    HA   LYS  10           HA       LYS  10  11.813  -0.975  -0.065
   65   1HB   LYS  10          2HB       LYS  10  13.910   0.002   0.236
   66   2HB   LYS  10          1HB       LYS  10  12.648   1.263   0.387
   67   1HG   LYS  10          2HG       LYS  10  14.344   0.057   2.641
   68   2HG   LYS  10          1HG       LYS  10  14.623   1.579   1.826
   69   1HD   LYS  10          2HD       LYS  10  12.616   2.580   2.713
   70   2HD   LYS  10          1HD       LYS  10  12.079   1.059   3.425
   71   1HE   LYS  10          1HE       LYS  10  13.011   2.459   5.139
   72   2HE   LYS  10          2HE       LYS  10  13.992   1.004   4.938
   73   1HZ   LYS  10          3HZ       LYS  10  14.607   3.657   3.820
   74   2HZ   LYS  10          1HZ       LYS  10  15.312   2.983   5.149
   75   3HZ   LYS  10          2HZ       LYS  10  15.544   2.306   3.666
   76    H    ALA  11           HN       ALA  11  12.439  -0.918   3.433
   77    HA   ALA  11           HA       ALA  11  14.138  -3.194   3.535
   78   1HB   ALA  11          2HB       ALA  11  13.862  -1.591   5.414
   79   2HB   ALA  11          1HB       ALA  11  12.195  -2.153   5.659
   80   3HB   ALA  11          3HB       ALA  11  13.556  -3.256   5.946
   81    H    ALA  12           HN       ALA  12  10.601  -2.938   3.546
   82    HA   ALA  12           HA       ALA  12  10.259  -5.851   3.998
   83   1HB   ALA  12          2HB       ALA  12   8.796  -4.253   5.143
   84   2HB   ALA  12          3HB       ALA  12   8.257  -3.596   3.578
   85   3HB   ALA  12          1HB       ALA  12   7.870  -5.268   4.021
   86    H    TRP  13           HN       TRP  13   9.853  -3.378   1.522
   87    HA   TRP  13           HA       TRP  13   8.382  -4.272  -0.474
   88   1HB   TRP  13          1HB       TRP  13   9.676  -2.200  -0.493
   89   2HB   TRP  13          2HB       TRP  13  11.173  -3.105  -0.720
   90    HD1  TRP  13           HD1      TRP  13  11.846  -3.839  -3.100
   91    HE1  TRP  13           HE1      TRP  13  10.978  -3.315  -5.466
   92    HE3  TRP  13           HE3      TRP  13   7.511  -1.422  -1.870
   93    HZ2  TRP  13           HZ2      TRP  13   8.751  -2.036  -6.649
   94    HZ3  TRP  13           HZ3      TRP  13   6.066  -0.502  -3.649
   95    HH2  TRP  13           HH2      TRP  13   6.649  -0.816  -6.045
   96    H    ASP  14           HN       ASP  14  11.877  -5.198  -0.495
   97    HA   ASP  14           HA       ASP  14  11.632  -6.925  -2.734
   98   1HB   ASP  14          1HB       ASP  14  13.736  -6.024  -1.888
   99   2HB   ASP  14          2HB       ASP  14  13.647  -7.013  -0.433
  100    H    ALA  15           HN       ALA  15  11.904  -7.759   0.675
  101    HA   ALA  15           HA       ALA  15  11.576 -10.541   0.507
  102   1HB   ALA  15          3HB       ALA  15  10.600  -8.682   2.730
  103   2HB   ALA  15          1HB       ALA  15  10.821 -10.439   2.863
  104   3HB   ALA  15          2HB       ALA  15  12.222  -9.387   2.585
  105    H    GLN  16           HN       GLN  16   9.089  -8.062   0.939
  106    HA   GLN  16           HA       GLN  16   6.807  -9.756   1.023
  107   1HB   GLN  16          2HB       GLN  16   7.352  -6.829   0.700
  108   2HB   GLN  16          1HB       GLN  16   5.920  -7.375  -0.134
  109   1HG   GLN  16          2HG       GLN  16   5.422  -6.591   2.137
  110   2HG   GLN  16          1HG       GLN  16   4.904  -8.240   1.793
  111   1HE2  GLN  16          2HE22     GLN  16   8.210  -8.170   4.231
  112   2HE2  GLN  16          1HE21     GLN  16   8.305  -7.391   2.661
  113    H    LEU  17           HN       LEU  17   8.217  -7.905  -1.696
  114    HA   LEU  17           HA       LEU  17   6.527  -8.609  -3.758
  115   1HB   LEU  17          1HB       LEU  17   8.298  -6.965  -3.905
  116   2HB   LEU  17          2HB       LEU  17   9.559  -8.172  -3.738
  117    HG   LEU  17           HG       LEU  17   9.328  -7.243  -5.971
  118   1HD1  LEU  17          3HD13     LEU  17  10.235  -9.570  -5.615
  119   2HD1  LEU  17          2HD12     LEU  17   8.661 -10.192  -6.170
  120   3HD1  LEU  17          1HD11     LEU  17   9.639  -9.193  -7.240
  121   1HD2  LEU  17          2HD22     LEU  17   6.896  -6.900  -6.030
  122   2HD2  LEU  17          3HD23     LEU  17   7.473  -7.793  -7.451
  123   3HD2  LEU  17          1HD21     LEU  17   6.653  -8.661  -6.142
  124    H    ALA  18           HN       ALA  18   9.350 -10.501  -2.540
  125    HA   ALA  18           HA       ALA  18   8.833 -12.601  -4.534
  126   1HB   ALA  18          1HB       ALA  18  10.748 -12.453  -2.157
  127   2HB   ALA  18          2HB       ALA  18  10.739 -13.716  -3.409
  128   3HB   ALA  18          3HB       ALA  18  11.120 -12.036  -3.842
  129    H    LYS  19           HN       LYS  19   8.822 -12.575  -0.918
  130    HA   LYS  19           HA       LYS  19   7.831 -15.208  -0.655
  131   1HB   LYS  19          1HB       LYS  19   7.624 -14.711   1.643
  132   2HB   LYS  19          2HB       LYS  19   8.986 -13.758   1.070
  133   1HG   LYS  19          2HG       LYS  19   7.996 -12.026   2.112
  134   2HG   LYS  19          1HG       LYS  19   6.869 -11.981   0.774
  135   1HD   LYS  19          2HD       LYS  19   5.398 -13.666   2.053
  136   2HD   LYS  19          1HD       LYS  19   6.534 -13.509   3.400
  137   1HE   LYS  19          2HE       LYS  19   4.689 -12.064   3.877
  138   2HE   LYS  19          1HE       LYS  19   6.059 -11.035   3.439
  139   1HZ   LYS  19          1HZ       LYS  19   5.083 -10.877   1.221
  140   2HZ   LYS  19          3HZ       LYS  19   3.821 -11.820   1.692
  141   3HZ   LYS  19          2HZ       LYS  19   4.040 -10.340   2.381
  142    H    GLY  20           HN       GLY  20   6.150 -12.195  -1.336
  143   1HA   GLY  20          1HA       GLY  20   3.549 -12.800  -0.528
  144   2HA   GLY  20          2HA       GLY  20   4.024 -11.736  -1.867
  145    H    LYS  21           HN       LYS  21   5.402 -14.034  -3.348
  146    HA   LYS  21           HA       LYS  21   4.755 -15.292  -5.165
  147   1HB   LYS  21          1HB       LYS  21   2.975 -16.501  -3.005
  148   2HB   LYS  21          2HB       LYS  21   3.293 -17.240  -4.584
  149   1HG   LYS  21          1HG       LYS  21   5.713 -17.261  -4.128
  150   2HG   LYS  21          2HG       LYS  21   5.457 -16.555  -2.536
  151   1HD   LYS  21          2HD       LYS  21   4.353 -19.241  -3.495
  152   2HD   LYS  21          1HD       LYS  21   5.802 -19.038  -2.506
  153   1HE   LYS  21          1HE       LYS  21   2.958 -18.305  -1.666
  154   2HE   LYS  21          2HE       LYS  21   3.892 -19.700  -1.124
  155   1HZ   LYS  21          2HZ       LYS  21   5.481 -18.204  -0.158
  156   2HZ   LYS  21          3HZ       LYS  21   4.607 -16.890  -0.626
  157   3HZ   LYS  21          1HZ       LYS  21   3.978 -17.952   0.464
  158    H    GLU  22           HN       GLU  22   3.948 -13.118  -5.671
  159    HA   GLU  22           HA       GLU  22   1.294 -12.246  -5.487
  160   1HB   GLU  22          1HB       GLU  22   2.088 -10.453  -6.924
  161   2HB   GLU  22          2HB       GLU  22   3.291 -10.842  -5.701
  162   1HG   GLU  22          2HG       GLU  22   3.578 -12.174  -8.394
  163   2HG   GLU  22          1HG       GLU  22   3.903 -10.445  -8.269
  164    H    GLU  23           HN       GLU  23   1.378 -14.928  -6.918
  165    HA   GLU  23           HA       GLU  23   0.562 -14.304  -9.684
  166   1HB   GLU  23          1HB       GLU  23   0.647 -16.933  -8.122
  167   2HB   GLU  23          2HB       GLU  23   0.211 -16.742  -9.826
  168   1HG   GLU  23          1HG       GLU  23   2.501 -17.420  -9.768
  169   2HG   GLU  23          2HG       GLU  23   2.479 -15.722 -10.254
  170    H    HIS  24           HN       HIS  24  -0.932 -15.899  -6.836
  171    HA   HIS  24           HA       HIS  24  -3.622 -14.868  -7.665
  172   1HB   HIS  24          2HB       HIS  24  -3.454 -17.311  -7.818
  173   2HB   HIS  24          1HB       HIS  24  -2.840 -17.392  -6.161
  174    HD2  HIS  24           HD2      HIS  24  -5.882 -15.039  -6.614
  175    HE1  HIS  24           HE1      HIS  24  -7.132 -18.528  -4.592
  176    HE2  HIS  24           HE2      HIS  24  -7.733 -16.098  -5.115
  177    H    LYS  25           HN       LYS  25  -1.607 -13.323  -6.277
  178    HA   LYS  25           HA       LYS  25  -3.085 -12.803  -3.780
  179   1HB   LYS  25          2HB       LYS  25  -0.119 -13.360  -3.925
  180   2HB   LYS  25          1HB       LYS  25  -0.899 -12.511  -2.578
  181   1HG   LYS  25          1HG       LYS  25  -2.354 -14.429  -2.141
  182   2HG   LYS  25          2HG       LYS  25  -1.652 -15.323  -3.502
  183   1HD   LYS  25          2HD       LYS  25   0.477 -15.461  -2.524
  184   2HD   LYS  25          1HD       LYS  25   0.026 -14.416  -1.155
  185   1HE   LYS  25          2HE       LYS  25  -1.581 -16.105  -0.368
  186   2HE   LYS  25          1HE       LYS  25  -1.316 -17.081  -1.826
  187   1HZ   LYS  25          2HZ       LYS  25   0.941 -17.396  -1.131
  188   2HZ   LYS  25          1HZ       LYS  25   0.703 -16.486   0.222
  189   3HZ   LYS  25          3HZ       LYS  25  -0.097 -17.918   0.039
  190    HA   PRO  26           HA       PRO  26  -2.218  -8.832  -5.845
  191   1HB   PRO  26          1HB       PRO  26  -3.896  -7.243  -4.448
  192   2HB   PRO  26          2HB       PRO  26  -4.522  -8.506  -5.549
  193   1HG   PRO  26          1HG       PRO  26  -4.146  -8.694  -2.552
  194   2HG   PRO  26          2HG       PRO  26  -5.600  -9.124  -3.484
  195   1HD   PRO  26          2HD       PRO  26  -3.764 -10.967  -2.728
  196   2HD   PRO  26          1HD       PRO  26  -4.626 -11.121  -4.283
  197    H    ILE  27           HN       ILE  27  -0.340  -7.881  -5.572
  198    HA   ILE  27           HA       ILE  27   0.403  -6.961  -2.846
  199    HB   ILE  27           HB       ILE  27   2.653  -7.068  -3.360
  200   1HG1  ILE  27          2HG12     ILE  27   2.037  -7.939  -6.212
  201   2HG1  ILE  27          1HG11     ILE  27   2.604  -6.328  -5.720
  202   1HG2  ILE  27          1HG21     ILE  27   1.313  -9.249  -2.885
  203   2HG2  ILE  27          3HG23     ILE  27   1.542  -9.635  -4.584
  204   3HG2  ILE  27          2HG22     ILE  27   2.951  -9.450  -3.515
  205   1HD1  ILE  27          3HD13     ILE  27   4.659  -7.205  -4.815
  206   2HD1  ILE  27          1HD11     ILE  27   4.212  -8.855  -5.284
  207   3HD1  ILE  27          2HD12     ILE  27   4.472  -7.631  -6.528
  208    H    VAL  28           HN       VAL  28  -0.153  -4.937  -2.625
  209    HA   VAL  28           HA       VAL  28  -0.441  -3.151  -4.989
  210    HB   VAL  28           HB       VAL  28  -2.107  -3.234  -2.434
  211   1HG1  VAL  28          1HG11     VAL  28  -2.463  -1.664  -5.025
  212   2HG1  VAL  28          3HG13     VAL  28  -3.623  -1.715  -3.687
  213   3HG1  VAL  28          2HG12     VAL  28  -2.031  -0.988  -3.448
  214   1HG2  VAL  28          2HG22     VAL  28  -2.857  -4.236  -5.207
  215   2HG2  VAL  28          3HG23     VAL  28  -2.638  -5.234  -3.751
  216   3HG2  VAL  28          1HG21     VAL  28  -3.964  -4.072  -3.831
  217    H    VAL  29           HN       VAL  29   0.248  -0.989  -4.585
  218    HA   VAL  29           HA       VAL  29   1.362  -0.448  -1.891
  219    HB   VAL  29           HB       VAL  29   3.296  -1.128  -3.254
  220   1HG1  VAL  29          1HG11     VAL  29   2.382  -0.550  -5.481
  221   2HG1  VAL  29          2HG12     VAL  29   2.645   1.169  -5.039
  222   3HG1  VAL  29          3HG13     VAL  29   4.022   0.055  -5.188
  223   1HG2  VAL  29          2HG22     VAL  29   3.191   1.905  -2.762
  224   2HG2  VAL  29          3HG23     VAL  29   3.709   0.676  -1.593
  225   3HG2  VAL  29          1HG21     VAL  29   4.656   0.994  -3.043
  226    H    ASP  30           HN       ASP  30   1.065   1.491  -1.152
  227    HA   ASP  30           HA       ASP  30  -0.523   3.508  -2.690
  228   1HB   ASP  30          1HB       ASP  30  -1.802   2.821  -0.809
  229   2HB   ASP  30          2HB       ASP  30  -0.381   2.674   0.220
  230    H    PHE  31           HN       PHE  31   1.164   4.694  -3.609
  231    HA   PHE  31           HA       PHE  31   3.465   5.530  -1.907
  232   1HB   PHE  31          1HB       PHE  31   2.836   5.893  -4.868
  233   2HB   PHE  31          2HB       PHE  31   4.216   6.575  -4.054
  234    HD1  PHE  31           HD2      PHE  31   5.947   5.027  -2.976
  235    HD2  PHE  31           HD1      PHE  31   2.964   3.688  -5.787
  236    HE1  PHE  31           HE2      PHE  31   7.514   3.312  -3.822
  237    HE2  PHE  31           HE1      PHE  31   4.572   2.028  -6.687
  238    HZ   PHE  31           HZ       PHE  31   6.866   1.891  -5.782
  239    H    THR  32           HN       THR  32   2.467   7.050  -0.520
  240    HA   THR  32           HA       THR  32   1.088   9.382  -1.833
  241    HB   THR  32           HB       THR  32  -0.474   8.046  -0.535
  242    HG1  THR  32           HG1      THR  32  -1.237   9.770   0.662
  243   1HG2  THR  32          2HG22     THR  32   1.330   8.661   1.852
  244   2HG2  THR  32          1HG21     THR  32  -0.288   7.924   1.915
  245   3HG2  THR  32          3HG23     THR  32   1.041   7.048   1.147
  246    H    ALA  33           HN       ALA  33   1.140  11.047   0.361
  247    HA   ALA  33           HA       ALA  33   4.003  11.559   0.937
  248   1HB   ALA  33          1HB       ALA  33   2.178  13.457  -0.597
  249   2HB   ALA  33          2HB       ALA  33   3.749  13.915   0.093
  250   3HB   ALA  33          3HB       ALA  33   3.671  12.698  -1.186
  251    H    THR  34           HN       THR  34   4.138  13.579   2.309
  252    HA   THR  34           HA       THR  34   2.111  13.445   4.487
  253    HB   THR  34           HB       THR  34   3.934  14.582   5.769
  254    HG1  THR  34           HG1      THR  34   5.564  14.041   3.492
  255   1HG2  THR  34          1HG21     THR  34   3.756  12.107   5.780
  256   2HG2  THR  34          2HG22     THR  34   4.804  12.013   4.350
  257   3HG2  THR  34          3HG23     THR  34   5.448  12.633   5.880
  258    H    TRP  35           HN       TRP  35   4.209  15.939   3.134
  259    HA   TRP  35           HA       TRP  35   2.891  18.245   3.799
  260   1HB   TRP  35          1HB       TRP  35   4.034  19.287   1.868
  261   2HB   TRP  35          2HB       TRP  35   5.087  18.223   2.794
  262    HD1  TRP  35           HD1      TRP  35   6.133  16.169   1.580
  263    HE1  TRP  35           HE1      TRP  35   6.092  15.224  -0.791
  264    HE3  TRP  35           HE3      TRP  35   2.541  19.223  -0.446
  265    HZ2  TRP  35           HZ2      TRP  35   4.746  15.773  -3.278
  266    HZ3  TRP  35           HZ3      TRP  35   1.900  18.973  -2.820
  267    HH2  TRP  35           HH2      TRP  35   3.008  17.275  -4.251
  268    H    CYS  36           HN       CYS  36   1.822  16.003   1.312
  269    HA   CYS  36           HA       CYS  36   0.138  17.700  -0.207
  270   1HB   CYS  36          2HB       CYS  36  -0.953  15.750  -0.940
  271   2HB   CYS  36          1HB       CYS  36   0.725  15.268  -0.704
  272    H    GLY  37           HN       GLY  37  -0.174  16.657   3.125
  273   1HA   GLY  37          1HA       GLY  37  -1.723  17.150   4.711
  274   2HA   GLY  37          2HA       GLY  37  -2.321  18.408   3.621
  275    HA   PRO  38           HA       PRO  38  -6.181  16.115   3.706
  276   1HB   PRO  38          1HB       PRO  38  -6.196  17.111   0.832
  277   2HB   PRO  38          2HB       PRO  38  -7.590  16.947   1.943
  278   1HG   PRO  38          1HG       PRO  38  -6.381  19.352   1.710
  279   2HG   PRO  38          2HG       PRO  38  -6.755  18.724   3.343
  280   1HD   PRO  38          1HD       PRO  38  -4.108  18.776   1.919
  281   2HD   PRO  38          2HD       PRO  38  -4.477  19.037   3.647
  282    H    CYS  39           HN       CYS  39  -4.151  15.616   0.806
  283    HA   CYS  39           HA       CYS  39  -5.330  13.232  -0.094
  284   1HB   CYS  39          1HB       CYS  39  -3.725  13.197  -1.603
  285   2HB   CYS  39          2HB       CYS  39  -3.205  14.742  -0.953
  286    H    LYS  40           HN       LYS  40  -3.125  13.690   2.631
  287    HA   LYS  40           HA       LYS  40  -2.185  11.051   2.934
  288   1HB   LYS  40          2HB       LYS  40  -1.655  13.387   4.135
  289   2HB   LYS  40          1HB       LYS  40  -2.783  12.771   5.347
  290   1HG   LYS  40          1HG       LYS  40  -0.154  11.575   4.352
  291   2HG   LYS  40          2HG       LYS  40  -0.456  12.351   5.910
  292   1HD   LYS  40          1HD       LYS  40  -2.111  10.457   6.406
  293   2HD   LYS  40          2HD       LYS  40  -1.495   9.669   4.934
  294   1HE   LYS  40          2HE       LYS  40   0.816   9.752   5.868
  295   2HE   LYS  40          1HE       LYS  40   0.171  10.453   7.363
  296   1HZ   LYS  40          2HZ       LYS  40  -0.543   7.823   6.271
  297   2HZ   LYS  40          1HZ       LYS  40   0.466   8.103   7.545
  298   3HZ   LYS  40          3HZ       LYS  40  -1.133   8.482   7.660
  299    H    MET  41           HN       MET  41  -5.358  12.450   3.615
  300    HA   MET  41           HA       MET  41  -6.319  10.671   5.576
  301   1HB   MET  41          1HB       MET  41  -8.481  11.439   4.992
  302   2HB   MET  41          2HB       MET  41  -7.388  12.789   4.719
  303   1HG   MET  41          2HG       MET  41  -8.686  12.908   2.821
  304   2HG   MET  41          1HG       MET  41  -7.366  11.913   2.217
  305   1HE   MET  41          1HE       MET  41 -11.024  12.157   3.324
  306   2HE   MET  41          3HE       MET  41 -11.683  10.539   3.001
  307   3HE   MET  41          2HE       MET  41 -10.619  10.793   4.400
  308    H    ILE  42           HN       ILE  42  -5.681  10.053   2.173
  309    HA   ILE  42           HA       ILE  42  -7.472   7.788   1.955
  310    HB   ILE  42           HB       ILE  42  -5.027   8.657   0.358
  311   1HG1  ILE  42          1HG11     ILE  42  -8.048   8.925  -0.059
  312   2HG1  ILE  42          2HG12     ILE  42  -6.924  10.232   0.329
  313   1HG2  ILE  42          2HG22     ILE  42  -7.058   6.433  -0.136
  314   2HG2  ILE  42          1HG21     ILE  42  -5.960   7.063  -1.371
  315   3HG2  ILE  42          3HG23     ILE  42  -5.302   6.260   0.046
  316   1HD1  ILE  42          3HD13     ILE  42  -5.738   9.799  -1.835
  317   2HD1  ILE  42          1HD11     ILE  42  -7.070   8.692  -2.278
  318   3HD1  ILE  42          2HD12     ILE  42  -7.411  10.390  -1.952
  319    H    ALA  43           HN       ALA  43  -4.226   8.229   3.300
  320    HA   ALA  43           HA       ALA  43  -3.280   5.591   3.045
  321   1HB   ALA  43          2HB       ALA  43  -1.857   7.432   3.716
  322   2HB   ALA  43          1HB       ALA  43  -2.712   7.616   5.254
  323   3HB   ALA  43          3HB       ALA  43  -1.791   6.137   4.929
  324    HA   PRO  44           HA       PRO  44  -5.152   4.346   7.284
  325   1HB   PRO  44          2HB       PRO  44  -7.328   5.754   8.284
  326   2HB   PRO  44          1HB       PRO  44  -5.628   6.014   8.766
  327   1HG   PRO  44          2HG       PRO  44  -7.210   7.527   6.682
  328   2HG   PRO  44          1HG       PRO  44  -6.201   8.205   7.991
  329   1HD   PRO  44          2HD       PRO  44  -5.173   8.001   5.533
  330   2HD   PRO  44          1HD       PRO  44  -4.191   7.491   6.929
  331    H    LEU  45           HN       LEU  45  -7.322   5.819   4.874
  332    HA   LEU  45           HA       LEU  45  -9.422   3.845   5.140
  333   1HB   LEU  45          1HB       LEU  45  -8.574   5.615   2.807
  334   2HB   LEU  45          2HB       LEU  45  -9.999   4.588   2.778
  335    HG   LEU  45           HG       LEU  45  -9.499   6.836   4.799
  336   1HD1  LEU  45          3HD13     LEU  45  -9.805   7.698   2.520
  337   2HD1  LEU  45          2HD12     LEU  45 -11.301   6.754   2.343
  338   3HD1  LEU  45          1HD11     LEU  45 -11.208   8.074   3.530
  339   1HD2  LEU  45          1HD21     LEU  45 -11.963   5.113   4.256
  340   2HD2  LEU  45          3HD23     LEU  45 -11.031   5.187   5.769
  341   3HD2  LEU  45          2HD22     LEU  45 -11.964   6.585   5.246
  342    H    PHE  46           HN       PHE  46  -6.639   4.128   2.925
  343    HA   PHE  46           HA       PHE  46  -6.940   1.644   1.579
  344   1HB   PHE  46          1HB       PHE  46  -5.469   3.456   0.873
  345   2HB   PHE  46          2HB       PHE  46  -4.473   3.281   2.306
  346    HD1  PHE  46           HD2      PHE  46  -5.438   1.633  -0.889
  347    HD2  PHE  46           HD1      PHE  46  -2.761   1.608   2.487
  348    HE1  PHE  46           HE2      PHE  46  -3.866   0.175  -2.139
  349    HE2  PHE  46           HE1      PHE  46  -1.197   0.140   1.248
  350    HZ   PHE  46           HZ       PHE  46  -1.724  -0.548  -1.086
  351    H    GLU  47           HN       GLU  47  -5.245   2.520   4.614
  352    HA   GLU  47           HA       GLU  47  -4.277  -0.050   5.242
  353   1HB   GLU  47          1HB       GLU  47  -3.947   2.408   6.354
  354   2HB   GLU  47          2HB       GLU  47  -5.146   1.756   7.479
  355   1HG   GLU  47          2HG       GLU  47  -3.009   1.224   8.385
  356   2HG   GLU  47          1HG       GLU  47  -3.589  -0.297   7.692
  357    H    THR  48           HN       THR  48  -7.460   1.460   5.873
  358    HA   THR  48           HA       THR  48  -8.465  -0.597   7.578
  359    HB   THR  48           HB       THR  48 -10.060   1.153   5.650
  360    HG1  THR  48           HG1      THR  48  -8.662   2.288   7.179
  361   1HG2  THR  48          1HG21     THR  48 -10.831  -0.270   8.230
  362   2HG2  THR  48          3HG23     THR  48 -11.858   0.845   7.309
  363   3HG2  THR  48          2HG22     THR  48 -11.382  -0.706   6.596
  364    H    LEU  49           HN       LEU  49  -8.590  -0.193   3.967
  365    HA   LEU  49           HA       LEU  49  -9.928  -2.710   3.526
  366   1HB   LEU  49          1HB       LEU  49  -8.194  -0.949   1.760
  367   2HB   LEU  49          2HB       LEU  49  -8.662  -2.572   1.261
  368    HG   LEU  49           HG       LEU  49 -11.011  -2.093   1.507
  369   1HD1  LEU  49          1HD21     LEU  49 -10.187   0.770   2.132
  370   2HD1  LEU  49          3HD23     LEU  49 -11.837   0.224   1.769
  371   3HD1  LEU  49          2HD22     LEU  49 -11.037  -0.345   3.233
  372   1HD2  LEU  49          1HD11     LEU  49  -9.925  -1.732  -0.667
  373   2HD2  LEU  49          3HD13     LEU  49 -11.230  -0.565  -0.432
  374   3HD2  LEU  49          2HD12     LEU  49  -9.540  -0.055  -0.222
  375    H    SER  50           HN       SER  50  -6.484  -1.821   3.715
  376    HA   SER  50           HA       SER  50  -5.300  -4.303   3.202
  377   1HB   SER  50          2HB       SER  50  -4.337  -2.470   5.452
  378   2HB   SER  50          1HB       SER  50  -3.426  -3.594   4.483
  379    HG   SER  50           HG       SER  50  -4.753  -1.350   3.354
  380    H    ASN  51           HN       ASN  51  -6.481  -3.082   6.359
  381    HA   ASN  51           HA       ASN  51  -6.014  -5.500   7.810
  382   1HB   ASN  51          1HB       ASN  51  -6.387  -3.081   8.644
  383   2HB   ASN  51          2HB       ASN  51  -8.115  -3.400   8.478
  384   1HD2  ASN  51          2HD22     ASN  51  -7.574  -6.107  11.153
  385   2HD2  ASN  51          1HD21     ASN  51  -7.960  -6.287   9.452
  386    H    ASP  52           HN       ASP  52  -8.832  -4.279   5.953
  387    HA   ASP  52           HA       ASP  52 -10.762  -6.135   6.839
  388   1HB   ASP  52          1HB       ASP  52 -11.259  -4.139   5.429
  389   2HB   ASP  52          2HB       ASP  52 -10.460  -4.923   4.046
  390    H    TYR  53           HN       TYR  53  -8.444  -6.349   4.098
  391    HA   TYR  53           HA       TYR  53  -9.307  -9.081   3.458
  392   1HB   TYR  53          1HB       TYR  53  -7.150  -7.204   2.467
  393   2HB   TYR  53          2HB       TYR  53  -7.234  -8.904   1.985
  394    HD1  TYR  53           HD1      TYR  53  -8.979  -9.765   0.535
  395    HD2  TYR  53           HD2      TYR  53  -8.946  -5.616   1.692
  396    HE1  TYR  53           HE1      TYR  53 -10.440  -9.207  -1.373
  397    HE2  TYR  53           HE2      TYR  53 -10.368  -5.051  -0.238
  398    HH   TYR  53           HH       TYR  53 -11.088  -7.486  -2.762
  399    H    ALA  54           HN       ALA  54  -6.379  -7.585   4.871
  400    HA   ALA  54           HA       ALA  54  -4.733  -8.276   6.195
  401   1HB   ALA  54          1HB       ALA  54  -6.556  -8.621   7.758
  402   2HB   ALA  54          2HB       ALA  54  -6.820 -10.273   7.172
  403   3HB   ALA  54          3HB       ALA  54  -5.313  -9.850   8.003
  404    H    GLY  55           HN       GLY  55  -6.199 -11.366   5.260
  405   1HA   GLY  55          1HA       GLY  55  -3.912 -12.970   5.700
  406   2HA   GLY  55          2HA       GLY  55  -5.375 -13.422   4.816
  407    H    LYS  56           HN       LYS  56  -5.238 -13.699   2.608
  408    HA   LYS  56           HA       LYS  56  -2.584 -13.936   1.511
  409   1HB   LYS  56          2HB       LYS  56  -3.738 -14.965  -0.339
  410   2HB   LYS  56          1HB       LYS  56  -4.280 -15.634   1.192
  411   1HG   LYS  56          2HG       LYS  56  -6.379 -14.335   1.063
  412   2HG   LYS  56          1HG       LYS  56  -5.864 -13.583  -0.442
  413   1HD   LYS  56          1HD       LYS  56  -6.303 -16.572  -0.006
  414   2HD   LYS  56          2HD       LYS  56  -7.464 -15.469  -0.750
  415   1HE   LYS  56          2HE       LYS  56  -4.713 -16.128  -1.911
  416   2HE   LYS  56          1HE       LYS  56  -6.259 -16.792  -2.432
  417   1HZ   LYS  56          3HZ       LYS  56  -5.669 -13.927  -2.488
  418   2HZ   LYS  56          1HZ       LYS  56  -5.453 -14.950  -3.756
  419   3HZ   LYS  56          2HZ       LYS  56  -6.967 -14.719  -3.153
  420    H    VAL  57           HN       VAL  57  -2.742 -11.278   1.951
  421    HA   VAL  57           HA       VAL  57  -2.660 -10.114  -0.773
  422    HB   VAL  57           HB       VAL  57  -3.933  -8.165  -0.067
  423   1HG1  VAL  57          1HG21     VAL  57  -5.194 -10.168  -1.010
  424   2HG1  VAL  57          2HG22     VAL  57  -5.662 -10.564   0.651
  425   3HG1  VAL  57          3HG23     VAL  57  -6.154  -9.021  -0.075
  426   1HG2  VAL  57          3HG13     VAL  57  -3.410  -8.172   2.371
  427   2HG2  VAL  57          2HG12     VAL  57  -5.128  -8.072   2.096
  428   3HG2  VAL  57          1HG11     VAL  57  -4.421  -9.616   2.583
  429    H    ILE  58           HN       ILE  58  -1.399  -8.113  -0.865
  430    HA   ILE  58           HA       ILE  58   0.068  -7.393   1.646
  431    HB   ILE  58           HB       ILE  58   1.286  -8.003  -1.078
  432   1HG1  ILE  58          2HG12     ILE  58   2.935  -9.138   0.726
  433   2HG1  ILE  58          1HG11     ILE  58   1.463  -9.205   1.684
  434   1HG2  ILE  58          3HG23     ILE  58   2.518  -6.519   1.262
  435   2HG2  ILE  58          1HG21     ILE  58   3.402  -7.115  -0.161
  436   3HG2  ILE  58          2HG22     ILE  58   2.181  -5.869  -0.359
  437   1HD1  ILE  58          1HD11     ILE  58   0.411 -10.444  -0.342
  438   2HD1  ILE  58          3HD13     ILE  58   2.038 -10.444  -1.042
  439   3HD1  ILE  58          2HD12     ILE  58   1.732 -11.284   0.485
  440    H    PHE  59           HN       PHE  59  -0.209  -5.304   2.064
  441    HA   PHE  59           HA       PHE  59  -0.947  -3.392  -0.135
  442   1HB   PHE  59          2HB       PHE  59  -2.153  -3.754   2.605
  443   2HB   PHE  59          1HB       PHE  59  -2.189  -2.226   1.764
  444    HD1  PHE  59           HD1      PHE  59  -3.130  -5.840   1.084
  445    HD2  PHE  59           HD2      PHE  59  -4.153  -1.665   0.708
  446    HE1  PHE  59           HE1      PHE  59  -5.472  -6.439   0.497
  447    HE2  PHE  59           HE2      PHE  59  -6.462  -2.275   0.141
  448    HZ   PHE  59           HZ       PHE  59  -7.172  -4.667   0.213
  449    H    LEU  60           HN       LEU  60   1.147  -2.621  -0.297
  450    HA   LEU  60           HA       LEU  60   2.755  -1.926   2.039
  451   1HB   LEU  60          1HB       LEU  60   3.123  -1.473  -0.938
  452   2HB   LEU  60          2HB       LEU  60   4.370  -1.197   0.295
  453    HG   LEU  60           HG       LEU  60   3.092  -3.837  -0.531
  454   1HD1  LEU  60          1HD21     LEU  60   4.679  -2.865  -2.174
  455   2HD1  LEU  60          2HD22     LEU  60   5.921  -2.802  -0.902
  456   3HD1  LEU  60          3HD23     LEU  60   5.289  -4.364  -1.456
  457   1HD2  LEU  60          2HD12     LEU  60   5.287  -3.279   1.523
  458   2HD2  LEU  60          3HD13     LEU  60   3.688  -4.005   1.835
  459   3HD2  LEU  60          1HD11     LEU  60   4.883  -4.876   0.864
  460    H    LYS  61           HN       LYS  61   1.933  -0.194   3.201
  461    HA   LYS  61           HA       LYS  61   1.077   2.298   1.865
  462   1HB   LYS  61          1HB       LYS  61  -0.085   1.972   3.833
  463   2HB   LYS  61          2HB       LYS  61   1.280   1.222   4.653
  464   1HG   LYS  61          1HG       LYS  61   0.737   3.311   5.663
  465   2HG   LYS  61          2HG       LYS  61   2.374   3.331   5.017
  466   1HD   LYS  61          1HD       LYS  61   1.499   4.685   3.047
  467   2HD   LYS  61          2HD       LYS  61  -0.103   4.656   3.795
  468   1HE   LYS  61          2HE       LYS  61   0.798   5.795   5.805
  469   2HE   LYS  61          1HE       LYS  61   2.443   5.707   5.147
  470   1HZ   LYS  61          2HZ       LYS  61   0.235   7.208   3.952
  471   2HZ   LYS  61          1HZ       LYS  61   1.492   7.843   4.812
  472   3HZ   LYS  61          3HZ       LYS  61   1.772   7.105   3.367
  473    H    VAL  62           HN       VAL  62   2.616   3.702   1.003
  474    HA   VAL  62           HA       VAL  62   5.264   3.876   2.341
  475    HB   VAL  62           HB       VAL  62   4.712   3.285  -0.612
  476   1HG1  VAL  62          2HG12     VAL  62   7.337   4.021   0.743
  477   2HG1  VAL  62          1HG11     VAL  62   7.167   3.395  -0.912
  478   3HG1  VAL  62          3HG13     VAL  62   6.521   4.979  -0.509
  479   1HG2  VAL  62          3HG23     VAL  62   6.153   1.814   1.641
  480   2HG2  VAL  62          1HG21     VAL  62   4.732   1.271   0.751
  481   3HG2  VAL  62          2HG22     VAL  62   6.291   1.359  -0.069
  482    H    ASP  63           HN       ASP  63   6.356   5.771   2.081
  483    HA   ASP  63           HA       ASP  63   4.731   8.143   1.278
  484   1HB   ASP  63          1HB       ASP  63   5.117   8.096   3.655
  485   2HB   ASP  63          2HB       ASP  63   6.838   7.743   3.425
  486    H    VAL  64           HN       VAL  64   5.455   8.919  -0.652
  487    HA   VAL  64           HA       VAL  64   7.966   8.202  -1.826
  488    HB   VAL  64           HB       VAL  64   7.493   9.843  -3.517
  489   1HG1  VAL  64          2HG12     VAL  64   6.201   7.757  -3.591
  490   2HG1  VAL  64          3HG13     VAL  64   4.876   8.530  -2.687
  491   3HG1  VAL  64          1HG11     VAL  64   5.315   9.124  -4.293
  492   1HG2  VAL  64          3HG23     VAL  64   5.329  10.988  -1.718
  493   2HG2  VAL  64          2HG22     VAL  64   6.791  11.803  -2.303
  494   3HG2  VAL  64          1HG21     VAL  64   5.530  11.347  -3.443
  495    H    ASP  65           HN       ASP  65   7.030  10.798   0.388
  496    HA   ASP  65           HA       ASP  65   9.223  12.573  -0.134
  497   1HB   ASP  65          1HB       ASP  65   7.777  12.173   2.509
  498   2HB   ASP  65          2HB       ASP  65   8.686  13.583   1.973
  499    H    ALA  66           HN       ALA  66   8.815   9.614   1.773
  500    HA   ALA  66           HA       ALA  66  11.431   9.895   3.108
  501   1HB   ALA  66          2HB       ALA  66   9.545   8.923   4.346
  502   2HB   ALA  66          1HB       ALA  66   9.372   7.638   3.134
  503   3HB   ALA  66          3HB       ALA  66  10.845   7.736   4.120
  504    H    VAL  67           HN       VAL  67   9.873   7.399   0.957
  505    HA   VAL  67           HA       VAL  67  12.623   6.511   0.233
  506    HB   VAL  67           HB       VAL  67  11.582   4.672  -0.887
  507   1HG1  VAL  67          3HG13     VAL  67  12.314   4.681   1.517
  508   2HG1  VAL  67          2HG12     VAL  67  10.621   4.947   1.982
  509   3HG1  VAL  67          1HG11     VAL  67  11.100   3.477   1.101
  510   1HG2  VAL  67          1HG21     VAL  67   9.304   5.736  -1.390
  511   2HG2  VAL  67          3HG23     VAL  67   9.296   4.122  -0.684
  512   3HG2  VAL  67          2HG22     VAL  67   8.947   5.543   0.334
  513    H    ALA  68           HN       ALA  68  12.696   8.841  -0.669
  514    HA   ALA  68           HA       ALA  68  11.631   9.578  -3.129
  515   1HB   ALA  68          1HB       ALA  68  13.140  10.995  -1.793
  516   2HB   ALA  68          2HB       ALA  68  14.513   9.932  -2.179
  517   3HB   ALA  68          3HB       ALA  68  13.718  10.864  -3.466
  518    H    ALA  69           HN       ALA  69  14.383   7.389  -2.531
  519    HA   ALA  69           HA       ALA  69  15.184   6.883  -5.184
  520   1HB   ALA  69          1HB       ALA  69  15.269   5.053  -2.744
  521   2HB   ALA  69          3HB       ALA  69  16.196   4.837  -4.245
  522   3HB   ALA  69          2HB       ALA  69  16.498   6.248  -3.214
  523    H    VAL  70           HN       VAL  70  12.882   4.930  -3.149
  524    HA   VAL  70           HA       VAL  70  12.339   3.060  -5.271
  525    HB   VAL  70           HB       VAL  70  10.585   3.745  -2.879
  526   1HG1  VAL  70          1HG21     VAL  70   9.447   2.415  -4.685
  527   2HG1  VAL  70          2HG22     VAL  70  10.752   1.225  -4.600
  528   3HG1  VAL  70          3HG23     VAL  70   9.684   1.475  -3.206
  529   1HG2  VAL  70          1HG11     VAL  70  12.760   1.624  -3.199
  530   2HG2  VAL  70          3HG13     VAL  70  12.851   3.034  -2.124
  531   3HG2  VAL  70          2HG12     VAL  70  11.651   1.768  -1.820
  532    H    ALA  71           HN       ALA  71  10.768   6.031  -4.096
  533    HA   ALA  71           HA       ALA  71   8.504   6.021  -5.761
  534   1HB   ALA  71          1HB       ALA  71   8.848   7.578  -3.888
  535   2HB   ALA  71          2HB       ALA  71  10.112   8.431  -4.794
  536   3HB   ALA  71          3HB       ALA  71   8.441   8.451  -5.380
  537    H    GLU  72           HN       GLU  72  11.714   7.665  -6.461
  538    HA   GLU  72           HA       GLU  72  10.841   8.372  -9.108
  539   1HB   GLU  72          2HB       GLU  72  13.068   9.101  -9.518
  540   2HB   GLU  72          1HB       GLU  72  12.573   9.578  -7.902
  541   1HG   GLU  72          2HG       GLU  72  14.790   8.938  -7.632
  542   2HG   GLU  72          1HG       GLU  72  13.882   7.570  -7.018
  543    H    ALA  73           HN       ALA  73  12.673   5.524  -7.840
  544    HA   ALA  73           HA       ALA  73  13.290   4.375 -10.342
  545   1HB   ALA  73          1HB       ALA  73  14.174   3.555  -8.190
  546   2HB   ALA  73          3HB       ALA  73  12.556   2.978  -7.729
  547   3HB   ALA  73          2HB       ALA  73  13.403   2.247  -9.106
  548    H    ALA  74           HN       ALA  74  10.301   4.141  -8.375
  549    HA   ALA  74           HA       ALA  74   8.920   2.452 -10.322
  550   1HB   ALA  74          3HB       ALA  74   7.970   3.930  -7.837
  551   2HB   ALA  74          1HB       ALA  74   7.025   2.742  -8.761
  552   3HB   ALA  74          2HB       ALA  74   8.505   2.242  -7.925
  553    H    GLY  75           HN       GLY  75   9.820   5.649 -10.591
  554   1HA   GLY  75          1HA       GLY  75   9.143   7.342 -11.926
  555   2HA   GLY  75          2HA       GLY  75   8.063   6.184 -12.728
  556    H    ILE  76           HN       ILE  76   7.868   7.074  -9.253
  557    HA   ILE  76           HA       ILE  76   5.065   7.782  -9.640
  558    HB   ILE  76           HB       ILE  76   6.802   8.219  -7.175
  559   1HG1  ILE  76          1HG11     ILE  76   6.805   5.867  -7.798
  560   2HG1  ILE  76          2HG12     ILE  76   5.895   6.138  -6.313
  561   1HG2  ILE  76          3HG23     ILE  76   3.808   8.289  -7.718
  562   2HG2  ILE  76          1HG21     ILE  76   4.457   8.054  -6.089
  563   3HG2  ILE  76          2HG22     ILE  76   4.820   9.541  -6.981
  564   1HD1  ILE  76          2HD12     ILE  76   4.672   5.703  -9.092
  565   2HD1  ILE  76          1HD11     ILE  76   4.858   4.480  -7.846
  566   3HD1  ILE  76          3HD13     ILE  76   3.788   5.858  -7.550
  567    H    THR  77           HN       THR  77   4.196   9.696  -9.849
  568    HA   THR  77           HA       THR  77   5.830  12.195  -9.743
  569    HB   THR  77           HB       THR  77   4.587  12.812 -11.907
  570    HG1  THR  77           HG1      THR  77   4.431  10.003 -12.238
  571   1HG2  THR  77          2HG22     THR  77   7.008  12.263 -11.892
  572   2HG2  THR  77          1HG21     THR  77   6.631  10.542 -12.093
  573   3HG2  THR  77          3HG23     THR  77   6.214  11.695 -13.373
  574    H    ALA  78           HN       ALA  78   2.585  11.253 -10.807
  575    HA   ALA  78           HA       ALA  78   1.296  13.377  -9.311
  576   1HB   ALA  78          2HB       ALA  78   0.169  10.974 -10.802
  577   2HB   ALA  78          1HB       ALA  78  -0.774  12.371 -10.229
  578   3HB   ALA  78          3HB       ALA  78   0.468  12.589 -11.478
  579    H    MET  79           HN       MET  79   2.517  12.398  -7.225
  580    HA   MET  79           HA       MET  79   1.177  10.215  -5.950
  581   1HB   MET  79          1HB       MET  79   2.292  10.761  -3.946
  582   2HB   MET  79          2HB       MET  79   3.415  10.971  -5.284
  583   1HG   MET  79          2HG       MET  79   1.988  13.265  -3.855
  584   2HG   MET  79          1HG       MET  79   3.569  12.642  -3.471
  585   1HE   MET  79          3HE       MET  79   1.750  15.290  -5.112
  586   2HE   MET  79          2HE       MET  79   2.791  15.881  -6.428
  587   3HE   MET  79          1HE       MET  79   1.752  14.475  -6.695
  588    HA   PRO  80           HA       PRO  80   0.190   9.674  -3.812
  589   1HB   PRO  80          2HB       PRO  80  -2.244   8.661  -3.171
  590   2HB   PRO  80          1HB       PRO  80  -1.468   9.951  -2.210
  591   1HG   PRO  80          1HG       PRO  80  -3.540  10.286  -4.385
  592   2HG   PRO  80          2HG       PRO  80  -3.557  10.995  -2.745
  593   1HD   PRO  80          1HD       PRO  80  -2.631  12.378  -4.935
  594   2HD   PRO  80          2HD       PRO  80  -1.867  12.579  -3.337
  595    H    THR  81           HN       THR  81   0.493   7.770  -4.846
  596    HA   THR  81           HA       THR  81  -1.068   7.185  -7.320
  597    HB   THR  81           HB       THR  81   1.929   7.172  -6.883
  598    HG1  THR  81           HG1      THR  81   0.428   9.042  -7.805
  599   1HG2  THR  81          2HG22     THR  81   0.276   5.973  -9.154
  600   2HG2  THR  81          3HG23     THR  81   2.014   6.320  -9.272
  601   3HG2  THR  81          1HG21     THR  81   1.431   5.133  -8.094
  602    H    PHE  82           HN       PHE  82  -1.841   5.232  -7.362
  603    HA   PHE  82           HA       PHE  82  -1.067   3.232  -5.317
  604   1HB   PHE  82          1HB       PHE  82  -3.588   3.732  -6.916
  605   2HB   PHE  82          2HB       PHE  82  -3.399   2.369  -5.841
  606    HD1  PHE  82           HD1      PHE  82  -3.105   2.761  -3.358
  607    HD2  PHE  82           HD2      PHE  82  -3.860   6.034  -6.074
  608    HE1  PHE  82           HE1      PHE  82  -3.430   4.303  -1.444
  609    HE2  PHE  82           HE2      PHE  82  -4.160   7.555  -4.167
  610    HZ   PHE  82           HZ       PHE  82  -3.765   6.717  -1.837
  611    H    HIS  83           HN       HIS  83  -0.121   1.398  -6.059
  612    HA   HIS  83           HA       HIS  83  -0.091   0.789  -9.008
  613   1HB   HIS  83          1HB       HIS  83   2.087   1.182  -7.013
  614   2HB   HIS  83          2HB       HIS  83   2.271  -0.167  -8.113
  615    HD2  HIS  83           HD2      HIS  83   0.919   3.208  -9.570
  616    HE1  HIS  83           HE1      HIS  83   5.063   2.920 -10.374
  617    HE2  HIS  83           HE2      HIS  83   2.942   4.260 -10.875
  618    H    VAL  84           HN       VAL  84  -0.077  -1.440  -9.488
  619    HA   VAL  84           HA       VAL  84  -0.240  -3.357  -7.210
  620    HB   VAL  84           HB       VAL  84  -1.823  -3.547  -9.808
  621   1HG1  VAL  84          2HG22     VAL  84  -1.905  -5.030  -7.141
  622   2HG1  VAL  84          1HG21     VAL  84  -3.077  -5.254  -8.450
  623   3HG1  VAL  84          3HG23     VAL  84  -1.377  -5.678  -8.705
  624   1HG2  VAL  84          1HG11     VAL  84  -2.805  -2.568  -7.100
  625   2HG2  VAL  84          3HG13     VAL  84  -2.738  -1.614  -8.598
  626   3HG2  VAL  84          2HG12     VAL  84  -3.840  -2.987  -8.477
  627    H    TYR  85           HN       TYR  85   0.991  -5.268  -7.532
  628    HA   TYR  85           HA       TYR  85   2.449  -5.482 -10.178
  629   1HB   TYR  85          1HB       TYR  85   3.698  -5.560  -7.421
  630   2HB   TYR  85          2HB       TYR  85   4.474  -6.091  -8.905
  631    HD1  TYR  85           HD2      TYR  85   3.187  -3.100  -7.102
  632    HD2  TYR  85           HD1      TYR  85   5.605  -4.617 -10.331
  633    HE1  TYR  85           HE2      TYR  85   4.240  -0.869  -7.390
  634    HE2  TYR  85           HE1      TYR  85   6.557  -2.358 -10.680
  635    HH   TYR  85           HH       TYR  85   5.198   0.489  -9.130
  636    H    LYS  86           HN       LYS  86   0.222  -6.987  -9.857
  637    HA   LYS  86           HA       LYS  86   0.826  -9.561  -8.636
  638   1HB   LYS  86          2HB       LYS  86  -1.207  -8.710 -10.746
  639   2HB   LYS  86          1HB       LYS  86  -0.999 -10.375 -10.171
  640   1HG   LYS  86          1HG       LYS  86  -1.368  -9.618  -7.830
  641   2HG   LYS  86          2HG       LYS  86  -1.657  -7.978  -8.412
  642   1HD   LYS  86          2HD       LYS  86  -3.792  -9.064  -7.986
  643   2HD   LYS  86          1HD       LYS  86  -3.617  -8.741  -9.711
  644   1HE   LYS  86          2HE       LYS  86  -4.609 -10.976  -9.226
  645   2HE   LYS  86          1HE       LYS  86  -3.113 -11.101 -10.153
  646   1HZ   LYS  86          2HZ       LYS  86  -1.976 -11.558  -8.067
  647   2HZ   LYS  86          1HZ       LYS  86  -3.423 -11.557  -7.268
  648   3HZ   LYS  86          3HZ       LYS  86  -3.105 -12.684  -8.441
  649    H    ASP  87           HN       ASP  87   1.395 -11.480  -9.802
  650    HA   ASP  87           HA       ASP  87   2.587 -12.776 -11.241
  651   1HB   ASP  87          1HB       ASP  87   1.457 -11.641 -13.162
  652   2HB   ASP  87          2HB       ASP  87   2.724 -10.423 -13.207
  653    H    GLY  88           HN       GLY  88   3.730  -9.452 -11.455
  654   1HA   GLY  88          1HA       GLY  88   5.833  -9.435  -9.676
  655   2HA   GLY  88          2HA       GLY  88   6.567 -10.109 -11.150
  656    H    VAL  89           HN       VAL  89   5.246  -8.795 -13.131
  657    HA   VAL  89           HA       VAL  89   6.509  -6.193 -13.092
  658    HB   VAL  89           HB       VAL  89   6.323  -7.671 -15.093
  659   1HG1  VAL  89          2HG12     VAL  89   4.010  -8.535 -14.763
  660   2HG1  VAL  89          3HG13     VAL  89   3.363  -6.922 -15.124
  661   3HG1  VAL  89          1HG11     VAL  89   4.240  -7.828 -16.366
  662   1HG2  VAL  89          2HG22     VAL  89   6.691  -5.212 -15.339
  663   2HG2  VAL  89          1HG21     VAL  89   5.901  -5.975 -16.730
  664   3HG2  VAL  89          3HG23     VAL  89   4.941  -5.010 -15.603
  665    H    LYS  90           HN       LYS  90   5.418  -4.166 -13.451
  666    HA   LYS  90           HA       LYS  90   3.338  -3.546 -11.643
  667   1HB   LYS  90          1HB       LYS  90   5.092  -2.034 -12.664
  668   2HB   LYS  90          2HB       LYS  90   4.158  -2.046 -14.167
  669   1HG   LYS  90          1HG       LYS  90   2.277  -0.942 -13.029
  670   2HG   LYS  90          2HG       LYS  90   3.043  -1.168 -11.456
  671   1HD   LYS  90          1HD       LYS  90   3.328   1.135 -12.241
  672   2HD   LYS  90          2HD       LYS  90   4.876   0.327 -12.013
  673   1HE   LYS  90          1HE       LYS  90   4.761   1.745 -14.069
  674   2HE   LYS  90          2HE       LYS  90   5.159   0.060 -14.427
  675   1HZ   LYS  90          3HZ       LYS  90   2.467   1.226 -14.623
  676   2HZ   LYS  90          2HZ       LYS  90   3.491   0.997 -15.901
  677   3HZ   LYS  90          1HZ       LYS  90   2.906  -0.297 -15.064
  678    H    ALA  91           HN       ALA  91   1.371  -4.448 -11.779
  679    HA   ALA  91           HA       ALA  91   0.330  -5.489 -14.306
  680   1HB   ALA  91          3HB       ALA  91   0.236  -6.808 -12.233
  681   2HB   ALA  91          1HB       ALA  91  -0.774  -5.559 -11.466
  682   3HB   ALA  91          2HB       ALA  91  -1.394  -6.479 -12.853
  683    H    ASP  92           HN       ASP  92  -0.548  -2.943 -11.970
  684    HA   ASP  92           HA       ASP  92  -2.159  -1.572 -13.955
  685   1HB   ASP  92          1HB       ASP  92  -3.656  -3.449 -13.082
  686   2HB   ASP  92          2HB       ASP  92  -3.551  -2.693 -11.479
  687    H    ASP  93           HN       ASP  93  -2.966   0.510 -13.018
  688    HA   ASP  93           HA       ASP  93  -1.638   1.398 -10.553
  689   1HB   ASP  93          1HB       ASP  93  -1.157   2.834 -13.193
  690   2HB   ASP  93          2HB       ASP  93  -0.533   3.307 -11.614
  691    H    LEU  94           HN       LEU  94  -2.351   3.549  -9.943
  692    HA   LEU  94           HA       LEU  94  -4.615   4.800 -11.327
  693   1HB   LEU  94          2HB       LEU  94  -5.724   3.062 -10.182
  694   2HB   LEU  94          1HB       LEU  94  -4.828   3.278  -8.690
  695    HG   LEU  94           HG       LEU  94  -7.224   3.946  -8.781
  696   1HD1  LEU  94          3HD23     LEU  94  -5.693   4.722  -7.000
  697   2HD1  LEU  94          1HD21     LEU  94  -5.521   6.272  -7.867
  698   3HD1  LEU  94          2HD22     LEU  94  -7.100   5.733  -7.272
  699   1HD2  LEU  94          3HD13     LEU  94  -7.041   5.069 -11.051
  700   2HD2  LEU  94          1HD11     LEU  94  -7.866   6.062  -9.840
  701   3HD2  LEU  94          2HD12     LEU  94  -6.203   6.425 -10.267
  702    H    VAL  95           HN       VAL  95  -4.065   6.943 -11.224
  703    HA   VAL  95           HA       VAL  95  -2.289   7.869  -9.046
  704    HB   VAL  95           HB       VAL  95  -1.847   9.763 -10.530
  705   1HG1  VAL  95          2HG22     VAL  95  -0.395   7.788 -10.596
  706   2HG1  VAL  95          1HG21     VAL  95  -1.403   7.061 -11.867
  707   3HG1  VAL  95          3HG23     VAL  95  -0.506   8.557 -12.186
  708   1HG2  VAL  95          3HG13     VAL  95  -3.985   9.818 -11.809
  709   2HG2  VAL  95          1HG11     VAL  95  -2.558   9.792 -12.852
  710   3HG2  VAL  95          2HG12     VAL  95  -3.514   8.319 -12.638
  711    H    GLY  96           HN       GLY  96  -2.629   9.880  -8.019
  712   1HA   GLY  96          1HA       GLY  96  -3.729  11.778  -7.351
  713   2HA   GLY  96          2HA       GLY  96  -5.047  11.447  -8.498
  714    H    ALA  97           HN       ALA  97  -5.938  12.324  -6.243
  715    HA   ALA  97           HA       ALA  97  -6.349  10.337  -4.165
  716   1HB   ALA  97          2HB       ALA  97  -7.593  13.075  -4.725
  717   2HB   ALA  97          1HB       ALA  97  -7.815  12.169  -3.224
  718   3HB   ALA  97          3HB       ALA  97  -6.200  12.747  -3.670
  719    H    SER  98           HN       SER  98  -7.149   9.243  -6.624
  720    HA   SER  98           HA       SER  98 -10.006   9.547  -7.076
  721   1HB   SER  98          2HB       SER  98  -8.022   7.536  -8.178
  722   2HB   SER  98          1HB       SER  98  -9.548   8.060  -8.920
  723    HG   SER  98           HG       SER  98  -7.089   9.125  -9.176
  724    H    GLN  99           HN       GLN  99 -10.054   8.946  -4.571
  725    HA   GLN  99           HA       GLN  99  -9.668   6.492  -3.445
  726   1HB   GLN  99          1HB       GLN  99 -10.521   8.480  -2.269
  727   2HB   GLN  99          2HB       GLN  99 -12.080   8.324  -3.086
  728   1HG   GLN  99          1HG       GLN  99 -12.242   7.469  -0.815
  729   2HG   GLN  99          2HG       GLN  99 -12.476   6.151  -1.957
  730   1HE2  GLN  99          1HE21     GLN  99  -9.057   6.261   0.369
  731   2HE2  GLN  99          2HE22     GLN  99  -9.893   7.763   0.000
  732    H    ASP 100           HN       ASP 100 -12.616   7.346  -5.323
  733    HA   ASP 100           HA       ASP 100 -14.047   4.932  -4.928
  734   1HB   ASP 100          2HB       ASP 100 -15.314   5.599  -6.888
  735   2HB   ASP 100          1HB       ASP 100 -15.010   7.017  -5.881
  736    H    LYS 101           HN       LYS 101 -11.786   5.895  -7.519
  737    HA   LYS 101           HA       LYS 101 -11.939   3.370  -8.890
  738   1HB   LYS 101          1HB       LYS 101 -11.380   5.619  -9.852
  739   2HB   LYS 101          2HB       LYS 101  -9.804   5.512  -9.074
  740   1HG   LYS 101          2HG       LYS 101  -9.181   3.594 -10.387
  741   2HG   LYS 101          1HG       LYS 101 -10.825   3.318 -10.955
  742   1HD   LYS 101          2HD       LYS 101  -9.499   5.954 -11.641
  743   2HD   LYS 101          1HD       LYS 101  -8.994   4.489 -12.489
  744   1HE   LYS 101          1HE       LYS 101 -10.711   5.640 -13.769
  745   2HE   LYS 101          2HE       LYS 101 -11.275   4.046 -13.251
  746   1HZ   LYS 101          3HZ       LYS 101 -11.956   6.596 -11.958
  747   2HZ   LYS 101          1HZ       LYS 101 -12.929   5.744 -12.979
  748   3HZ   LYS 101          2HZ       LYS 101 -12.512   5.109 -11.518
  749    H    LEU 102           HN       LEU 102  -9.870   4.704  -6.331
  750    HA   LEU 102           HA       LEU 102  -7.833   2.747  -6.282
  751   1HB   LEU 102          1HB       LEU 102  -8.237   4.947  -4.841
  752   2HB   LEU 102          2HB       LEU 102  -9.043   3.844  -3.720
  753    HG   LEU 102           HG       LEU 102  -6.158   3.951  -4.504
  754   1HD1  LEU 102          1HD11     LEU 102  -7.733   3.973  -1.876
  755   2HD1  LEU 102          3HD13     LEU 102  -5.977   4.055  -1.986
  756   3HD1  LEU 102          2HD12     LEU 102  -6.964   5.364  -2.670
  757   1HD2  LEU 102          2HD22     LEU 102  -7.498   1.655  -3.014
  758   2HD2  LEU 102          1HD21     LEU 102  -6.672   1.551  -4.595
  759   3HD2  LEU 102          3HD23     LEU 102  -5.748   1.938  -3.153
  760    H    LYS 103           HN       LYS 103 -10.941   2.906  -4.426
  761    HA   LYS 103           HA       LYS 103 -10.829   0.314  -3.314
  762   1HB   LYS 103          1HB       LYS 103 -13.244   2.021  -4.101
  763   2HB   LYS 103          2HB       LYS 103 -13.278   0.557  -3.116
  764   1HG   LYS 103          1HG       LYS 103 -11.570   1.753  -1.570
  765   2HG   LYS 103          2HG       LYS 103 -12.022   3.231  -2.432
  766   1HD   LYS 103          1HD       LYS 103 -14.465   2.657  -1.889
  767   2HD   LYS 103          2HD       LYS 103 -13.840   1.384  -0.828
  768   1HE   LYS 103          2HE       LYS 103 -13.443   4.397  -0.577
  769   2HE   LYS 103          1HE       LYS 103 -14.315   3.323   0.527
  770   1HZ   LYS 103          2HZ       LYS 103 -12.171   2.249   0.965
  771   2HZ   LYS 103          3HZ       LYS 103 -11.425   3.396   0.033
  772   3HZ   LYS 103          1HZ       LYS 103 -12.206   3.836   1.412
  773    H    ALA 104           HN       ALA 104 -12.336   1.445  -6.391
  774    HA   ALA 104           HA       ALA 104 -13.338  -1.023  -7.252
  775   1HB   ALA 104          1HB       ALA 104 -13.706   1.180  -8.388
  776   2HB   ALA 104          3HB       ALA 104 -12.054   1.078  -9.047
  777   3HB   ALA 104          2HB       ALA 104 -13.262  -0.131  -9.501
  778    H    LEU 105           HN       LEU 105  -9.973   0.272  -7.780
  779    HA   LEU 105           HA       LEU 105  -9.113  -2.074  -9.202
  780   1HB   LEU 105          1HB       LEU 105  -7.524  -0.002  -7.615
  781   2HB   LEU 105          2HB       LEU 105  -6.817  -1.367  -8.470
  782    HG   LEU 105           HG       LEU 105  -8.043   1.124  -9.610
  783   1HD1  LEU 105          3HD13     LEU 105  -5.593   0.868  -9.283
  784   2HD1  LEU 105          2HD12     LEU 105  -5.606  -0.597 -10.280
  785   3HD1  LEU 105          1HD11     LEU 105  -6.000   0.961 -11.014
  786   1HD2  LEU 105          1HD21     LEU 105  -7.880  -1.523 -11.106
  787   2HD2  LEU 105          2HD22     LEU 105  -9.333  -0.527 -10.838
  788   3HD2  LEU 105          3HD23     LEU 105  -8.036   0.064 -11.880
  789    H    VAL 106           HN       VAL 106  -8.941  -1.242  -5.678
  790    HA   VAL 106           HA       VAL 106  -7.542  -3.633  -4.998
  791    HB   VAL 106           HB       VAL 106  -9.625  -2.150  -3.330
  792   1HG1  VAL 106          1HG21     VAL 106  -7.550  -4.289  -2.619
  793   2HG1  VAL 106          2HG22     VAL 106  -8.428  -3.321  -1.425
  794   3HG1  VAL 106          3HG23     VAL 106  -9.310  -4.437  -2.469
  795   1HG2  VAL 106          2HG12     VAL 106  -7.620  -0.785  -3.968
  796   2HG2  VAL 106          3HG13     VAL 106  -7.674  -1.144  -2.236
  797   3HG2  VAL 106          1HG11     VAL 106  -6.575  -2.050  -3.304
  798    H    ALA 107           HN       ALA 107 -11.042  -3.013  -5.157
  799    HA   ALA 107           HA       ALA 107 -11.940  -5.632  -4.572
  800   1HB   ALA 107          1HB       ALA 107 -13.429  -3.667  -4.734
  801   2HB   ALA 107          3HB       ALA 107 -13.194  -3.618  -6.495
  802   3HB   ALA 107          2HB       ALA 107 -14.009  -5.005  -5.746
  803    H    LYS 108           HN       LYS 108 -11.086  -4.234  -7.771
  804    HA   LYS 108           HA       LYS 108 -11.678  -6.501  -9.347
  805   1HB   LYS 108          2HB       LYS 108 -11.305  -4.247 -10.237
  806   2HB   LYS 108          1HB       LYS 108  -9.623  -4.272  -9.694
  807   1HG   LYS 108          2HG       LYS 108  -9.208  -6.225 -11.270
  808   2HG   LYS 108          1HG       LYS 108 -10.832  -5.946 -11.916
  809   1HD   LYS 108          2HD       LYS 108  -8.482  -3.986 -11.858
  810   2HD   LYS 108          1HD       LYS 108  -9.054  -4.888 -13.265
  811   1HE   LYS 108          2HE       LYS 108 -11.247  -3.677 -13.120
  812   2HE   LYS 108          1HE       LYS 108 -10.602  -2.716 -11.774
  813   1HZ   LYS 108          3HZ       LYS 108  -8.887  -1.928 -13.230
  814   2HZ   LYS 108          2HZ       LYS 108  -9.501  -2.797 -14.488
  815   3HZ   LYS 108          1HZ       LYS 108 -10.380  -1.571 -13.827
  816    H    HIS 109           HN       HIS 109  -8.466  -5.473  -8.082
  817    HA   HIS 109           HA       HIS 109  -7.197  -7.886  -9.111
  818   1HB   HIS 109          1HB       HIS 109  -6.269  -5.649  -7.270
  819   2HB   HIS 109          2HB       HIS 109  -5.253  -7.019  -7.738
  820    HD2  HIS 109           HD2      HIS 109  -6.952  -3.900  -9.473
  821    HE1  HIS 109           HE1      HIS 109  -4.302  -5.708 -12.210
  822    HE2  HIS 109           HE2      HIS 109  -5.820  -3.683 -11.807
  823    H    ALA 110           HN       ALA 110  -8.103  -6.763  -5.825
  824    HA   ALA 110           HA       ALA 110  -7.520  -9.427  -4.676
  825   1HB   ALA 110          3HB       ALA 110  -6.914  -7.251  -3.492
  826   2HB   ALA 110          2HB       ALA 110  -8.644  -6.969  -3.271
  827   3HB   ALA 110          1HB       ALA 110  -7.892  -8.401  -2.559
  828    H    ALA 111           HN       ALA 111  -9.255  -9.907  -6.550
  829    HA   ALA 111           HA       ALA 111 -12.038  -9.581  -5.754
  830   1HB   ALA 111          1HB       ALA 111 -10.709 -11.415  -7.797
  831   2HB   ALA 111          2HB       ALA 111 -12.460 -11.183  -7.607
  832   3HB   ALA 111          3HB       ALA 111 -11.440  -9.825  -8.111
  833    H    ALA 112           HN       ALA 112  -9.622 -12.211  -5.613
  834    HA   ALA 112           HA       ALA 112 -10.566 -13.422  -3.275
  835   1HB   ALA 112          2HB       ALA 112 -11.204 -14.865  -5.900
  836   2HB   ALA 112          1HB       ALA 112 -11.270 -15.593  -4.282
  837   3HB   ALA 112          3HB       ALA 112 -12.405 -14.302  -4.714
   
  No H/Q in entry =         837
  Start of MODEL   10
    1   1H    GLY   1          1HN       GLY   1  -5.270  -7.903   9.945
    2   2H    GLY   1          3HN       GLY   1  -5.158  -7.415  11.542
    3   3H    GLY   1          2HN       GLY   1  -4.883  -6.351  10.306
    4   1HA   GLY   1          1HA       GLY   1  -2.717  -6.873  10.651
    5   2HA   GLY   1          2HA       GLY   1  -3.164  -8.456  11.331
    6    H    GLY   2           HN       GLY   2  -1.146  -8.628   9.527
    7   1HA   GLY   2          1HA       GLY   2  -1.024 -10.440   7.883
    8   2HA   GLY   2          2HA       GLY   2  -2.422  -9.729   7.058
    9    H    SER   3           HN       SER   3  -1.128  -9.429   5.074
   10    HA   SER   3           HA       SER   3   1.263  -7.681   5.199
   11   1HB   SER   3          2HB       SER   3   1.158  -8.102   2.735
   12   2HB   SER   3          1HB       SER   3   1.415  -9.556   3.719
   13    HG   SER   3           HG       SER   3  -1.135  -8.711   2.786
   14    H    VAL   4           HN       VAL   4  -0.377  -6.176   6.296
   15    HA   VAL   4           HA       VAL   4  -1.873  -4.578   4.307
   16    HB   VAL   4           HB       VAL   4  -3.377  -4.138   6.214
   17   1HG1  VAL   4          2HG12     VAL   4  -3.637  -6.272   4.842
   18   2HG1  VAL   4          3HG13     VAL   4  -2.803  -7.129   6.148
   19   3HG1  VAL   4          1HG11     VAL   4  -4.328  -6.334   6.484
   20   1HG2  VAL   4          2HG22     VAL   4  -1.876  -4.074   8.065
   21   2HG2  VAL   4          1HG21     VAL   4  -3.241  -5.169   8.330
   22   3HG2  VAL   4          3HG23     VAL   4  -1.639  -5.839   7.953
   23    H    ILE   5           HN       ILE   5   0.961  -4.330   5.037
   24    HA   ILE   5           HA       ILE   5   1.178  -1.539   5.511
   25    HB   ILE   5           HB       ILE   5   2.866  -2.022   7.525
   26   1HG1  ILE   5          2HG12     ILE   5   2.109  -3.671   9.119
   27   2HG1  ILE   5          1HG11     ILE   5   0.879  -4.289   8.022
   28   1HG2  ILE   5          1HG21     ILE   5   0.797  -0.591   7.603
   29   2HG2  ILE   5          2HG22     ILE   5  -0.105  -2.020   8.156
   30   3HG2  ILE   5          3HG23     ILE   5   1.229  -1.387   9.121
   31   1HD1  ILE   5          2HD12     ILE   5   3.879  -4.348   7.453
   32   2HD1  ILE   5          1HD11     ILE   5   2.966  -5.679   8.190
   33   3HD1  ILE   5          3HD13     ILE   5   2.601  -5.187   6.536
   34    H    VAL   6           HN       VAL   6   3.661  -1.178   5.818
   35    HA   VAL   6           HA       VAL   6   5.478  -3.059   4.693
   36    HB   VAL   6           HB       VAL   6   4.285  -1.991   2.682
   37   1HG1  VAL   6          1HG11     VAL   6   4.349   0.311   3.719
   38   2HG1  VAL   6          3HG13     VAL   6   6.036   0.430   3.182
   39   3HG1  VAL   6          2HG12     VAL   6   4.760   0.177   1.992
   40   1HG2  VAL   6          1HG21     VAL   6   6.461  -3.197   2.514
   41   2HG2  VAL   6          2HG22     VAL   6   6.195  -1.947   1.291
   42   3HG2  VAL   6          3HG23     VAL   6   7.306  -1.648   2.624
   43    H    ILE   7           HN       ILE   7   7.384  -0.831   4.276
   44    HA   ILE   7           HA       ILE   7   7.353   0.754   6.678
   45    HB   ILE   7           HB       ILE   7   7.906  -1.504   7.553
   46   1HG1  ILE   7          2HG12     ILE   7  10.373   0.285   7.716
   47   2HG1  ILE   7          1HG11     ILE   7   8.865   0.564   8.621
   48   1HG2  ILE   7          3HG23     ILE   7   9.076  -2.280   5.426
   49   2HG2  ILE   7          1HG21     ILE   7  10.454  -1.261   5.919
   50   3HG2  ILE   7          2HG22     ILE   7   9.947  -2.650   6.909
   51   1HD1  ILE   7          2HD12     ILE   7   9.095  -1.776   9.567
   52   2HD1  ILE   7          3HD13     ILE   7  10.703  -1.865   8.817
   53   3HD1  ILE   7          1HD11     ILE   7  10.378  -0.647  10.055
   54    H    ASP   8           HN       ASP   8   9.490   1.989   6.748
   55    HA   ASP   8           HA       ASP   8   9.697   3.257   4.173
   56   1HB   ASP   8          2HB       ASP   8  11.069   4.858   5.355
   57   2HB   ASP   8          1HB       ASP   8   9.752   4.417   6.443
   58    H    SER   9           HN       SER   9  11.761   1.110   6.042
   59    HA   SER   9           HA       SER   9  14.179   1.490   4.643
   60   1HB   SER   9          2HB       SER   9  13.134  -1.025   5.980
   61   2HB   SER   9          1HB       SER   9  14.825  -0.684   5.561
   62    HG   SER   9           HG       SER   9  13.313   1.088   7.213
   63    H    LYS  10           HN       LYS  10  14.115   1.476   2.441
   64    HA   LYS  10           HA       LYS  10  12.648   0.304   0.599
   65   1HB   LYS  10          1HB       LYS  10  14.603   1.785   0.332
   66   2HB   LYS  10          2HB       LYS  10  15.708   0.416   0.423
   67   1HG   LYS  10          1HG       LYS  10  13.461   0.427  -1.619
   68   2HG   LYS  10          2HG       LYS  10  14.913   1.403  -1.895
   69   1HD   LYS  10          1HD       LYS  10  16.347  -0.589  -1.779
   70   2HD   LYS  10          2HD       LYS  10  14.960  -1.614  -1.404
   71   1HE   LYS  10          1HE       LYS  10  15.488  -1.869  -3.728
   72   2HE   LYS  10          2HE       LYS  10  13.916  -1.078  -3.570
   73   1HZ   LYS  10          2HZ       LYS  10  16.471   0.275  -4.126
   74   2HZ   LYS  10          1HZ       LYS  10  15.293  -0.054  -5.231
   75   3HZ   LYS  10          3HZ       LYS  10  15.000   1.013  -4.012
   76    H    ALA  11           HN       ALA  11  15.473  -1.453   1.924
   77    HA   ALA  11           HA       ALA  11  15.287  -3.815   0.424
   78   1HB   ALA  11          1HB       ALA  11  17.125  -3.321   2.000
   79   2HB   ALA  11          2HB       ALA  11  16.019  -3.541   3.377
   80   3HB   ALA  11          3HB       ALA  11  16.420  -4.916   2.327
   81    H    ALA  12           HN       ALA  12  13.349  -2.847   3.249
   82    HA   ALA  12           HA       ALA  12  12.103  -5.419   3.663
   83   1HB   ALA  12          2HB       ALA  12  12.336  -3.626   5.419
   84   2HB   ALA  12          1HB       ALA  12  11.177  -2.672   4.463
   85   3HB   ALA  12          3HB       ALA  12  10.670  -4.209   5.188
   86    H    TRP  13           HN       TRP  13  11.517  -2.654   1.488
   87    HA   TRP  13           HA       TRP  13   8.730  -3.259   0.958
   88   1HB   TRP  13          2HB       TRP  13   8.870  -1.340  -0.109
   89   2HB   TRP  13          1HB       TRP  13  10.588  -1.236   0.151
   90    HD1  TRP  13           HD1      TRP  13  12.116  -2.416  -1.918
   91    HE1  TRP  13           HE1      TRP  13  11.721  -2.475  -4.426
   92    HE3  TRP  13           HE3      TRP  13   7.192  -0.982  -1.995
   93    HZ2  TRP  13           HZ2      TRP  13   9.644  -1.791  -6.251
   94    HZ3  TRP  13           HZ3      TRP  13   6.104  -0.514  -4.175
   95    HH2  TRP  13           HH2      TRP  13   7.280  -0.984  -6.300
   96    H    ASP  14           HN       ASP  14  11.864  -4.109  -0.537
   97    HA   ASP  14           HA       ASP  14  10.842  -5.860  -2.546
   98   1HB   ASP  14          2HB       ASP  14  13.536  -5.977  -1.109
   99   2HB   ASP  14          1HB       ASP  14  13.115  -6.819  -2.597
  100    H    ALA  15           HN       ALA  15  12.052  -6.477   0.739
  101    HA   ALA  15           HA       ALA  15  11.610  -9.240   0.858
  102   1HB   ALA  15          1HB       ALA  15  12.696  -7.841   2.660
  103   2HB   ALA  15          3HB       ALA  15  11.063  -7.337   3.168
  104   3HB   ALA  15          2HB       ALA  15  11.529  -9.038   3.257
  105    H    GLN  16           HN       GLN  16   9.281  -6.627   1.583
  106    HA   GLN  16           HA       GLN  16   7.069  -8.246   2.245
  107   1HB   GLN  16          2HB       GLN  16   7.507  -5.409   1.681
  108   2HB   GLN  16          1HB       GLN  16   6.081  -5.980   0.853
  109   1HG   GLN  16          2HG       GLN  16   5.320  -5.270   2.961
  110   2HG   GLN  16          1HG       GLN  16   5.239  -7.015   2.967
  111   1HE2  GLN  16          1HE21     GLN  16   8.326  -5.455   5.259
  112   2HE2  GLN  16          2HE22     GLN  16   8.333  -5.165   3.527
  113    H    LEU  17           HN       LEU  17   8.000  -6.884  -1.006
  114    HA   LEU  17           HA       LEU  17   5.967  -8.076  -2.501
  115   1HB   LEU  17          2HB       LEU  17   8.895  -7.951  -3.371
  116   2HB   LEU  17          1HB       LEU  17   7.468  -8.103  -4.369
  117    HG   LEU  17           HG       LEU  17   8.342  -5.631  -2.868
  118   1HD1  LEU  17          3HD23     LEU  17   9.563  -6.132  -4.960
  119   2HD1  LEU  17          1HD21     LEU  17   8.019  -6.235  -5.833
  120   3HD1  LEU  17          2HD22     LEU  17   8.538  -4.692  -5.129
  121   1HD2  LEU  17          2HD12     LEU  17   5.871  -5.810  -2.830
  122   2HD2  LEU  17          3HD13     LEU  17   6.425  -4.491  -3.872
  123   3HD2  LEU  17          1HD11     LEU  17   5.879  -6.016  -4.602
  124    H    ALA  18           HN       ALA  18   9.096  -9.525  -1.538
  125    HA   ALA  18           HA       ALA  18   8.660 -12.033  -2.835
  126   1HB   ALA  18          3HB       ALA  18  10.866 -11.176  -2.121
  127   2HB   ALA  18          1HB       ALA  18  10.402 -11.380  -0.419
  128   3HB   ALA  18          2HB       ALA  18  10.541 -12.801  -1.475
  129    H    LYS  19           HN       LYS  19   8.224 -11.244   0.687
  130    HA   LYS  19           HA       LYS  19   7.166 -13.883   1.204
  131   1HB   LYS  19          2HB       LYS  19   6.352 -13.006   3.300
  132   2HB   LYS  19          1HB       LYS  19   8.048 -12.600   3.050
  133   1HG   LYS  19          1HG       LYS  19   7.639 -10.362   2.721
  134   2HG   LYS  19          2HG       LYS  19   5.958 -10.544   2.272
  135   1HD   LYS  19          1HD       LYS  19   7.159 -10.893   5.065
  136   2HD   LYS  19          2HD       LYS  19   6.247  -9.496   4.494
  137   1HE   LYS  19          1HE       LYS  19   5.183 -12.298   5.036
  138   2HE   LYS  19          2HE       LYS  19   4.753 -10.782   5.824
  139   1HZ   LYS  19          3HZ       LYS  19   3.814 -10.049   3.734
  140   2HZ   LYS  19          2HZ       LYS  19   4.171 -11.504   3.039
  141   3HZ   LYS  19          1HZ       LYS  19   3.092 -11.430   4.280
  142    H    GLY  20           HN       GLY  20   5.718 -10.995  -0.175
  143   1HA   GLY  20          1HA       GLY  20   3.000 -11.493   0.374
  144   2HA   GLY  20          2HA       GLY  20   3.678 -10.529  -0.950
  145    H    LYS  21           HN       LYS  21   4.445 -13.963  -0.799
  146    HA   LYS  21           HA       LYS  21   3.996 -15.693  -2.213
  147   1HB   LYS  21          2HB       LYS  21   1.166 -14.640  -1.844
  148   2HB   LYS  21          1HB       LYS  21   1.606 -16.287  -2.315
  149   1HG   LYS  21          2HG       LYS  21   2.307 -14.929   0.333
  150   2HG   LYS  21          1HG       LYS  21   0.965 -16.048   0.063
  151   1HD   LYS  21          2HD       LYS  21   2.605 -17.844  -0.556
  152   2HD   LYS  21          1HD       LYS  21   3.936 -16.714  -0.244
  153   1HE   LYS  21          2HE       LYS  21   3.672 -18.135   1.682
  154   2HE   LYS  21          1HE       LYS  21   3.231 -16.474   2.110
  155   1HZ   LYS  21          1HZ       LYS  21   1.344 -18.633   1.450
  156   2HZ   LYS  21          3HZ       LYS  21   1.695 -18.096   2.968
  157   3HZ   LYS  21          2HZ       LYS  21   0.936 -17.100   1.899
  158    H    GLU  22           HN       GLU  22   5.173 -14.444  -3.780
  159    HA   GLU  22           HA       GLU  22   3.938 -13.163  -6.019
  160   1HB   GLU  22          1HB       GLU  22   6.719 -14.391  -5.719
  161   2HB   GLU  22          2HB       GLU  22   6.171 -13.267  -6.968
  162   1HG   GLU  22          2HG       GLU  22   5.612 -11.606  -5.120
  163   2HG   GLU  22          1HG       GLU  22   6.440 -12.692  -3.992
  164    H    GLU  23           HN       GLU  23   2.359 -14.929  -6.064
  165    HA   GLU  23           HA       GLU  23   3.080 -17.092  -8.030
  166   1HB   GLU  23          1HB       GLU  23   0.610 -16.756  -6.247
  167   2HB   GLU  23          2HB       GLU  23   0.897 -18.074  -7.391
  168   1HG   GLU  23          2HG       GLU  23   2.885 -18.768  -6.098
  169   2HG   GLU  23          1HG       GLU  23   2.670 -17.407  -4.986
  170    H    HIS  24           HN       HIS  24   0.241 -15.112  -7.292
  171    HA   HIS  24           HA       HIS  24   0.283 -13.572  -9.769
  172   1HB   HIS  24          2HB       HIS  24  -1.910 -14.437 -10.522
  173   2HB   HIS  24          1HB       HIS  24  -0.753 -15.770 -10.451
  174    HD2  HIS  24           HD2      HIS  24  -3.908 -14.433  -8.522
  175    HE1  HIS  24           HE1      HIS  24  -2.835 -18.147  -6.816
  176    HE2  HIS  24           HE2      HIS  24  -4.548 -16.226  -6.764
  177    H    LYS  25           HN       LYS  25   0.307 -13.298  -6.779
  178    HA   LYS  25           HA       LYS  25  -2.350 -12.463  -6.034
  179   1HB   LYS  25          2HB       LYS  25   0.354 -12.394  -4.651
  180   2HB   LYS  25          1HB       LYS  25  -1.093 -11.740  -3.884
  181   1HG   LYS  25          1HG       LYS  25  -1.011 -14.601  -4.947
  182   2HG   LYS  25          2HG       LYS  25  -0.459 -14.160  -3.329
  183   1HD   LYS  25          1HD       LYS  25  -2.635 -13.171  -2.785
  184   2HD   LYS  25          2HD       LYS  25  -3.277 -13.606  -4.379
  185   1HE   LYS  25          1HE       LYS  25  -2.232 -15.642  -2.367
  186   2HE   LYS  25          2HE       LYS  25  -3.932 -15.160  -2.536
  187   1HZ   LYS  25          2HZ       LYS  25  -2.345 -16.352  -4.689
  188   2HZ   LYS  25          3HZ       LYS  25  -3.476 -17.120  -3.761
  189   3HZ   LYS  25          1HZ       LYS  25  -3.939 -15.897  -4.749
  190    HA   PRO  26           HA       PRO  26  -1.840  -8.167  -7.198
  191   1HB   PRO  26          1HB       PRO  26  -3.936  -7.039  -5.859
  192   2HB   PRO  26          2HB       PRO  26  -4.145  -8.140  -7.253
  193   1HG   PRO  26          1HG       PRO  26  -4.184  -8.877  -4.320
  194   2HG   PRO  26          2HG       PRO  26  -5.456  -9.228  -5.504
  195   1HD   PRO  26          1HD       PRO  26  -3.576 -11.038  -4.835
  196   2HD   PRO  26          2HD       PRO  26  -4.053 -10.867  -6.549
  197    H    ILE  27           HN       ILE  27  -0.084  -7.142  -6.475
  198    HA   ILE  27           HA       ILE  27   0.120  -6.497  -3.595
  199    HB   ILE  27           HB       ILE  27   2.202  -6.238  -5.782
  200   1HG1  ILE  27          2HG12     ILE  27   2.212  -8.292  -3.549
  201   2HG1  ILE  27          1HG11     ILE  27   1.516  -8.647  -5.129
  202   1HG2  ILE  27          2HG22     ILE  27   2.338  -5.943  -2.748
  203   2HG2  ILE  27          1HG21     ILE  27   3.720  -5.859  -3.850
  204   3HG2  ILE  27          3HG23     ILE  27   2.466  -4.627  -3.933
  205   1HD1  ILE  27          3HD13     ILE  27   3.685  -8.131  -6.210
  206   2HD1  ILE  27          1HD11     ILE  27   4.408  -7.884  -4.602
  207   3HD1  ILE  27          2HD12     ILE  27   3.773  -9.470  -5.049
  208    H    VAL  28           HN       VAL  28  -1.026  -4.760  -3.186
  209    HA   VAL  28           HA       VAL  28  -1.313  -2.644  -5.269
  210    HB   VAL  28           HB       VAL  28  -2.977  -2.965  -2.746
  211   1HG1  VAL  28          2HG12     VAL  28  -2.901  -0.727  -3.872
  212   2HG1  VAL  28          1HG11     VAL  28  -3.400  -1.487  -5.393
  213   3HG1  VAL  28          3HG13     VAL  28  -4.503  -1.483  -4.004
  214   1HG2  VAL  28          3HG23     VAL  28  -3.581  -4.031  -5.538
  215   2HG2  VAL  28          2HG22     VAL  28  -3.328  -4.998  -4.077
  216   3HG2  VAL  28          1HG21     VAL  28  -4.734  -3.934  -4.194
  217    H    VAL  29           HN       VAL  29   0.277  -1.130  -4.959
  218    HA   VAL  29           HA       VAL  29   1.107  -0.569  -2.144
  219    HB   VAL  29           HB       VAL  29   2.907  -1.503  -3.465
  220   1HG1  VAL  29          3HG13     VAL  29   2.296  -0.701  -5.720
  221   2HG1  VAL  29          1HG11     VAL  29   2.773   0.935  -5.191
  222   3HG1  VAL  29          2HG12     VAL  29   3.973  -0.360  -5.261
  223   1HG2  VAL  29          2HG22     VAL  29   3.191   0.275  -1.635
  224   2HG2  VAL  29          1HG21     VAL  29   4.521   0.198  -2.797
  225   3HG2  VAL  29          3HG23     VAL  29   3.309   1.483  -2.921
  226    H    ASP  30           HN       ASP  30   0.457   1.165  -1.311
  227    HA   ASP  30           HA       ASP  30  -0.685   3.417  -2.841
  228   1HB   ASP  30          1HB       ASP  30  -1.938   2.752  -0.923
  229   2HB   ASP  30          2HB       ASP  30  -0.494   2.598   0.078
  230    H    PHE  31           HN       PHE  31   1.028   4.513  -3.818
  231    HA   PHE  31           HA       PHE  31   3.394   5.270  -2.157
  232   1HB   PHE  31          2HB       PHE  31   2.782   5.638  -5.105
  233   2HB   PHE  31          1HB       PHE  31   4.139   6.334  -4.263
  234    HD1  PHE  31           HD1      PHE  31   5.961   4.901  -3.310
  235    HD2  PHE  31           HD2      PHE  31   2.894   3.366  -5.915
  236    HE1  PHE  31           HE1      PHE  31   7.600   3.345  -4.316
  237    HE2  PHE  31           HE2      PHE  31   4.551   1.819  -6.937
  238    HZ   PHE  31           HZ       PHE  31   6.927   1.918  -6.265
  239    H    THR  32           HN       THR  32   2.620   6.872  -0.792
  240    HA   THR  32           HA       THR  32   1.490   9.302  -2.064
  241    HB   THR  32           HB       THR  32   0.320   7.904   0.380
  242    HG1  THR  32           HG1      THR  32  -0.681   7.158  -1.384
  243   1HG2  THR  32          2HG22     THR  32  -0.250  10.679  -0.770
  244   2HG2  THR  32          3HG23     THR  32  -1.299   9.824   0.370
  245   3HG2  THR  32          1HG21     THR  32   0.324  10.304   0.876
  246    H    ALA  33           HN       ALA  33   2.023  11.213  -0.820
  247    HA   ALA  33           HA       ALA  33   4.665  10.863   0.475
  248   1HB   ALA  33          2HB       ALA  33   4.408  12.465  -1.397
  249   2HB   ALA  33          3HB       ALA  33   3.180  13.354  -0.461
  250   3HB   ALA  33          1HB       ALA  33   4.862  13.275   0.107
  251    H    THR  34           HN       THR  34   5.171  11.954   2.432
  252    HA   THR  34           HA       THR  34   3.210  11.904   4.530
  253    HB   THR  34           HB       THR  34   5.866  13.391   4.472
  254    HG1  THR  34           HG1      THR  34   5.368  10.591   4.686
  255   1HG2  THR  34          1HG21     THR  34   4.424  11.844   6.673
  256   2HG2  THR  34          2HG22     THR  34   5.991  12.673   6.819
  257   3HG2  THR  34          3HG23     THR  34   4.517  13.617   6.533
  258    H    TRP  35           HN       TRP  35   4.402  14.207   2.228
  259    HA   TRP  35           HA       TRP  35   3.534  16.693   3.239
  260   1HB   TRP  35          1HB       TRP  35   4.433  15.472   0.642
  261   2HB   TRP  35          2HB       TRP  35   3.469  16.905   0.465
  262    HD1  TRP  35           HD1      TRP  35   6.852  15.812   1.844
  263    HE1  TRP  35           HE1      TRP  35   8.319  17.929   2.148
  264    HE3  TRP  35           HE3      TRP  35   3.342  19.391   0.848
  265    HZ2  TRP  35           HZ2      TRP  35   7.992  20.778   1.998
  266    HZ3  TRP  35           HZ3      TRP  35   3.940  21.803   0.956
  267    HH2  TRP  35           HH2      TRP  35   6.256  22.500   1.525
  268    H    CYS  36           HN       CYS  36   2.040  18.033   1.803
  269    HA   CYS  36           HA       CYS  36   0.020  18.696   1.070
  270   1HB   CYS  36          2HB       CYS  36   0.030  17.178  -0.693
  271   2HB   CYS  36          1HB       CYS  36  -0.209  15.786   0.338
  272    H    GLY  37           HN       GLY  37  -0.600  15.655   2.832
  273   1HA   GLY  37          1HA       GLY  37  -1.506  15.574   5.036
  274   2HA   GLY  37          2HA       GLY  37  -2.249  17.161   4.830
  275    HA   PRO  38           HA       PRO  38  -6.181  15.362   3.852
  276   1HB   PRO  38          1HB       PRO  38  -6.056  16.806   1.188
  277   2HB   PRO  38          2HB       PRO  38  -7.446  16.644   2.302
  278   1HG   PRO  38          2HG       PRO  38  -5.991  18.918   2.356
  279   2HG   PRO  38          1HG       PRO  38  -6.394  18.119   3.907
  280   1HD   PRO  38          2HD       PRO  38  -3.827  17.950   2.327
  281   2HD   PRO  38          1HD       PRO  38  -4.041  18.241   4.081
  282    H    CYS  39           HN       CYS  39  -3.949  15.402   1.131
  283    HA   CYS  39           HA       CYS  39  -4.765  13.325  -0.524
  284   1HB   CYS  39          1HB       CYS  39  -1.921  13.968   0.408
  285   2HB   CYS  39          2HB       CYS  39  -2.347  13.014  -1.004
  286    H    LYS  40           HN       LYS  40  -3.136  13.108   2.627
  287    HA   LYS  40           HA       LYS  40  -2.556  10.271   2.346
  288   1HB   LYS  40          1HB       LYS  40  -1.230  12.250   3.511
  289   2HB   LYS  40          2HB       LYS  40  -2.258  11.862   4.901
  290   1HG   LYS  40          2HG       LYS  40  -1.421   9.505   4.812
  291   2HG   LYS  40          1HG       LYS  40  -0.508   9.909   3.340
  292   1HD   LYS  40          2HD       LYS  40   0.697  11.704   4.672
  293   2HD   LYS  40          1HD       LYS  40  -0.102  11.083   6.124
  294   1HE   LYS  40          2HE       LYS  40   2.171  10.167   5.921
  295   2HE   LYS  40          1HE       LYS  40   0.996   8.855   5.751
  296   1HZ   LYS  40          3HZ       LYS  40   2.161  10.264   3.454
  297   2HZ   LYS  40          2HZ       LYS  40   2.856   8.928   4.129
  298   3HZ   LYS  40          1HZ       LYS  40   1.350   8.830   3.453
  299    H    MET  41           HN       MET  41  -5.350  12.032   3.356
  300    HA   MET  41           HA       MET  41  -6.251  10.399   5.543
  301   1HB   MET  41          1HB       MET  41  -7.802  11.859   3.357
  302   2HB   MET  41          2HB       MET  41  -8.529  11.183   4.812
  303   1HG   MET  41          2HG       MET  41  -6.324  13.285   4.850
  304   2HG   MET  41          1HG       MET  41  -8.046  13.634   4.899
  305   1HE   MET  41          3HE       MET  41  -9.598  13.041   6.868
  306   2HE   MET  41          2HE       MET  41  -9.128  11.328   7.038
  307   3HE   MET  41          1HE       MET  41  -9.065  12.410   8.444
  308    H    ILE  42           HN       ILE  42  -6.175   9.831   2.100
  309    HA   ILE  42           HA       ILE  42  -7.967   7.584   2.074
  310    HB   ILE  42           HB       ILE  42  -5.667   8.428   0.264
  311   1HG1  ILE  42          2HG12     ILE  42  -8.703   8.461  -0.120
  312   2HG1  ILE  42          1HG11     ILE  42  -7.774   9.848   0.463
  313   1HG2  ILE  42          1HG21     ILE  42  -7.669   6.130  -0.027
  314   2HG2  ILE  42          3HG23     ILE  42  -6.688   6.746  -1.364
  315   3HG2  ILE  42          2HG22     ILE  42  -5.898   5.998   0.015
  316   1HD1  ILE  42          3HD13     ILE  42  -6.429   9.842  -1.619
  317   2HD1  ILE  42          2HD12     ILE  42  -7.483   8.563  -2.275
  318   3HD1  ILE  42          1HD11     ILE  42  -8.164  10.138  -1.857
  319    H    ALA  43           HN       ALA  43  -4.623   7.905   3.209
  320    HA   ALA  43           HA       ALA  43  -3.767   5.250   2.930
  321   1HB   ALA  43          3HB       ALA  43  -2.278   7.083   3.531
  322   2HB   ALA  43          2HB       ALA  43  -3.017   7.223   5.135
  323   3HB   ALA  43          1HB       ALA  43  -2.153   5.751   4.689
  324    HA   PRO  44           HA       PRO  44  -5.486   3.998   7.233
  325   1HB   PRO  44          1HB       PRO  44  -7.569   5.465   8.346
  326   2HB   PRO  44          2HB       PRO  44  -5.842   5.645   8.761
  327   1HG   PRO  44          1HG       PRO  44  -7.444   7.264   6.772
  328   2HG   PRO  44          2HG       PRO  44  -6.355   7.874   8.053
  329   1HD   PRO  44          1HD       PRO  44  -5.416   7.684   5.556
  330   2HD   PRO  44          2HD       PRO  44  -4.420   7.082   6.901
  331    H    LEU  45           HN       LEU  45  -7.704   5.588   4.953
  332    HA   LEU  45           HA       LEU  45  -9.885   3.700   5.286
  333   1HB   LEU  45          2HB       LEU  45  -9.071   5.355   2.851
  334   2HB   LEU  45          1HB       LEU  45 -10.574   4.465   3.013
  335    HG   LEU  45           HG       LEU  45  -9.656   6.824   4.736
  336   1HD1  LEU  45          1HD11     LEU  45 -10.362   7.397   2.430
  337   2HD1  LEU  45          3HD13     LEU  45 -11.915   6.575   2.716
  338   3HD1  LEU  45          2HD12     LEU  45 -11.486   8.027   3.647
  339   1HD2  LEU  45          1HD21     LEU  45 -12.223   5.179   4.873
  340   2HD2  LEU  45          3HD23     LEU  45 -11.017   5.393   6.166
  341   3HD2  LEU  45          2HD22     LEU  45 -12.000   6.761   5.648
  342    H    PHE  46           HN       PHE  46  -7.239   3.924   2.933
  343    HA   PHE  46           HA       PHE  46  -7.591   1.448   1.606
  344   1HB   PHE  46          1HB       PHE  46  -6.212   3.240   0.784
  345   2HB   PHE  46          2HB       PHE  46  -5.170   3.189   2.188
  346    HD1  PHE  46           HD2      PHE  46  -6.072   1.297  -0.912
  347    HD2  PHE  46           HD1      PHE  46  -3.336   1.708   2.388
  348    HE1  PHE  46           HE2      PHE  46  -4.362   0.024  -2.166
  349    HE2  PHE  46           HE1      PHE  46  -1.659   0.333   1.161
  350    HZ   PHE  46           HZ       PHE  46  -2.129  -0.464  -1.113
  351    H    GLU  47           HN       GLU  47  -5.813   2.292   4.603
  352    HA   GLU  47           HA       GLU  47  -4.723  -0.248   5.151
  353   1HB   GLU  47          1HB       GLU  47  -4.299   2.092   6.224
  354   2HB   GLU  47          2HB       GLU  47  -5.588   1.634   7.347
  355   1HG   GLU  47          1HG       GLU  47  -4.338  -0.347   8.042
  356   2HG   GLU  47          2HG       GLU  47  -3.113  -0.071   6.794
  357    H    THR  48           HN       THR  48  -7.950   1.123   5.860
  358    HA   THR  48           HA       THR  48  -8.823  -1.000   7.587
  359    HB   THR  48           HB       THR  48 -10.554   0.690   5.724
  360    HG1  THR  48           HG1      THR  48  -9.115   1.925   7.138
  361   1HG2  THR  48          2HG22     THR  48 -11.131  -0.690   8.377
  362   2HG2  THR  48          1HG21     THR  48 -12.253   0.340   7.467
  363   3HG2  THR  48          3HG23     THR  48 -11.728  -1.212   6.786
  364    H    LEU  49           HN       LEU  49  -9.175  -0.441   4.035
  365    HA   LEU  49           HA       LEU  49 -10.343  -2.980   3.431
  366   1HB   LEU  49          2HB       LEU  49  -8.765  -0.958   1.810
  367   2HB   LEU  49          1HB       LEU  49  -9.132  -2.563   1.176
  368    HG   LEU  49           HG       LEU  49 -11.526  -2.250   1.592
  369   1HD1  LEU  49          2HD22     LEU  49 -10.740   0.638   2.176
  370   2HD1  LEU  49          1HD21     LEU  49 -12.394   0.066   1.874
  371   3HD1  LEU  49          3HD23     LEU  49 -11.526  -0.494   3.307
  372   1HD2  LEU  49          3HD13     LEU  49 -10.497  -1.880  -0.625
  373   2HD2  LEU  49          1HD11     LEU  49 -11.879  -0.806  -0.357
  374   3HD2  LEU  49          2HD12     LEU  49 -10.221  -0.172  -0.213
  375    H    SER  50           HN       SER  50  -6.960  -1.965   3.697
  376    HA   SER  50           HA       SER  50  -5.621  -4.379   3.011
  377   1HB   SER  50          1HB       SER  50  -4.743  -2.608   5.298
  378   2HB   SER  50          2HB       SER  50  -3.819  -3.634   4.215
  379    HG   SER  50           HG       SER  50  -5.252  -1.521   3.103
  380    H    ASN  51           HN       ASN  51  -6.820  -3.397   6.251
  381    HA   ASN  51           HA       ASN  51  -6.241  -5.935   7.467
  382   1HB   ASN  51          2HB       ASN  51  -8.102  -3.652   8.201
  383   2HB   ASN  51          1HB       ASN  51  -8.025  -5.153   9.130
  384   1HD2  ASN  51          1HD21     ASN  51  -4.857  -2.555   9.338
  385   2HD2  ASN  51          2HD22     ASN  51  -6.102  -2.311   8.121
  386    H    ASP  52           HN       ASP  52  -9.163  -4.781   5.732
  387    HA   ASP  52           HA       ASP  52 -10.775  -7.035   6.336
  388   1HB   ASP  52          2HB       ASP  52 -10.776  -5.369   3.768
  389   2HB   ASP  52          1HB       ASP  52 -12.044  -6.465   4.306
  390    H    TYR  53           HN       TYR  53  -8.525  -6.573   3.551
  391    HA   TYR  53           HA       TYR  53  -9.067  -9.297   2.558
  392   1HB   TYR  53          2HB       TYR  53  -7.164  -7.087   1.796
  393   2HB   TYR  53          1HB       TYR  53  -7.077  -8.670   1.042
  394    HD1  TYR  53           HD1      TYR  53  -8.920  -9.579  -0.369
  395    HD2  TYR  53           HD2      TYR  53  -8.982  -5.546   1.134
  396    HE1  TYR  53           HE1      TYR  53 -10.560  -8.947  -2.106
  397    HE2  TYR  53           HE2      TYR  53 -10.670  -4.933  -0.549
  398    HH   TYR  53           HH       TYR  53 -11.941  -5.661  -2.333
  399    H    ALA  54           HN       ALA  54  -6.642  -7.777   4.573
  400    HA   ALA  54           HA       ALA  54  -4.997  -8.463   5.877
  401   1HB   ALA  54          3HB       ALA  54  -6.759  -9.832   6.867
  402   2HB   ALA  54          2HB       ALA  54  -6.421 -11.163   5.745
  403   3HB   ALA  54          1HB       ALA  54  -5.203 -10.678   6.941
  404    H    GLY  55           HN       GLY  55  -5.368 -11.343   3.864
  405   1HA   GLY  55          1HA       GLY  55  -2.458 -11.228   3.086
  406   2HA   GLY  55          2HA       GLY  55  -3.224 -12.716   3.653
  407    H    LYS  56           HN       LYS  56  -5.795 -11.609   2.074
  408    HA   LYS  56           HA       LYS  56  -5.362 -13.246  -0.243
  409   1HB   LYS  56          2HB       LYS  56  -7.404 -11.122   0.506
  410   2HB   LYS  56          1HB       LYS  56  -7.534 -12.058  -0.983
  411   1HG   LYS  56          1HG       LYS  56  -7.176 -13.645   1.551
  412   2HG   LYS  56          2HG       LYS  56  -8.687 -12.752   1.389
  413   1HD   LYS  56          2HD       LYS  56  -8.925 -15.038   0.554
  414   2HD   LYS  56          1HD       LYS  56  -9.214 -13.844  -0.721
  415   1HE   LYS  56          2HE       LYS  56  -6.983 -14.262  -1.678
  416   2HE   LYS  56          1HE       LYS  56  -6.584 -15.363  -0.343
  417   1HZ   LYS  56          3HZ       LYS  56  -8.775 -15.761  -2.249
  418   2HZ   LYS  56          1HZ       LYS  56  -7.281 -16.432  -2.376
  419   3HZ   LYS  56          2HZ       LYS  56  -8.259 -16.830  -1.100
  420    H    VAL  57           HN       VAL  57  -4.910  -9.830   0.451
  421    HA   VAL  57           HA       VAL  57  -3.769  -9.349  -2.242
  422    HB   VAL  57           HB       VAL  57  -5.598  -7.588  -0.599
  423   1HG1  VAL  57          1HG11     VAL  57  -3.902  -6.217  -1.808
  424   2HG1  VAL  57          2HG12     VAL  57  -4.403  -6.962  -3.331
  425   3HG1  VAL  57          3HG13     VAL  57  -5.532  -5.947  -2.435
  426   1HG2  VAL  57          2HG22     VAL  57  -6.156  -8.946  -3.251
  427   2HG2  VAL  57          1HG21     VAL  57  -6.940  -9.269  -1.709
  428   3HG2  VAL  57          3HG23     VAL  57  -7.196  -7.715  -2.511
  429    H    ILE  58           HN       ILE  58  -1.861  -8.119  -2.127
  430    HA   ILE  58           HA       ILE  58  -0.745  -7.845   0.641
  431    HB   ILE  58           HB       ILE  58   0.657  -7.665  -2.034
  432   1HG1  ILE  58          1HG11     ILE  58  -0.243  -9.850  -2.031
  433   2HG1  ILE  58          2HG12     ILE  58   1.466  -9.924  -1.652
  434   1HG2  ILE  58          2HG22     ILE  58   1.805  -6.630  -0.073
  435   2HG2  ILE  58          3HG23     ILE  58   1.835  -8.227   0.694
  436   3HG2  ILE  58          1HG21     ILE  58   2.687  -7.965  -0.827
  437   1HD1  ILE  58          3HD13     ILE  58   0.906 -10.277   0.765
  438   2HD1  ILE  58          1HD11     ILE  58  -0.823 -10.223   0.349
  439   3HD1  ILE  58          2HD12     ILE  58   0.203 -11.509  -0.292
  440    H    PHE  59           HN       PHE  59  -1.471  -5.884   1.457
  441    HA   PHE  59           HA       PHE  59  -1.638  -3.520  -0.381
  442   1HB   PHE  59          2HB       PHE  59  -2.766  -4.122   2.319
  443   2HB   PHE  59          1HB       PHE  59  -2.584  -2.480   1.750
  444    HD1  PHE  59           HD2      PHE  59  -4.131  -5.760   0.713
  445    HD2  PHE  59           HD1      PHE  59  -4.420  -1.466   0.801
  446    HE1  PHE  59           HE2      PHE  59  -6.547  -5.857   0.068
  447    HE2  PHE  59           HE1      PHE  59  -6.783  -1.589   0.158
  448    HZ   PHE  59           HZ       PHE  59  -7.875  -3.837  -0.070
  449    H    LEU  60           HN       LEU  60   0.189  -2.349  -0.460
  450    HA   LEU  60           HA       LEU  60   2.015  -2.218   1.919
  451   1HB   LEU  60          1HB       LEU  60   2.517  -1.841  -1.051
  452   2HB   LEU  60          2HB       LEU  60   3.752  -1.696   0.216
  453    HG   LEU  60           HG       LEU  60   2.186  -4.186  -0.642
  454   1HD1  LEU  60          2HD22     LEU  60   3.934  -3.448  -2.227
  455   2HD1  LEU  60          1HD21     LEU  60   5.134  -3.451  -0.915
  456   3HD1  LEU  60          3HD23     LEU  60   4.363  -4.969  -1.420
  457   1HD2  LEU  60          1HD11     LEU  60   4.377  -3.919   1.449
  458   2HD2  LEU  60          2HD12     LEU  60   2.687  -4.379   1.773
  459   3HD2  LEU  60          3HD13     LEU  60   3.734  -5.451   0.841
  460    H    LYS  61           HN       LYS  61   2.600  -0.178   2.706
  461    HA   LYS  61           HA       LYS  61   1.194   2.213   1.519
  462   1HB   LYS  61          2HB       LYS  61   1.588   1.391   4.421
  463   2HB   LYS  61          1HB       LYS  61   1.055   2.998   3.876
  464   1HG   LYS  61          1HG       LYS  61  -0.895   2.062   2.785
  465   2HG   LYS  61          2HG       LYS  61  -0.359   0.410   3.132
  466   1HD   LYS  61          1HD       LYS  61  -2.179   1.128   4.607
  467   2HD   LYS  61          2HD       LYS  61  -0.736   0.703   5.524
  468   1HE   LYS  61          1HE       LYS  61  -1.186   3.595   4.712
  469   2HE   LYS  61          2HE       LYS  61  -2.121   2.925   6.053
  470   1HZ   LYS  61          3HZ       LYS  61   0.801   2.897   5.944
  471   2HZ   LYS  61          1HZ       LYS  61  -0.122   3.957   6.805
  472   3HZ   LYS  61          2HZ       LYS  61  -0.157   2.353   7.173
  473    H    VAL  62           HN       VAL  62   2.958   2.999   0.350
  474    HA   VAL  62           HA       VAL  62   5.557   3.257   1.804
  475    HB   VAL  62           HB       VAL  62   4.859   3.296  -1.154
  476   1HG1  VAL  62          2HG12     VAL  62   7.521   3.736   0.258
  477   2HG1  VAL  62          1HG11     VAL  62   7.317   3.471  -1.491
  478   3HG1  VAL  62          3HG13     VAL  62   6.695   4.946  -0.752
  479   1HG2  VAL  62          2HG22     VAL  62   6.556   1.464   0.620
  480   2HG2  VAL  62          3HG23     VAL  62   4.984   1.054  -0.102
  481   3HG2  VAL  62          1HG21     VAL  62   6.394   1.324  -1.138
  482    H    ASP  63           HN       ASP  63   6.012   5.087   2.726
  483    HA   ASP  63           HA       ASP  63   4.823   7.658   2.025
  484   1HB   ASP  63          1HB       ASP  63   6.873   6.709   4.024
  485   2HB   ASP  63          2HB       ASP  63   6.813   8.412   3.566
  486    H    VAL  64           HN       VAL  64   5.333   8.253  -0.017
  487    HA   VAL  64           HA       VAL  64   7.515   7.691  -1.618
  488    HB   VAL  64           HB       VAL  64   5.785  10.187  -1.400
  489   1HG1  VAL  64          3HG13     VAL  64   7.829   9.548  -3.552
  490   2HG1  VAL  64          2HG12     VAL  64   6.519  10.733  -3.730
  491   3HG1  VAL  64          1HG11     VAL  64   7.779  10.989  -2.518
  492   1HG2  VAL  64          3HG23     VAL  64   4.736   7.988  -2.053
  493   2HG2  VAL  64          1HG21     VAL  64   4.655   9.207  -3.336
  494   3HG2  VAL  64          2HG22     VAL  64   5.865   7.903  -3.412
  495    H    ASP  65           HN       ASP  65   7.319  10.326   0.758
  496    HA   ASP  65           HA       ASP  65   9.595  11.786   0.429
  497   1HB   ASP  65          2HB       ASP  65   8.412  10.750   3.041
  498   2HB   ASP  65          1HB       ASP  65   9.587  12.064   2.897
  499    H    ALA  66           HN       ALA  66   9.336   8.525   1.897
  500    HA   ALA  66           HA       ALA  66  12.075   8.548   2.922
  501   1HB   ALA  66          1HB       ALA  66   9.963   6.343   2.756
  502   2HB   ALA  66          3HB       ALA  66  11.523   6.245   3.594
  503   3HB   ALA  66          2HB       ALA  66  10.287   7.401   4.140
  504    H    VAL  67           HN       VAL  67  10.399   6.326   0.622
  505    HA   VAL  67           HA       VAL  67  13.074   5.501  -0.364
  506    HB   VAL  67           HB       VAL  67  11.892   3.790  -1.621
  507   1HG1  VAL  67          1HG11     VAL  67  12.763   3.378   0.655
  508   2HG1  VAL  67          3HG13     VAL  67  11.184   3.839   1.323
  509   3HG1  VAL  67          2HG12     VAL  67  11.333   2.402   0.293
  510   1HG2  VAL  67          3HG23     VAL  67   9.661   4.872  -1.942
  511   2HG2  VAL  67          2HG22     VAL  67   9.559   3.291  -1.154
  512   3HG2  VAL  67          1HG21     VAL  67   9.403   4.782  -0.192
  513    H    ALA  68           HN       ALA  68  13.052   7.960  -1.006
  514    HA   ALA  68           HA       ALA  68  11.844   8.985  -3.264
  515   1HB   ALA  68          2HB       ALA  68  13.439  10.221  -1.854
  516   2HB   ALA  68          3HB       ALA  68  14.784   9.238  -2.479
  517   3HB   ALA  68          1HB       ALA  68  13.899  10.330  -3.566
  518    H    ALA  69           HN       ALA  69  14.629   6.761  -3.183
  519    HA   ALA  69           HA       ALA  69  15.251   6.675  -5.937
  520   1HB   ALA  69          1HB       ALA  69  16.694   5.754  -4.177
  521   2HB   ALA  69          2HB       ALA  69  15.494   4.491  -3.821
  522   3HB   ALA  69          3HB       ALA  69  16.319   4.519  -5.394
  523    H    VAL  70           HN       VAL  70  12.936   4.673  -4.030
  524    HA   VAL  70           HA       VAL  70  12.254   2.964  -6.287
  525    HB   VAL  70           HB       VAL  70  10.725   3.456  -3.700
  526   1HG1  VAL  70          1HG21     VAL  70   9.375   2.380  -5.516
  527   2HG1  VAL  70          3HG23     VAL  70  10.618   1.132  -5.677
  528   3HG1  VAL  70          2HG22     VAL  70   9.691   1.278  -4.170
  529   1HG2  VAL  70          2HG12     VAL  70  13.029   2.589  -3.253
  530   2HG2  VAL  70          3HG13     VAL  70  11.780   1.375  -2.918
  531   3HG2  VAL  70          1HG11     VAL  70  12.738   1.276  -4.412
  532    H    ALA  71           HN       ALA  71  10.878   5.822  -4.649
  533    HA   ALA  71           HA       ALA  71   8.506   6.071  -6.135
  534   1HB   ALA  71          1HB       ALA  71   9.017   7.389  -4.114
  535   2HB   ALA  71          2HB       ALA  71  10.265   8.294  -4.994
  536   3HB   ALA  71          3HB       ALA  71   8.570   8.445  -5.470
  537    H    GLU  72           HN       GLU  72  11.693   7.694  -6.856
  538    HA   GLU  72           HA       GLU  72  10.703   8.763  -9.326
  539   1HB   GLU  72          1HB       GLU  72  12.960   9.358  -9.840
  540   2HB   GLU  72          2HB       GLU  72  12.633   9.692  -8.136
  541   1HG   GLU  72          2HG       GLU  72  13.815   7.531  -7.576
  542   2HG   GLU  72          1HG       GLU  72  14.288   7.394  -9.275
  543    H    ALA  73           HN       ALA  73  12.517   5.700  -8.606
  544    HA   ALA  73           HA       ALA  73  12.805   4.852 -11.284
  545   1HB   ALA  73          2HB       ALA  73  13.880   3.740  -9.363
  546   2HB   ALA  73          1HB       ALA  73  12.297   3.168  -8.789
  547   3HB   ALA  73          3HB       ALA  73  12.950   2.581 -10.331
  548    H    ALA  74           HN       ALA  74  10.036   4.504  -9.058
  549    HA   ALA  74           HA       ALA  74   8.378   3.050 -10.980
  550   1HB   ALA  74          2HB       ALA  74   7.861   4.194  -8.222
  551   2HB   ALA  74          1HB       ALA  74   6.712   3.210  -9.150
  552   3HB   ALA  74          3HB       ALA  74   8.261   2.524  -8.639
  553    H    GLY  75           HN       GLY  75   9.349   6.232 -11.076
  554   1HA   GLY  75          1HA       GLY  75   8.529   8.095 -12.073
  555   2HA   GLY  75          2HA       GLY  75   7.334   7.047 -12.863
  556    H    ILE  76           HN       ILE  76   7.548   7.383  -9.331
  557    HA   ILE  76           HA       ILE  76   4.752   8.069  -9.199
  558    HB   ILE  76           HB       ILE  76   6.882   8.250  -7.032
  559   1HG1  ILE  76          1HG11     ILE  76   6.728   6.022  -7.934
  560   2HG1  ILE  76          2HG12     ILE  76   6.054   6.058  -6.305
  561   1HG2  ILE  76          2HG22     ILE  76   3.834   8.328  -6.948
  562   2HG2  ILE  76          3HG23     ILE  76   4.861   8.059  -5.527
  563   3HG2  ILE  76          1HG21     ILE  76   4.960   9.584  -6.407
  564   1HD1  ILE  76          2HD12     ILE  76   4.485   5.939  -8.930
  565   2HD1  ILE  76          3HD13     ILE  76   4.775   4.619  -7.816
  566   3HD1  ILE  76          1HD11     ILE  76   3.778   5.985  -7.292
  567    H    THR  77           HN       THR  77   3.938   9.927  -9.583
  568    HA   THR  77           HA       THR  77   5.418  12.495  -9.169
  569    HB   THR  77           HB       THR  77   4.233  13.056 -11.454
  570    HG1  THR  77           HG1      THR  77   4.588  10.245 -11.772
  571   1HG2  THR  77          1HG21     THR  77   6.656  11.192 -11.385
  572   2HG2  THR  77          3HG23     THR  77   6.175  12.238 -12.735
  573   3HG2  THR  77          2HG22     THR  77   6.684  12.956 -11.195
  574    H    ALA  78           HN       ALA  78   2.298  11.457 -10.530
  575    HA   ALA  78           HA       ALA  78   0.832  13.511  -9.086
  576   1HB   ALA  78          3HB       ALA  78  -0.111  11.134 -10.740
  577   2HB   ALA  78          1HB       ALA  78  -1.129  12.484 -10.190
  578   3HB   ALA  78          2HB       ALA  78   0.193  12.778 -11.337
  579    H    MET  79           HN       MET  79   1.840  12.615  -6.952
  580    HA   MET  79           HA       MET  79   0.631  10.277  -5.809
  581   1HB   MET  79          1HB       MET  79   1.666  10.805  -3.796
  582   2HB   MET  79          2HB       MET  79   2.794  11.268  -5.065
  583   1HG   MET  79          1HG       MET  79   1.017  13.180  -3.478
  584   2HG   MET  79          2HG       MET  79   2.709  12.849  -3.171
  585   1HE   MET  79          1HE       MET  79   1.757  15.732  -3.261
  586   2HE   MET  79          3HE       MET  79   1.748  16.547  -4.844
  587   3HE   MET  79          2HE       MET  79   0.448  15.408  -4.428
  588    HA   PRO  80           HA       PRO  80  -0.682   9.546  -3.597
  589   1HB   PRO  80          1HB       PRO  80  -3.614   9.269  -4.327
  590   2HB   PRO  80          2HB       PRO  80  -2.770   8.595  -2.911
  591   1HG   PRO  80          1HG       PRO  80  -4.243  10.842  -2.635
  592   2HG   PRO  80          2HG       PRO  80  -2.578  10.843  -1.970
  593   1HD   PRO  80          2HD       PRO  80  -3.505  11.900  -4.677
  594   2HD   PRO  80          1HD       PRO  80  -2.514  12.729  -3.451
  595    H    THR  81           HN       THR  81   0.075   7.755  -4.741
  596    HA   THR  81           HA       THR  81  -1.113   7.180  -7.430
  597    HB   THR  81           HB       THR  81   1.790   7.279  -6.595
  598    HG1  THR  81           HG1      THR  81   0.187   9.096  -7.724
  599   1HG2  THR  81          3HG23     THR  81   0.454   6.230  -9.132
  600   2HG2  THR  81          2HG22     THR  81   2.162   6.703  -9.059
  601   3HG2  THR  81          1HG21     THR  81   1.569   5.380  -8.039
  602    H    PHE  82           HN       PHE  82  -2.197   5.342  -7.177
  603    HA   PHE  82           HA       PHE  82  -1.183   3.257  -5.325
  604   1HB   PHE  82          2HB       PHE  82  -3.805   3.534  -6.807
  605   2HB   PHE  82          1HB       PHE  82  -3.382   2.273  -5.650
  606    HD1  PHE  82           HD1      PHE  82  -3.154   2.788  -3.221
  607    HD2  PHE  82           HD2      PHE  82  -4.270   5.856  -6.050
  608    HE1  PHE  82           HE1      PHE  82  -3.683   4.340  -1.356
  609    HE2  PHE  82           HE2      PHE  82  -4.855   7.360  -4.188
  610    HZ   PHE  82           HZ       PHE  82  -4.359   6.669  -1.837
  611    H    HIS  83           HN       HIS  83  -0.048   1.621  -6.188
  612    HA   HIS  83           HA       HIS  83  -0.178   1.034  -9.153
  613   1HB   HIS  83          1HB       HIS  83   2.022   1.340  -7.106
  614   2HB   HIS  83          2HB       HIS  83   2.201   0.044  -8.262
  615    HD2  HIS  83           HD2      HIS  83   0.825   3.531  -9.416
  616    HE1  HIS  83           HE1      HIS  83   4.856   3.224 -10.641
  617    HE2  HIS  83           HE2      HIS  83   2.755   4.632 -10.828
  618    H    VAL  84           HN       VAL  84  -0.433  -0.929  -9.860
  619    HA   VAL  84           HA       VAL  84  -0.831  -3.010  -7.753
  620    HB   VAL  84           HB       VAL  84  -2.260  -2.538 -10.411
  621   1HG1  VAL  84          3HG13     VAL  84  -2.253  -4.961  -8.655
  622   2HG1  VAL  84          1HG11     VAL  84  -3.356  -4.596 -10.033
  623   3HG1  VAL  84          2HG12     VAL  84  -1.627  -4.852 -10.324
  624   1HG2  VAL  84          3HG23     VAL  84  -3.055  -1.476  -8.266
  625   2HG2  VAL  84          1HG21     VAL  84  -4.169  -2.754  -8.873
  626   3HG2  VAL  84          2HG22     VAL  84  -3.048  -3.104  -7.530
  627    H    TYR  85           HN       TYR  85   0.652  -4.436  -7.724
  628    HA   TYR  85           HA       TYR  85   1.860  -5.190 -10.283
  629   1HB   TYR  85          1HB       TYR  85   3.119  -5.310  -7.493
  630   2HB   TYR  85          2HB       TYR  85   3.869  -6.008  -8.913
  631    HD1  TYR  85           HD2      TYR  85   3.009  -2.860  -7.166
  632    HD2  TYR  85           HD1      TYR  85   5.066  -4.631 -10.513
  633    HE1  TYR  85           HE2      TYR  85   4.168  -0.708  -7.620
  634    HE2  TYR  85           HE1      TYR  85   6.098  -2.432 -11.035
  635    HH   TYR  85           HH       TYR  85   4.941   0.547  -9.530
  636    H    LYS  86           HN       LYS  86   0.981  -7.108 -10.953
  637    HA   LYS  86           HA       LYS  86  -0.176  -8.909  -8.846
  638   1HB   LYS  86          1HB       LYS  86  -0.552  -8.896 -11.858
  639   2HB   LYS  86          2HB       LYS  86  -1.048 -10.201 -10.766
  640   1HG   LYS  86          2HG       LYS  86  -2.344  -8.469  -9.404
  641   2HG   LYS  86          1HG       LYS  86  -1.971  -7.310 -10.666
  642   1HD   LYS  86          2HD       LYS  86  -4.205  -8.151 -11.016
  643   2HD   LYS  86          1HD       LYS  86  -3.182  -8.765 -12.316
  644   1HE   LYS  86          1HE       LYS  86  -4.764 -10.469 -11.450
  645   2HE   LYS  86          2HE       LYS  86  -3.093 -10.985 -11.226
  646   1HZ   LYS  86          1HZ       LYS  86  -4.818  -9.815  -9.139
  647   2HZ   LYS  86          3HZ       LYS  86  -4.411 -11.402  -9.305
  648   3HZ   LYS  86          2HZ       LYS  86  -3.251 -10.308  -8.942
  649    H    ASP  87           HN       ASP  87   1.003 -10.565  -8.236
  650    HA   ASP  87           HA       ASP  87   2.561 -12.242  -8.086
  651   1HB   ASP  87          1HB       ASP  87   2.316 -13.081 -10.330
  652   2HB   ASP  87          2HB       ASP  87   3.089 -11.695 -11.067
  653    H    GLY  88           HN       GLY  88   3.900  -9.921 -10.259
  654   1HA   GLY  88          1HA       GLY  88   5.299  -8.212  -8.480
  655   2HA   GLY  88          2HA       GLY  88   6.441  -9.447  -9.055
  656    H    VAL  89           HN       VAL  89   3.705  -8.360 -11.078
  657    HA   VAL  89           HA       VAL  89   5.561  -6.855 -12.860
  658    HB   VAL  89           HB       VAL  89   3.314  -8.776 -13.621
  659   1HG1  VAL  89          1HG21     VAL  89   5.271  -7.177 -15.337
  660   2HG1  VAL  89          2HG22     VAL  89   4.126  -8.395 -15.938
  661   3HG1  VAL  89          3HG23     VAL  89   3.518  -6.901 -15.217
  662   1HG2  VAL  89          3HG13     VAL  89   6.342  -9.054 -13.881
  663   2HG2  VAL  89          2HG12     VAL  89   5.274 -10.049 -12.866
  664   3HG2  VAL  89          1HG11     VAL  89   5.148 -10.139 -14.625
  665    H    LYS  90           HN       LYS  90   4.790  -4.845 -13.336
  666    HA   LYS  90           HA       LYS  90   2.595  -3.769 -11.919
  667   1HB   LYS  90          1HB       LYS  90   4.676  -2.603 -12.937
  668   2HB   LYS  90          2HB       LYS  90   3.742  -2.536 -14.435
  669   1HG   LYS  90          1HG       LYS  90   1.923  -1.304 -13.181
  670   2HG   LYS  90          2HG       LYS  90   2.859  -1.461 -11.701
  671   1HD   LYS  90          2HD       LYS  90   3.164   0.760 -12.596
  672   2HD   LYS  90          1HD       LYS  90   4.694  -0.115 -12.622
  673   1HE   LYS  90          1HE       LYS  90   4.257   1.253 -14.677
  674   2HE   LYS  90          2HE       LYS  90   4.524  -0.457 -15.041
  675   1HZ   LYS  90          3HZ       LYS  90   1.881   0.808 -14.786
  676   2HZ   LYS  90          1HZ       LYS  90   2.650   0.512 -16.220
  677   3HZ   LYS  90          2HZ       LYS  90   2.186  -0.740 -15.255
  678    H    ALA  91           HN       ALA  91   0.522  -4.341 -12.283
  679    HA   ALA  91           HA       ALA  91  -0.314  -5.345 -14.956
  680   1HB   ALA  91          1HB       ALA  91  -0.787  -6.590 -12.780
  681   2HB   ALA  91          3HB       ALA  91  -1.911  -5.269 -12.381
  682   3HB   ALA  91          2HB       ALA  91  -2.206  -6.257 -13.806
  683    H    ASP  92           HN       ASP  92  -1.036  -2.793 -12.595
  684    HA   ASP  92           HA       ASP  92  -2.428  -1.153 -14.530
  685   1HB   ASP  92          1HB       ASP  92  -4.122  -2.915 -13.845
  686   2HB   ASP  92          2HB       ASP  92  -3.956  -2.343 -12.175
  687    H    ASP  93           HN       ASP  93  -3.333   0.865 -13.114
  688    HA   ASP  93           HA       ASP  93  -2.001   1.259 -10.625
  689   1HB   ASP  93          1HB       ASP  93  -1.154   3.034 -12.993
  690   2HB   ASP  93          2HB       ASP  93  -0.613   3.212 -11.324
  691    H    LEU  94           HN       LEU  94  -2.575   3.652  -9.927
  692    HA   LEU  94           HA       LEU  94  -4.670   5.029 -11.437
  693   1HB   LEU  94          1HB       LEU  94  -5.968   3.289 -10.582
  694   2HB   LEU  94          2HB       LEU  94  -5.162   3.255  -9.028
  695    HG   LEU  94           HG       LEU  94  -7.528   4.058  -9.152
  696   1HD1  LEU  94          3HD23     LEU  94  -5.948   4.600  -7.254
  697   2HD1  LEU  94          2HD22     LEU  94  -5.843   6.247  -7.925
  698   3HD1  LEU  94          1HD21     LEU  94  -7.399   5.580  -7.404
  699   1HD2  LEU  94          3HD13     LEU  94  -7.146   5.388 -11.282
  700   2HD2  LEU  94          1HD11     LEU  94  -8.090   6.224 -10.045
  701   3HD2  LEU  94          2HD12     LEU  94  -6.402   6.650 -10.285
  702    H    VAL  95           HN       VAL  95  -4.333   7.163 -11.053
  703    HA   VAL  95           HA       VAL  95  -2.720   7.975  -8.706
  704    HB   VAL  95           HB       VAL  95  -2.170   9.953 -10.081
  705   1HG1  VAL  95          1HG11     VAL  95  -0.653   8.053 -10.029
  706   2HG1  VAL  95          3HG13     VAL  95  -1.503   7.283 -11.389
  707   3HG1  VAL  95          2HG12     VAL  95  -0.635   8.812 -11.627
  708   1HG2  VAL  95          2HG22     VAL  95  -4.167   9.962 -11.587
  709   2HG2  VAL  95          1HG21     VAL  95  -2.630  10.032 -12.458
  710   3HG2  VAL  95          3HG23     VAL  95  -3.534   8.513 -12.400
  711    H    GLY  96           HN       GLY  96  -3.156  10.023  -7.742
  712   1HA   GLY  96          1HA       GLY  96  -4.372  11.905  -7.157
  713   2HA   GLY  96          2HA       GLY  96  -5.639  11.478  -8.328
  714    H    ALA  97           HN       ALA  97  -6.699  12.302  -6.129
  715    HA   ALA  97           HA       ALA  97  -7.003  10.298  -4.040
  716   1HB   ALA  97          3HB       ALA  97  -7.073  12.722  -3.569
  717   2HB   ALA  97          2HB       ALA  97  -8.484  12.903  -4.636
  718   3HB   ALA  97          1HB       ALA  97  -8.623  11.977  -3.134
  719    H    SER  98           HN       SER  98  -7.624   9.179  -6.557
  720    HA   SER  98           HA       SER  98 -10.479   9.225  -7.091
  721   1HB   SER  98          1HB       SER  98  -8.265   7.453  -8.170
  722   2HB   SER  98          2HB       SER  98  -9.809   7.836  -8.962
  723    HG   SER  98           HG       SER  98  -7.486   9.130  -9.148
  724    H    GLN  99           HN       GLN  99 -10.513   8.548  -4.585
  725    HA   GLN  99           HA       GLN  99  -9.854   6.039  -3.653
  726   1HB   GLN  99          2HB       GLN  99 -10.868   8.085  -2.428
  727   2HB   GLN  99          1HB       GLN  99 -12.449   7.406  -2.856
  728   1HG   GLN  99          2HG       GLN  99 -11.538   5.195  -1.781
  729   2HG   GLN  99          1HG       GLN  99 -10.247   6.201  -1.122
  730   1HE2  GLN  99          2HE22     GLN  99 -12.656   8.105   0.933
  731   2HE2  GLN  99          1HE21     GLN  99 -11.358   8.461  -0.194
  732    H    ASP 100           HN       ASP 100 -13.045   6.867  -5.177
  733    HA   ASP 100           HA       ASP 100 -14.232   4.336  -4.969
  734   1HB   ASP 100          2HB       ASP 100 -14.503   6.326  -7.266
  735   2HB   ASP 100          1HB       ASP 100 -15.654   5.058  -6.819
  736    H    LYS 101           HN       LYS 101 -12.105   5.633  -7.493
  737    HA   LYS 101           HA       LYS 101 -12.207   3.375  -9.243
  738   1HB   LYS 101          1HB       LYS 101 -11.304   5.915  -9.464
  739   2HB   LYS 101          2HB       LYS 101  -9.772   5.127  -9.089
  740   1HG   LYS 101          2HG       LYS 101 -11.683   4.543 -11.401
  741   2HG   LYS 101          1HG       LYS 101 -10.129   5.381 -11.490
  742   1HD   LYS 101          2HD       LYS 101  -9.024   3.211 -10.692
  743   2HD   LYS 101          1HD       LYS 101 -10.608   2.433 -10.855
  744   1HE   LYS 101          2HE       LYS 101  -9.428   1.961 -12.864
  745   2HE   LYS 101          1HE       LYS 101 -10.640   3.176 -13.284
  746   1HZ   LYS 101          1HZ       LYS 101  -7.789   3.670 -12.741
  747   2HZ   LYS 101          2HZ       LYS 101  -8.500   3.650 -14.224
  748   3HZ   LYS 101          3HZ       LYS 101  -8.893   4.828 -13.142
  749    H    LEU 102           HN       LEU 102  -9.997   4.384  -6.589
  750    HA   LEU 102           HA       LEU 102  -8.161   2.255  -6.756
  751   1HB   LEU 102          1HB       LEU 102  -7.830   4.234  -5.337
  752   2HB   LEU 102          2HB       LEU 102  -9.149   3.745  -4.272
  753    HG   LEU 102           HG       LEU 102  -7.966   1.765  -3.528
  754   1HD1  LEU 102          1HD21     LEU 102  -5.840   2.726  -5.471
  755   2HD1  LEU 102          3HD23     LEU 102  -5.498   1.599  -4.135
  756   3HD1  LEU 102          2HD22     LEU 102  -6.615   1.133  -5.422
  757   1HD2  LEU 102          3HD13     LEU 102  -6.473   4.410  -3.413
  758   2HD2  LEU 102          2HD12     LEU 102  -7.733   3.844  -2.303
  759   3HD2  LEU 102          1HD11     LEU 102  -6.153   3.043  -2.335
  760    H    LYS 103           HN       LYS 103 -11.169   2.467  -4.727
  761    HA   LYS 103           HA       LYS 103 -11.020  -0.150  -3.668
  762   1HB   LYS 103          2HB       LYS 103 -13.411   1.631  -4.328
  763   2HB   LYS 103          1HB       LYS 103 -13.500   0.120  -3.412
  764   1HG   LYS 103          1HG       LYS 103 -11.790   1.064  -1.807
  765   2HG   LYS 103          2HG       LYS 103 -11.957   2.623  -2.592
  766   1HD   LYS 103          2HD       LYS 103 -14.198   1.029  -1.252
  767   2HD   LYS 103          1HD       LYS 103 -13.336   2.382  -0.514
  768   1HE   LYS 103          1HE       LYS 103 -15.072   2.577  -3.024
  769   2HE   LYS 103          2HE       LYS 103 -15.553   3.044  -1.390
  770   1HZ   LYS 103          1HZ       LYS 103 -13.818   4.666  -1.366
  771   2HZ   LYS 103          3HZ       LYS 103 -13.340   4.236  -2.889
  772   3HZ   LYS 103          2HZ       LYS 103 -14.823   4.912  -2.649
  773    H    ALA 104           HN       ALA 104 -12.637   1.018  -6.678
  774    HA   ALA 104           HA       ALA 104 -13.625  -1.485  -7.536
  775   1HB   ALA 104          2HB       ALA 104 -14.214   0.688  -8.572
  776   2HB   ALA 104          3HB       ALA 104 -12.579   0.811  -9.256
  777   3HB   ALA 104          1HB       ALA 104 -13.660  -0.493  -9.777
  778    H    LEU 105           HN       LEU 105 -10.378   0.010  -8.127
  779    HA   LEU 105           HA       LEU 105  -9.416  -2.169  -9.709
  780   1HB   LEU 105          1HB       LEU 105  -7.959  -0.074  -8.032
  781   2HB   LEU 105          2HB       LEU 105  -7.132  -1.336  -8.922
  782    HG   LEU 105           HG       LEU 105  -8.646   1.016 -10.008
  783   1HD1  LEU 105          2HD12     LEU 105  -6.203   1.113  -9.594
  784   2HD1  LEU 105          1HD11     LEU 105  -5.962  -0.290 -10.652
  785   3HD1  LEU 105          3HD13     LEU 105  -6.570   1.227 -11.334
  786   1HD2  LEU 105          1HD21     LEU 105  -8.122  -1.574 -11.511
  787   2HD2  LEU 105          3HD23     LEU 105  -9.658  -0.686 -11.357
  788   3HD2  LEU 105          2HD22     LEU 105  -8.340  -0.014 -12.317
  789    H    VAL 106           HN       VAL 106  -9.207  -1.615  -6.136
  790    HA   VAL 106           HA       VAL 106  -7.665  -3.957  -5.649
  791    HB   VAL 106           HB       VAL 106  -9.855  -2.740  -3.904
  792   1HG1  VAL 106          1HG21     VAL 106  -9.329  -5.106  -3.262
  793   2HG1  VAL 106          3HG23     VAL 106  -7.606  -4.694  -3.209
  794   3HG1  VAL 106          2HG22     VAL 106  -8.749  -3.946  -2.074
  795   1HG2  VAL 106          2HG12     VAL 106  -7.935  -1.190  -4.377
  796   2HG2  VAL 106          3HG13     VAL 106  -7.985  -1.708  -2.688
  797   3HG2  VAL 106          1HG11     VAL 106  -6.819  -2.441  -3.813
  798    H    ALA 107           HN       ALA 107 -11.197  -3.539  -5.756
  799    HA   ALA 107           HA       ALA 107 -11.947  -6.236  -5.363
  800   1HB   ALA 107          2HB       ALA 107 -13.539  -4.343  -5.389
  801   2HB   ALA 107          3HB       ALA 107 -13.335  -4.181  -7.145
  802   3HB   ALA 107          1HB       ALA 107 -14.055  -5.652  -6.469
  803    H    LYS 108           HN       LYS 108 -11.248  -4.584  -8.484
  804    HA   LYS 108           HA       LYS 108 -11.645  -6.793 -10.204
  805   1HB   LYS 108          2HB       LYS 108 -11.485  -4.598 -11.136
  806   2HB   LYS 108          1HB       LYS 108 -10.029  -4.237 -10.250
  807   1HG   LYS 108          2HG       LYS 108  -9.631  -4.375 -12.627
  808   2HG   LYS 108          1HG       LYS 108  -8.617  -5.453 -11.685
  809   1HD   LYS 108          1HD       LYS 108  -9.405  -6.430 -13.810
  810   2HD   LYS 108          2HD       LYS 108  -9.821  -7.390 -12.401
  811   1HE   LYS 108          1HE       LYS 108 -12.161  -6.480 -12.488
  812   2HE   LYS 108          2HE       LYS 108 -11.701  -5.452 -13.859
  813   1HZ   LYS 108          1HZ       LYS 108 -11.252  -7.440 -15.103
  814   2HZ   LYS 108          3HZ       LYS 108 -11.670  -8.387 -13.820
  815   3HZ   LYS 108          2HZ       LYS 108 -12.804  -7.441 -14.549
  816    H    HIS 109           HN       HIS 109  -8.552  -5.592  -8.843
  817    HA   HIS 109           HA       HIS 109  -7.090  -7.808 -10.019
  818   1HB   HIS 109          1HB       HIS 109  -6.281  -5.595  -8.093
  819   2HB   HIS 109          2HB       HIS 109  -5.166  -6.747  -8.846
  820    HD2  HIS 109           HD2      HIS 109  -6.799  -3.398  -9.697
  821    HE1  HIS 109           HE1      HIS 109  -5.435  -5.008 -13.337
  822    HE2  HIS 109           HE2      HIS 109  -6.354  -2.910 -12.230
  823    H    ALA 110           HN       ALA 110  -8.778  -7.442  -7.011
  824    HA   ALA 110           HA       ALA 110  -7.622  -8.826  -5.087
  825   1HB   ALA 110          3HB       ALA 110  -9.963  -8.095  -4.991
  826   2HB   ALA 110          2HB       ALA 110 -10.431  -9.402  -6.103
  827   3HB   ALA 110          1HB       ALA 110  -9.808  -9.784  -4.489
  828    H    ALA 111           HN       ALA 111  -9.127 -10.482  -7.884
  829    HA   ALA 111           HA       ALA 111  -9.058 -12.656  -8.611
  830   1HB   ALA 111          3HB       ALA 111  -6.790 -11.907  -9.209
  831   2HB   ALA 111          2HB       ALA 111  -6.163 -12.434  -7.637
  832   3HB   ALA 111          1HB       ALA 111  -6.796 -13.628  -8.792
  833    H    ALA 112           HN       ALA 112  -6.737 -14.217  -6.598
  834    HA   ALA 112           HA       ALA 112  -8.246 -14.762  -4.305
  835   1HB   ALA 112          1HB       ALA 112  -8.251 -16.889  -6.508
  836   2HB   ALA 112          2HB       ALA 112  -8.713 -17.163  -4.815
  837   3HB   ALA 112          3HB       ALA 112  -9.693 -16.093  -5.835
   
  No H/Q in entry =         837
  Start of MODEL   11
    1   1H    GLY   1          2HN       GLY   1  -0.255  -5.630   9.530
    2   2H    GLY   1          1HN       GLY   1   0.801  -4.492  10.159
    3   3H    GLY   1          3HN       GLY   1   0.686  -4.767   8.518
    4   1HA   GLY   1          1HA       GLY   1   2.641  -5.807   9.219
    5   2HA   GLY   1          2HA       GLY   1   1.710  -6.694  10.449
    6    H    GLY   2           HN       GLY   2   3.114  -8.252   8.664
    7   1HA   GLY   2          1HA       GLY   2   2.839  -9.992   7.207
    8   2HA   GLY   2          2HA       GLY   2   1.093  -9.892   7.519
    9    H    SER   3           HN       SER   3  -0.101  -9.456   5.658
   10    HA   SER   3           HA       SER   3   1.296  -8.612   3.289
   11   1HB   SER   3          2HB       SER   3  -0.660  -9.047   2.182
   12   2HB   SER   3          1HB       SER   3  -0.658 -10.262   3.440
   13    HG   SER   3           HG       SER   3  -2.489  -8.430   2.840
   14    H    VAL   4           HN       VAL   4  -0.455  -6.856   5.811
   15    HA   VAL   4           HA       VAL   4  -0.643  -4.495   4.036
   16    HB   VAL   4           HB       VAL   4  -2.264  -3.715   5.374
   17   1HG1  VAL   4          2HG12     VAL   4  -3.051  -5.791   4.200
   18   2HG1  VAL   4          1HG11     VAL   4  -2.736  -6.724   5.679
   19   3HG1  VAL   4          3HG13     VAL   4  -3.972  -5.473   5.686
   20   1HG2  VAL   4          3HG23     VAL   4  -1.320  -3.758   7.557
   21   2HG2  VAL   4          2HG22     VAL   4  -2.958  -4.411   7.587
   22   3HG2  VAL   4          1HG21     VAL   4  -1.578  -5.529   7.657
   23    H    ILE   5           HN       ILE   5   0.610  -2.889   4.177
   24    HA   ILE   5           HA       ILE   5   2.455  -2.568   6.475
   25    HB   ILE   5           HB       ILE   5   3.064  -3.112   3.537
   26   1HG1  ILE   5          1HG11     ILE   5   2.909  -5.155   4.887
   27   2HG1  ILE   5          2HG12     ILE   5   4.529  -4.819   4.308
   28   1HG2  ILE   5          3HG23     ILE   5   4.910  -1.957   5.633
   29   2HG2  ILE   5          1HG21     ILE   5   5.457  -2.721   4.113
   30   3HG2  ILE   5          2HG22     ILE   5   4.456  -1.271   4.047
   31   1HD1  ILE   5          2HD12     ILE   5   5.252  -4.065   6.526
   32   2HD1  ILE   5          1HD11     ILE   5   3.615  -4.325   7.172
   33   3HD1  ILE   5          3HD13     ILE   5   4.566  -5.694   6.588
   34    H    VAL   6           HN       VAL   6   3.238  -0.604   6.746
   35    HA   VAL   6           HA       VAL   6   2.643   1.571   4.880
   36    HB   VAL   6           HB       VAL   6   2.232   3.096   6.774
   37   1HG1  VAL   6          2HG12     VAL   6   0.300   2.018   5.614
   38   2HG1  VAL   6          3HG13     VAL   6   0.293   0.743   6.846
   39   3HG1  VAL   6          1HG11     VAL   6  -0.050   2.421   7.300
   40   1HG2  VAL   6          1HG21     VAL   6   2.237   0.607   8.542
   41   2HG2  VAL   6          2HG22     VAL   6   3.341   1.998   8.651
   42   3HG2  VAL   6          3HG23     VAL   6   1.632   2.200   9.023
   43    H    ILE   7           HN       ILE   7   4.670   2.315   4.237
   44    HA   ILE   7           HA       ILE   7   6.850   2.147   6.209
   45    HB   ILE   7           HB       ILE   7   6.426  -0.122   4.880
   46   1HG1  ILE   7          1HG11     ILE   7   9.029  -0.354   4.659
   47   2HG1  ILE   7          2HG12     ILE   7   9.086   1.181   5.486
   48   1HG2  ILE   7          3HG23     ILE   7   6.315   0.982   2.658
   49   2HG2  ILE   7          1HG21     ILE   7   8.048   1.366   2.777
   50   3HG2  ILE   7          2HG22     ILE   7   7.510  -0.316   2.755
   51   1HD1  ILE   7          1HD11     ILE   7   7.577  -1.283   6.489
   52   2HD1  ILE   7          3HD13     ILE   7   9.173  -0.754   7.046
   53   3HD1  ILE   7          2HD12     ILE   7   7.742   0.252   7.352
   54    H    ASP   8           HN       ASP   8   8.770   3.074   5.570
   55    HA   ASP   8           HA       ASP   8   8.757   4.920   3.264
   56   1HB   ASP   8          1HB       ASP   8   9.726   6.613   4.796
   57   2HB   ASP   8          2HB       ASP   8   8.183   6.077   5.451
   58    H    SER   9           HN       SER   9   9.814   2.251   3.428
   59    HA   SER   9           HA       SER   9  12.590   2.751   2.719
   60   1HB   SER   9          1HB       SER   9  11.859   1.092   5.159
   61   2HB   SER   9          2HB       SER   9  13.385   0.907   4.274
   62    HG   SER   9           HG       SER   9  12.622   3.491   5.070
   63    H    LYS  10           HN       LYS  10  13.079   1.396   1.094
   64    HA   LYS  10           HA       LYS  10  11.254  -0.185  -0.249
   65   1HB   LYS  10          2HB       LYS  10  13.231  -1.159  -1.363
   66   2HB   LYS  10          1HB       LYS  10  13.231   0.618  -1.278
   67   1HG   LYS  10          2HG       LYS  10  14.937   0.494   0.559
   68   2HG   LYS  10          1HG       LYS  10  14.870  -1.271   0.477
   69   1HD   LYS  10          1HD       LYS  10  16.815  -0.488  -0.703
   70   2HD   LYS  10          2HD       LYS  10  15.694  -1.295  -1.798
   71   1HE   LYS  10          1HE       LYS  10  16.712   0.722  -2.801
   72   2HE   LYS  10          2HE       LYS  10  14.957   0.864  -2.716
   73   1HZ   LYS  10          3HZ       LYS  10  16.866   2.045  -0.814
   74   2HZ   LYS  10          2HZ       LYS  10  16.087   2.855  -2.017
   75   3HZ   LYS  10          1HZ       LYS  10  15.228   2.221  -0.764
   76    H    ALA  11           HN       ALA  11  13.475  -1.137   2.227
   77    HA   ALA  11           HA       ALA  11  13.741  -3.798   2.334
   78   1HB   ALA  11          1HB       ALA  11  12.838  -2.094   4.692
   79   2HB   ALA  11          3HB       ALA  11  13.606  -3.693   4.796
   80   3HB   ALA  11          2HB       ALA  11  14.501  -2.323   4.115
   81    H    ALA  12           HN       ALA  12  10.780  -2.340   3.803
   82    HA   ALA  12           HA       ALA  12   9.543  -4.905   4.193
   83   1HB   ALA  12          2HB       ALA  12   9.052  -2.795   5.478
   84   2HB   ALA  12          1HB       ALA  12   8.137  -2.228   4.049
   85   3HB   ALA  12          3HB       ALA  12   7.621  -3.680   4.914
   86    H    TRP  13           HN       TRP  13   9.561  -2.605   1.503
   87    HA   TRP  13           HA       TRP  13   7.162  -3.546   0.201
   88   1HB   TRP  13          2HB       TRP  13   7.568  -1.605  -0.785
   89   2HB   TRP  13          1HB       TRP  13   9.209  -1.516  -0.234
   90    HD1  TRP  13           HD1      TRP  13  11.049  -2.928  -1.915
   91    HE1  TRP  13           HE1      TRP  13  11.175  -2.857  -4.464
   92    HE3  TRP  13           HE3      TRP  13   6.369  -1.088  -2.930
   93    HZ2  TRP  13           HZ2      TRP  13   9.558  -2.037  -6.632
   94    HZ3  TRP  13           HZ3      TRP  13   5.831  -0.408  -5.244
   95    HH2  TRP  13           HH2      TRP  13   7.368  -0.948  -7.115
   96    H    ASP  14           HN       ASP  14  10.670  -4.238  -0.189
   97    HA   ASP  14           HA       ASP  14  10.217  -6.241  -2.226
   98   1HB   ASP  14          1HB       ASP  14  12.526  -6.832  -1.982
   99   2HB   ASP  14          2HB       ASP  14  12.300  -5.076  -1.991
  100    H    ALA  15           HN       ALA  15  10.997  -6.444   1.184
  101    HA   ALA  15           HA       ALA  15  10.882  -9.171   1.604
  102   1HB   ALA  15          1HB       ALA  15  11.428  -7.512   3.368
  103   2HB   ALA  15          2HB       ALA  15   9.702  -7.096   3.499
  104   3HB   ALA  15          3HB       ALA  15  10.266  -8.721   3.934
  105    H    GLN  16           HN       GLN  16   8.034  -7.002   1.713
  106    HA   GLN  16           HA       GLN  16   6.175  -9.204   2.049
  107   1HB   GLN  16          1HB       GLN  16   5.895  -6.265   1.646
  108   2HB   GLN  16          2HB       GLN  16   4.620  -7.265   0.979
  109   1HG   GLN  16          1HG       GLN  16   3.992  -6.751   3.145
  110   2HG   GLN  16          2HG       GLN  16   4.274  -8.463   3.065
  111   1HE2  GLN  16          1HE21     GLN  16   7.211  -6.297   5.097
  112   2HE2  GLN  16          2HE22     GLN  16   6.729  -5.794   3.489
  113    H    LEU  17           HN       LEU  17   7.145  -7.259  -0.840
  114    HA   LEU  17           HA       LEU  17   5.553  -8.451  -2.769
  115   1HB   LEU  17          2HB       LEU  17   8.356  -7.399  -2.715
  116   2HB   LEU  17          1HB       LEU  17   7.982  -8.429  -4.073
  117    HG   LEU  17           HG       LEU  17   6.162  -6.114  -3.370
  118   1HD1  LEU  17          2HD22     LEU  17   8.651  -6.026  -5.133
  119   2HD1  LEU  17          3HD23     LEU  17   7.420  -4.750  -5.017
  120   3HD1  LEU  17          1HD21     LEU  17   8.413  -5.148  -3.608
  121   1HD2  LEU  17          2HD12     LEU  17   5.397  -7.858  -4.997
  122   2HD2  LEU  17          1HD11     LEU  17   5.637  -6.291  -5.800
  123   3HD2  LEU  17          3HD13     LEU  17   6.843  -7.575  -5.978
  124    H    ALA  18           HN       ALA  18   8.649  -9.745  -1.540
  125    HA   ALA  18           HA       ALA  18   8.577 -12.185  -2.973
  126   1HB   ALA  18          3HB       ALA  18   9.907 -11.491  -0.315
  127   2HB   ALA  18          2HB       ALA  18  10.279 -12.905  -1.328
  128   3HB   ALA  18          1HB       ALA  18  10.589 -11.265  -1.937
  129    H    LYS  19           HN       LYS  19   7.933 -11.913   0.626
  130    HA   LYS  19           HA       LYS  19   6.990 -14.607   0.716
  131   1HB   LYS  19          2HB       LYS  19   6.278 -14.167   2.945
  132   2HB   LYS  19          1HB       LYS  19   7.811 -13.326   2.682
  133   1HG   LYS  19          2HG       LYS  19   6.568 -11.218   2.412
  134   2HG   LYS  19          1HG       LYS  19   5.027 -12.048   2.595
  135   1HD   LYS  19          1HD       LYS  19   5.412 -11.075   4.694
  136   2HD   LYS  19          2HD       LYS  19   5.721 -12.802   4.885
  137   1HE   LYS  19          1HE       LYS  19   7.401 -11.509   6.078
  138   2HE   LYS  19          2HE       LYS  19   8.194 -12.333   4.727
  139   1HZ   LYS  19          2HZ       LYS  19   7.277  -9.536   4.734
  140   2HZ   LYS  19          1HZ       LYS  19   8.837 -10.032   4.951
  141   3HZ   LYS  19          3HZ       LYS  19   8.089 -10.291   3.504
  142    H    GLY  20           HN       GLY  20   5.348 -11.645  -0.102
  143   1HA   GLY  20          1HA       GLY  20   2.652 -12.365   0.317
  144   2HA   GLY  20          2HA       GLY  20   3.283 -11.117  -0.763
  145    H    LYS  21           HN       LYS  21   4.974 -13.242  -2.237
  146    HA   LYS  21           HA       LYS  21   4.820 -14.434  -4.143
  147   1HB   LYS  21          2HB       LYS  21   2.263 -15.536  -2.902
  148   2HB   LYS  21          1HB       LYS  21   3.113 -16.200  -4.302
  149   1HG   LYS  21          2HG       LYS  21   5.170 -16.485  -2.934
  150   2HG   LYS  21          1HG       LYS  21   4.293 -15.935  -1.502
  151   1HD   LYS  21          2HD       LYS  21   3.556 -18.376  -3.185
  152   2HD   LYS  21          1HD       LYS  21   4.485 -18.411  -1.676
  153   1HE   LYS  21          2HE       LYS  21   2.538 -17.342  -0.488
  154   2HE   LYS  21          1HE       LYS  21   1.589 -17.486  -1.980
  155   1HZ   LYS  21          2HZ       LYS  21   1.908 -19.844  -1.891
  156   2HZ   LYS  21          3HZ       LYS  21   2.782 -19.715  -0.498
  157   3HZ   LYS  21          1HZ       LYS  21   1.189 -19.296  -0.512
  158    H    GLU  22           HN       GLU  22   4.535 -12.213  -4.892
  159    HA   GLU  22           HA       GLU  22   2.271 -10.946  -5.835
  160   1HB   GLU  22          2HB       GLU  22   3.804  -9.977  -7.541
  161   2HB   GLU  22          1HB       GLU  22   4.424  -9.878  -5.898
  162   1HG   GLU  22          1HG       GLU  22   5.299 -12.189  -7.661
  163   2HG   GLU  22          2HG       GLU  22   5.992 -10.588  -7.890
  164    H    GLU  23           HN       GLU  23   3.567 -13.883  -7.039
  165    HA   GLU  23           HA       GLU  23   2.976 -14.274  -9.641
  166   1HB   GLU  23          1HB       GLU  23   2.203 -16.053  -7.281
  167   2HB   GLU  23          2HB       GLU  23   2.265 -16.577  -8.971
  168   1HG   GLU  23          1HG       GLU  23   4.667 -16.114  -9.082
  169   2HG   GLU  23          2HG       GLU  23   4.674 -15.485  -7.429
  170    H    HIS  24           HN       HIS  24   0.532 -14.515  -7.018
  171    HA   HIS  24           HA       HIS  24  -1.503 -13.519  -8.919
  172   1HB   HIS  24          2HB       HIS  24  -1.824 -15.983  -8.846
  173   2HB   HIS  24          1HB       HIS  24  -1.797 -15.943  -7.076
  174    HD2  HIS  24           HD2      HIS  24  -4.175 -15.340  -5.831
  175    HE1  HIS  24           HE1      HIS  24  -6.375 -14.384  -9.308
  176    HE2  HIS  24           HE2      HIS  24  -6.536 -14.710  -6.779
  177    H    LYS  25           HN       LYS  25  -0.090 -13.085  -6.067
  178    HA   LYS  25           HA       LYS  25  -2.503 -12.080  -4.651
  179   1HB   LYS  25          2HB       LYS  25   0.359 -12.494  -3.887
  180   2HB   LYS  25          1HB       LYS  25  -0.514 -11.193  -3.102
  181   1HG   LYS  25          2HG       LYS  25  -0.682 -13.239  -1.782
  182   2HG   LYS  25          1HG       LYS  25  -2.219 -12.591  -2.303
  183   1HD   LYS  25          2HD       LYS  25  -2.026 -14.392  -4.268
  184   2HD   LYS  25          1HD       LYS  25  -0.793 -15.096  -3.218
  185   1HE   LYS  25          1HE       LYS  25  -2.921 -16.156  -2.731
  186   2HE   LYS  25          2HE       LYS  25  -2.573 -15.084  -1.362
  187   1HZ   LYS  25          1HZ       LYS  25  -4.351 -14.479  -3.631
  188   2HZ   LYS  25          3HZ       LYS  25  -4.830 -14.888  -2.114
  189   3HZ   LYS  25          2HZ       LYS  25  -4.050 -13.461  -2.374
  190    HA   PRO  26           HA       PRO  26  -1.713  -8.277  -6.964
  191   1HB   PRO  26          1HB       PRO  26  -3.755  -6.702  -5.996
  192   2HB   PRO  26          2HB       PRO  26  -4.005  -7.972  -7.229
  193   1HG   PRO  26          1HG       PRO  26  -4.286  -8.242  -4.256
  194   2HG   PRO  26          2HG       PRO  26  -5.539  -8.634  -5.453
  195   1HD   PRO  26          1HD       PRO  26  -3.946 -10.530  -4.394
  196   2HD   PRO  26          2HD       PRO  26  -4.172 -10.562  -6.166
  197    H    ILE  27           HN       ILE  27  -0.237  -6.857  -6.471
  198    HA   ILE  27           HA       ILE  27   0.337  -6.216  -3.644
  199    HB   ILE  27           HB       ILE  27   2.003  -5.742  -6.140
  200   1HG1  ILE  27          1HG11     ILE  27   1.581  -8.095  -5.944
  201   2HG1  ILE  27          2HG12     ILE  27   3.283  -7.667  -5.780
  202   1HG2  ILE  27          1HG21     ILE  27   2.655  -5.703  -3.152
  203   2HG2  ILE  27          3HG23     ILE  27   3.873  -5.601  -4.440
  204   3HG2  ILE  27          2HG22     ILE  27   2.660  -4.331  -4.266
  205   1HD1  ILE  27          2HD12     ILE  27   3.018  -7.930  -3.270
  206   2HD1  ILE  27          3HD13     ILE  27   1.343  -8.465  -3.620
  207   3HD1  ILE  27          1HD11     ILE  27   2.725  -9.414  -4.188
  208    H    VAL  28           HN       VAL  28  -1.137  -4.591  -3.311
  209    HA   VAL  28           HA       VAL  28  -1.421  -2.441  -5.364
  210    HB   VAL  28           HB       VAL  28  -3.521  -3.272  -4.421
  211   1HG1  VAL  28          1HG21     VAL  28  -2.907  -3.819  -2.138
  212   2HG1  VAL  28          2HG22     VAL  28  -2.731  -2.091  -1.772
  213   3HG1  VAL  28          3HG23     VAL  28  -4.301  -2.744  -2.253
  214   1HG2  VAL  28          1HG11     VAL  28  -2.844  -0.374  -3.902
  215   2HG2  VAL  28          3HG13     VAL  28  -3.366  -1.101  -5.426
  216   3HG2  VAL  28          2HG12     VAL  28  -4.484  -1.062  -4.059
  217    H    VAL  29           HN       VAL  29  -0.028  -0.796  -5.264
  218    HA   VAL  29           HA       VAL  29   1.372  -0.258  -2.697
  219    HB   VAL  29           HB       VAL  29   2.317   0.776  -5.366
  220   1HG1  VAL  29          2HG22     VAL  29   3.207   1.646  -3.174
  221   2HG1  VAL  29          1HG21     VAL  29   3.797   0.009  -2.825
  222   3HG1  VAL  29          3HG23     VAL  29   4.420   0.914  -4.216
  223   1HG2  VAL  29          1HG11     VAL  29   2.890  -1.964  -4.218
  224   2HG2  VAL  29          3HG13     VAL  29   2.055  -1.596  -5.747
  225   3HG2  VAL  29          2HG12     VAL  29   3.762  -1.190  -5.566
  226    H    ASP  30           HN       ASP  30   0.717   1.539  -1.652
  227    HA   ASP  30           HA       ASP  30  -0.662   3.726  -3.185
  228   1HB   ASP  30          1HB       ASP  30  -1.893   2.964  -1.231
  229   2HB   ASP  30          2HB       ASP  30  -0.521   3.224  -0.186
  230    H    PHE  31           HN       PHE  31   1.190   4.520  -4.200
  231    HA   PHE  31           HA       PHE  31   3.596   5.243  -2.641
  232   1HB   PHE  31          2HB       PHE  31   2.756   5.678  -5.520
  233   2HB   PHE  31          1HB       PHE  31   4.206   6.349  -4.813
  234    HD1  PHE  31           HD2      PHE  31   5.948   4.768  -3.774
  235    HD2  PHE  31           HD1      PHE  31   2.824   3.442  -6.431
  236    HE1  PHE  31           HE2      PHE  31   7.505   3.137  -4.779
  237    HE2  PHE  31           HE1      PHE  31   4.395   1.806  -7.434
  238    HZ   PHE  31           HZ       PHE  31   6.769   1.761  -6.742
  239    H    THR  32           HN       THR  32   2.932   6.757  -1.149
  240    HA   THR  32           HA       THR  32   1.588   9.286  -2.099
  241    HB   THR  32           HB       THR  32   0.088   7.941  -0.693
  242    HG1  THR  32           HG1      THR  32  -0.326   9.602   0.751
  243   1HG2  THR  32          1HG21     THR  32   1.768   6.698   0.663
  244   2HG2  THR  32          3HG23     THR  32   2.220   8.208   1.486
  245   3HG2  THR  32          2HG22     THR  32   0.588   7.540   1.675
  246    H    ALA  33           HN       ALA  33   2.113  10.877   0.042
  247    HA   ALA  33           HA       ALA  33   5.065  10.780   0.458
  248   1HB   ALA  33          1HB       ALA  33   4.649  12.146  -1.604
  249   2HB   ALA  33          3HB       ALA  33   3.663  13.247  -0.628
  250   3HB   ALA  33          2HB       ALA  33   5.383  13.048  -0.265
  251    H    THR  34           HN       THR  34   5.686  11.548   2.435
  252    HA   THR  34           HA       THR  34   4.129  11.958   4.655
  253    HB   THR  34           HB       THR  34   6.136  13.604   5.256
  254    HG1  THR  34           HG1      THR  34   7.889  13.151   3.669
  255   1HG2  THR  34          2HG22     THR  34   6.560  10.682   4.519
  256   2HG2  THR  34          3HG23     THR  34   7.706  11.664   5.451
  257   3HG2  THR  34          1HG21     THR  34   6.085  11.334   6.091
  258    H    TRP  35           HN       TRP  35   5.483  14.516   2.657
  259    HA   TRP  35           HA       TRP  35   3.942  16.655   3.804
  260   1HB   TRP  35          1HB       TRP  35   5.009  17.948   1.877
  261   2HB   TRP  35          2HB       TRP  35   6.065  17.169   3.038
  262    HD1  TRP  35           HD1      TRP  35   7.842  15.543   2.191
  263    HE1  TRP  35           HE1      TRP  35   8.603  14.687  -0.082
  264    HE3  TRP  35           HE3      TRP  35   3.926  17.246  -0.652
  265    HZ2  TRP  35           HZ2      TRP  35   7.602  14.654  -2.789
  266    HZ3  TRP  35           HZ3      TRP  35   3.911  16.848  -3.090
  267    HH2  TRP  35           HH2      TRP  35   5.703  15.501  -4.162
  268    H    CYS  36           HN       CYS  36   2.499  14.303   1.952
  269    HA   CYS  36           HA       CYS  36   1.101  16.047   0.089
  270   1HB   CYS  36          2HB       CYS  36  -0.078  14.240  -0.582
  271   2HB   CYS  36          1HB       CYS  36   1.429  13.474  -0.088
  272    H    GLY  37           HN       GLY  37   0.914  15.679   3.460
  273   1HA   GLY  37          1HA       GLY  37  -0.570  16.309   5.065
  274   2HA   GLY  37          2HA       GLY  37  -0.919  17.619   3.931
  275    HA   PRO  38           HA       PRO  38  -5.168  16.185   4.216
  276   1HB   PRO  38          1HB       PRO  38  -5.159  17.103   1.319
  277   2HB   PRO  38          2HB       PRO  38  -6.453  17.317   2.537
  278   1HG   PRO  38          1HG       PRO  38  -4.739  19.352   2.059
  279   2HG   PRO  38          2HG       PRO  38  -5.119  18.912   3.751
  280   1HD   PRO  38          2HD       PRO  38  -2.655  18.217   2.148
  281   2HD   PRO  38          1HD       PRO  38  -2.812  18.717   3.860
  282    H    CYS  39           HN       CYS  39  -3.274  15.232   1.345
  283    HA   CYS  39           HA       CYS  39  -5.039  13.169   0.464
  284   1HB   CYS  39          1HB       CYS  39  -3.578  12.925  -1.160
  285   2HB   CYS  39          2HB       CYS  39  -2.604  14.201  -0.441
  286    H    LYS  40           HN       LYS  40  -2.803  13.250   3.182
  287    HA   LYS  40           HA       LYS  40  -2.286  10.522   3.499
  288   1HB   LYS  40          2HB       LYS  40  -1.371  12.591   4.781
  289   2HB   LYS  40          1HB       LYS  40  -2.816  12.468   5.775
  290   1HG   LYS  40          1HG       LYS  40  -0.984  11.394   6.902
  291   2HG   LYS  40          2HG       LYS  40  -2.143  10.156   6.436
  292   1HD   LYS  40          1HD       LYS  40   0.248   9.500   6.106
  293   2HD   LYS  40          2HD       LYS  40  -0.717   9.366   4.642
  294   1HE   LYS  40          2HE       LYS  40   1.553  10.335   4.240
  295   2HE   LYS  40          1HE       LYS  40   0.260  11.412   3.727
  296   1HZ   LYS  40          1HZ       LYS  40   0.532  12.599   5.803
  297   2HZ   LYS  40          3HZ       LYS  40   1.783  11.614   6.231
  298   3HZ   LYS  40          2HZ       LYS  40   1.913  12.605   4.916
  299    H    MET  41           HN       MET  41  -5.296  12.286   4.020
  300    HA   MET  41           HA       MET  41  -6.614  10.476   5.803
  301   1HB   MET  41          1HB       MET  41  -7.694  12.269   3.575
  302   2HB   MET  41          2HB       MET  41  -8.685  11.459   4.802
  303   1HG   MET  41          1HG       MET  41  -7.336  12.577   6.572
  304   2HG   MET  41          2HG       MET  41  -6.554  13.568   5.348
  305   1HE   MET  41          2HE       MET  41  -7.767  15.385   3.898
  306   2HE   MET  41          1HE       MET  41  -9.000  14.227   3.335
  307   3HE   MET  41          3HE       MET  41  -9.494  15.784   4.036
  308    H    ILE  42           HN       ILE  42  -5.745  10.086   2.453
  309    HA   ILE  42           HA       ILE  42  -7.716   8.059   1.811
  310    HB   ILE  42           HB       ILE  42  -4.943   8.601   0.676
  311   1HG1  ILE  42          1HG11     ILE  42  -7.593   9.429  -0.584
  312   2HG1  ILE  42          2HG12     ILE  42  -6.788  10.490   0.571
  313   1HG2  ILE  42          2HG22     ILE  42  -7.285   6.955  -0.371
  314   2HG2  ILE  42          1HG21     ILE  42  -5.884   7.422  -1.355
  315   3HG2  ILE  42          3HG23     ILE  42  -5.660   6.370   0.043
  316   1HD1  ILE  42          2HD12     ILE  42  -4.692  10.356  -0.782
  317   2HD1  ILE  42          1HD11     ILE  42  -5.622   9.557  -2.064
  318   3HD1  ILE  42          3HD13     ILE  42  -6.034  11.206  -1.540
  319    H    ALA  43           HN       ALA  43  -4.593   8.096   3.497
  320    HA   ALA  43           HA       ALA  43  -3.851   5.419   3.186
  321   1HB   ALA  43          3HB       ALA  43  -2.367   7.160   4.087
  322   2HB   ALA  43          2HB       ALA  43  -3.298   7.217   5.595
  323   3HB   ALA  43          1HB       ALA  43  -2.434   5.740   5.146
  324    HA   PRO  44           HA       PRO  44  -6.160   4.136   7.221
  325   1HB   PRO  44          1HB       PRO  44  -8.373   5.599   8.026
  326   2HB   PRO  44          2HB       PRO  44  -6.724   5.795   8.682
  327   1HG   PRO  44          1HG       PRO  44  -8.028   7.383   6.461
  328   2HG   PRO  44          2HG       PRO  44  -7.164   8.019   7.895
  329   1HD   PRO  44          1HD       PRO  44  -5.851   7.824   5.585
  330   2HD   PRO  44          2HD       PRO  44  -5.055   7.245   7.063
  331    H    LEU  45           HN       LEU  45  -7.974   5.769   4.645
  332    HA   LEU  45           HA       LEU  45 -10.182   3.909   4.553
  333   1HB   LEU  45          1HB       LEU  45  -8.979   5.985   2.734
  334   2HB   LEU  45          2HB       LEU  45  -9.934   4.741   1.961
  335    HG   LEU  45           HG       LEU  45 -11.136   6.857   2.556
  336   1HD1  LEU  45          1HD21     LEU  45 -12.369   4.748   2.183
  337   2HD1  LEU  45          3HD23     LEU  45 -12.289   4.385   3.922
  338   3HD1  LEU  45          2HD22     LEU  45 -13.180   5.806   3.350
  339   1HD2  LEU  45          3HD13     LEU  45 -10.036   7.306   4.723
  340   2HD2  LEU  45          1HD11     LEU  45 -11.803   7.344   4.827
  341   3HD2  LEU  45          2HD12     LEU  45 -10.915   5.944   5.453
  342    H    PHE  46           HN       PHE  46  -7.166   4.127   2.655
  343    HA   PHE  46           HA       PHE  46  -7.406   1.633   1.295
  344   1HB   PHE  46          2HB       PHE  46  -5.869   3.353   0.606
  345   2HB   PHE  46          1HB       PHE  46  -5.063   3.338   2.154
  346    HD1  PHE  46           HD1      PHE  46  -5.780   1.042  -0.817
  347    HD2  PHE  46           HD2      PHE  46  -3.062   2.080   2.371
  348    HE1  PHE  46           HE1      PHE  46  -3.937  -0.034  -2.006
  349    HE2  PHE  46           HE2      PHE  46  -1.267   0.798   1.251
  350    HZ   PHE  46           HZ       PHE  46  -1.643  -0.124  -1.017
  351    H    GLU  47           HN       GLU  47  -6.075   2.453   4.519
  352    HA   GLU  47           HA       GLU  47  -5.082  -0.102   5.206
  353   1HB   GLU  47          2HB       GLU  47  -4.780   2.197   6.361
  354   2HB   GLU  47          1HB       GLU  47  -6.273   1.803   7.233
  355   1HG   GLU  47          2HG       GLU  47  -3.682   0.175   7.154
  356   2HG   GLU  47          1HG       GLU  47  -4.209   1.215   8.481
  357    H    THR  48           HN       THR  48  -8.357   1.357   5.593
  358    HA   THR  48           HA       THR  48  -9.523  -0.823   7.013
  359    HB   THR  48           HB       THR  48 -10.906   1.000   4.990
  360    HG1  THR  48           HG1      THR  48  -9.724   2.135   6.664
  361   1HG2  THR  48          1HG21     THR  48 -11.938  -0.512   7.427
  362   2HG2  THR  48          3HG23     THR  48 -12.878   0.607   6.420
  363   3HG2  THR  48          2HG22     THR  48 -12.288  -0.917   5.732
  364    H    LEU  49           HN       LEU  49  -9.256  -0.132   3.479
  365    HA   LEU  49           HA       LEU  49 -10.429  -2.584   2.641
  366   1HB   LEU  49          2HB       LEU  49  -9.836  -0.478   1.261
  367   2HB   LEU  49          1HB       LEU  49  -8.201  -1.143   1.158
  368    HG   LEU  49           HG       LEU  49  -9.214  -3.185   0.055
  369   1HD1  LEU  49          2HD22     LEU  49 -11.728  -1.462   0.295
  370   2HD1  LEU  49          3HD23     LEU  49 -11.558  -2.737  -0.918
  371   3HD1  LEU  49          1HD21     LEU  49 -11.524  -3.147   0.805
  372   1HD2  LEU  49          3HD13     LEU  49  -8.250  -1.248  -1.217
  373   2HD2  LEU  49          2HD12     LEU  49  -9.561  -2.060  -2.084
  374   3HD2  LEU  49          1HD11     LEU  49  -9.855  -0.508  -1.268
  375    H    SER  50           HN       SER  50  -7.122  -1.742   3.622
  376    HA   SER  50           HA       SER  50  -5.818  -4.160   2.960
  377   1HB   SER  50          2HB       SER  50  -5.053  -2.534   5.385
  378   2HB   SER  50          1HB       SER  50  -4.110  -3.581   4.343
  379    HG   SER  50           HG       SER  50  -5.303  -1.389   3.124
  380    H    ASN  51           HN       ASN  51  -7.489  -3.242   5.972
  381    HA   ASN  51           HA       ASN  51  -7.156  -5.739   7.323
  382   1HB   ASN  51          2HB       ASN  51  -7.982  -3.933   8.602
  383   2HB   ASN  51          1HB       ASN  51  -9.242  -3.524   7.445
  384   1HD2  ASN  51          2HD22     ASN  51 -11.613  -5.847   8.709
  385   2HD2  ASN  51          1HD21     ASN  51 -11.266  -4.794   7.353
  386    H    ASP  52           HN       ASP  52  -9.830  -4.520   5.286
  387    HA   ASP  52           HA       ASP  52 -11.472  -6.767   5.392
  388   1HB   ASP  52          2HB       ASP  52 -11.122  -4.853   3.048
  389   2HB   ASP  52          1HB       ASP  52 -12.521  -5.887   3.353
  390    H    TYR  53           HN       TYR  53  -8.841  -6.154   3.002
  391    HA   TYR  53           HA       TYR  53  -9.156  -8.950   1.966
  392   1HB   TYR  53          1HB       TYR  53  -7.923  -6.399   0.927
  393   2HB   TYR  53          2HB       TYR  53  -7.635  -7.957   0.183
  394    HD1  TYR  53           HD1      TYR  53 -10.280  -5.449   0.897
  395    HD2  TYR  53           HD2      TYR  53  -9.092  -8.896  -1.400
  396    HE1  TYR  53           HE1      TYR  53 -12.001  -4.923  -0.790
  397    HE2  TYR  53           HE2      TYR  53 -10.674  -8.245  -3.179
  398    HH   TYR  53           HH       TYR  53 -12.867  -5.441  -2.865
  399    H    ALA  54           HN       ALA  54  -7.839  -8.303   4.626
  400    HA   ALA  54           HA       ALA  54  -5.055  -8.272   4.401
  401   1HB   ALA  54          3HB       ALA  54  -6.804  -9.696   6.457
  402   2HB   ALA  54          2HB       ALA  54  -5.069  -9.357   6.646
  403   3HB   ALA  54          1HB       ALA  54  -6.220  -8.016   6.534
  404    H    GLY  55           HN       GLY  55  -3.424  -9.815   4.186
  405   1HA   GLY  55          1HA       GLY  55  -2.435 -11.861   3.828
  406   2HA   GLY  55          2HA       GLY  55  -3.992 -12.670   4.052
  407    H    LYS  56           HN       LYS  56  -5.638 -11.884   2.196
  408    HA   LYS  56           HA       LYS  56  -4.709 -13.200  -0.153
  409   1HB   LYS  56          2HB       LYS  56  -7.155 -11.417   0.251
  410   2HB   LYS  56          1HB       LYS  56  -6.829 -12.454  -1.145
  411   1HG   LYS  56          1HG       LYS  56  -6.626 -14.409   0.570
  412   2HG   LYS  56          2HG       LYS  56  -7.347 -13.289   1.735
  413   1HD   LYS  56          2HD       LYS  56  -9.125 -14.605   0.846
  414   2HD   LYS  56          1HD       LYS  56  -9.294 -12.999   0.116
  415   1HE   LYS  56          2HE       LYS  56  -8.254 -13.851  -1.995
  416   2HE   LYS  56          1HE       LYS  56  -7.944 -15.409  -1.228
  417   1HZ   LYS  56          2HZ       LYS  56 -10.587 -14.234  -1.711
  418   2HZ   LYS  56          3HZ       LYS  56  -9.842 -15.395  -2.615
  419   3HZ   LYS  56          1HZ       LYS  56 -10.290 -15.724  -1.057
  420    H    VAL  57           HN       VAL  57  -4.762  -9.735   0.651
  421    HA   VAL  57           HA       VAL  57  -3.481  -9.134  -2.010
  422    HB   VAL  57           HB       VAL  57  -5.471  -7.587  -0.361
  423   1HG1  VAL  57          3HG13     VAL  57  -3.855  -6.012  -1.326
  424   2HG1  VAL  57          2HG12     VAL  57  -4.127  -6.652  -2.934
  425   3HG1  VAL  57          1HG11     VAL  57  -5.437  -5.838  -2.075
  426   1HG2  VAL  57          3HG23     VAL  57  -5.827  -9.000  -3.000
  427   2HG2  VAL  57          2HG22     VAL  57  -6.674  -9.253  -1.489
  428   3HG2  VAL  57          1HG21     VAL  57  -6.937  -7.758  -2.389
  429    H    ILE  58           HN       ILE  58  -1.732  -7.754  -1.934
  430    HA   ILE  58           HA       ILE  58  -0.571  -7.376   0.795
  431    HB   ILE  58           HB       ILE  58   0.936  -7.137  -1.796
  432   1HG1  ILE  58          1HG11     ILE  58   0.031  -9.337  -1.996
  433   2HG1  ILE  58          2HG12     ILE  58   1.727  -9.447  -1.537
  434   1HG2  ILE  58          3HG23     ILE  58   1.963  -6.256   0.250
  435   2HG2  ILE  58          1HG21     ILE  58   1.805  -7.839   1.032
  436   3HG2  ILE  58          2HG22     ILE  58   2.843  -7.651  -0.396
  437   1HD1  ILE  58          2HD12     ILE  58   1.021  -9.977   0.810
  438   2HD1  ILE  58          1HD11     ILE  58  -0.672 -10.010   0.226
  439   3HD1  ILE  58          3HD13     ILE  58   0.505 -11.150  -0.409
  440    H    PHE  59           HN       PHE  59  -0.675  -5.356   1.575
  441    HA   PHE  59           HA       PHE  59  -1.340  -3.095  -0.287
  442   1HB   PHE  59          2HB       PHE  59  -2.088  -3.550   2.614
  443   2HB   PHE  59          1HB       PHE  59  -2.245  -2.020   1.782
  444    HD1  PHE  59           HD2      PHE  59  -3.358  -5.607   1.650
  445    HD2  PHE  59           HD1      PHE  59  -4.213  -1.511   0.643
  446    HE1  PHE  59           HE2      PHE  59  -5.688  -6.181   1.145
  447    HE2  PHE  59           HE1      PHE  59  -6.422  -2.174  -0.227
  448    HZ   PHE  59           HZ       PHE  59  -7.179  -4.527  -0.018
  449    H    LEU  60           HN       LEU  60   0.534  -2.151  -0.736
  450    HA   LEU  60           HA       LEU  60   2.585  -1.739   1.410
  451   1HB   LEU  60          1HB       LEU  60   2.707  -1.748  -1.631
  452   2HB   LEU  60          2HB       LEU  60   4.081  -1.404  -0.552
  453    HG   LEU  60           HG       LEU  60   2.558  -4.015  -0.940
  454   1HD1  LEU  60          2HD22     LEU  60   4.242  -3.405  -2.659
  455   2HD1  LEU  60          3HD23     LEU  60   5.471  -3.231  -1.400
  456   3HD1  LEU  60          1HD21     LEU  60   4.751  -4.821  -1.720
  457   1HD2  LEU  60          3HD13     LEU  60   4.699  -3.333   1.124
  458   2HD2  LEU  60          2HD12     LEU  60   3.058  -3.974   1.414
  459   3HD2  LEU  60          1HD11     LEU  60   4.267  -4.982   0.630
  460    H    LYS  61           HN       LYS  61   1.616   0.189   2.403
  461    HA   LYS  61           HA       LYS  61   1.271   2.493   0.571
  462   1HB   LYS  61          1HB       LYS  61  -0.165   2.211   2.626
  463   2HB   LYS  61          2HB       LYS  61   1.264   2.491   3.591
  464   1HG   LYS  61          1HG       LYS  61   1.198   4.622   1.672
  465   2HG   LYS  61          2HG       LYS  61  -0.463   4.366   2.171
  466   1HD   LYS  61          1HD       LYS  61   0.464   6.013   3.642
  467   2HD   LYS  61          2HD       LYS  61   0.215   4.524   4.556
  468   1HE   LYS  61          2HE       LYS  61   2.363   5.605   5.140
  469   2HE   LYS  61          1HE       LYS  61   2.659   4.025   4.417
  470   1HZ   LYS  61          1HZ       LYS  61   2.869   6.602   3.033
  471   2HZ   LYS  61          3HZ       LYS  61   4.120   5.660   3.547
  472   3HZ   LYS  61          2HZ       LYS  61   3.132   5.126   2.350
  473    H    VAL  62           HN       VAL  62   3.048   3.417  -0.250
  474    HA   VAL  62           HA       VAL  62   5.623   3.232   1.270
  475    HB   VAL  62           HB       VAL  62   5.040   3.110  -1.712
  476   1HG1  VAL  62          1HG11     VAL  62   7.712   3.524  -0.286
  477   2HG1  VAL  62          2HG12     VAL  62   7.526   3.049  -1.986
  478   3HG1  VAL  62          3HG13     VAL  62   6.963   4.635  -1.455
  479   1HG2  VAL  62          2HG22     VAL  62   4.943   1.000  -0.382
  480   2HG2  VAL  62          1HG21     VAL  62   6.307   1.023  -1.516
  481   3HG2  VAL  62          3HG23     VAL  62   6.588   1.318   0.211
  482    H    ASP  63           HN       ASP  63   6.447   5.062   1.954
  483    HA   ASP  63           HA       ASP  63   5.402   7.670   1.062
  484   1HB   ASP  63          1HB       ASP  63   5.919   7.460   3.386
  485   2HB   ASP  63          2HB       ASP  63   7.549   6.861   3.024
  486    H    VAL  64           HN       VAL  64   6.021   8.236  -0.997
  487    HA   VAL  64           HA       VAL  64   8.447   7.434  -2.263
  488    HB   VAL  64           HB       VAL  64   7.936   9.080  -3.957
  489   1HG1  VAL  64          3HG13     VAL  64   6.636   7.011  -3.959
  490   2HG1  VAL  64          1HG11     VAL  64   5.363   7.775  -2.984
  491   3HG1  VAL  64          2HG12     VAL  64   5.711   8.371  -4.614
  492   1HG2  VAL  64          3HG23     VAL  64   6.000  10.312  -1.996
  493   2HG2  VAL  64          2HG22     VAL  64   7.356  11.069  -2.839
  494   3HG2  VAL  64          1HG21     VAL  64   5.921  10.585  -3.746
  495    H    ASP  65           HN       ASP  65   7.667  10.186  -0.187
  496    HA   ASP  65           HA       ASP  65   9.770  11.946  -0.762
  497   1HB   ASP  65          2HB       ASP  65   7.836  12.375   0.768
  498   2HB   ASP  65          1HB       ASP  65   8.578  11.318   1.972
  499    H    ALA  66           HN       ALA  66   9.663   9.226   1.580
  500    HA   ALA  66           HA       ALA  66  12.509   9.278   2.115
  501   1HB   ALA  66          1HB       ALA  66  10.340   7.208   2.658
  502   2HB   ALA  66          3HB       ALA  66  11.982   7.192   3.341
  503   3HB   ALA  66          2HB       ALA  66  10.862   8.504   3.758
  504    H    VAL  67           HN       VAL  67  10.373   6.881   0.400
  505    HA   VAL  67           HA       VAL  67  12.771   5.484  -0.582
  506    HB   VAL  67           HB       VAL  67   9.876   4.819  -1.227
  507   1HG1  VAL  67          3HG23     VAL  67  11.796   3.681  -2.469
  508   2HG1  VAL  67          1HG21     VAL  67  12.380   3.083  -0.915
  509   3HG1  VAL  67          2HG22     VAL  67  10.789   2.572  -1.520
  510   1HG2  VAL  67          3HG13     VAL  67  11.563   4.072   1.190
  511   2HG2  VAL  67          1HG11     VAL  67   9.977   4.871   1.210
  512   3HG2  VAL  67          2HG12     VAL  67  10.105   3.180   0.707
  513    H    ALA  68           HN       ALA  68  13.184   7.771  -1.554
  514    HA   ALA  68           HA       ALA  68  11.992   8.660  -3.919
  515   1HB   ALA  68          1HB       ALA  68  13.680   9.924  -2.653
  516   2HB   ALA  68          2HB       ALA  68  14.937   8.755  -3.118
  517   3HB   ALA  68          3HB       ALA  68  14.160   9.766  -4.356
  518    H    ALA  69           HN       ALA  69  14.599   6.248  -3.512
  519    HA   ALA  69           HA       ALA  69  15.304   5.789  -6.164
  520   1HB   ALA  69          2HB       ALA  69  16.497   4.848  -4.235
  521   2HB   ALA  69          3HB       ALA  69  15.125   3.775  -3.877
  522   3HB   ALA  69          1HB       ALA  69  16.051   3.566  -5.379
  523    H    VAL  70           HN       VAL  70  12.804   3.932  -4.310
  524    HA   VAL  70           HA       VAL  70  12.025   2.391  -6.622
  525    HB   VAL  70           HB       VAL  70  10.399   2.960  -4.108
  526   1HG1  VAL  70          1HG11     VAL  70   9.082   2.030  -6.035
  527   2HG1  VAL  70          2HG12     VAL  70  10.228   0.691  -6.137
  528   3HG1  VAL  70          3HG13     VAL  70   9.221   0.897  -4.684
  529   1HG2  VAL  70          3HG23     VAL  70  12.619   1.879  -3.598
  530   2HG2  VAL  70          1HG21     VAL  70  11.253   0.778  -3.332
  531   3HG2  VAL  70          2HG22     VAL  70  12.248   0.630  -4.800
  532    H    ALA  71           HN       ALA  71  10.762   5.349  -5.031
  533    HA   ALA  71           HA       ALA  71   8.486   5.734  -6.625
  534   1HB   ALA  71          3HB       ALA  71   9.083   7.085  -4.638
  535   2HB   ALA  71          1HB       ALA  71  10.349   7.908  -5.569
  536   3HB   ALA  71          2HB       ALA  71   8.652   8.095  -6.036
  537    H    GLU  72           HN       GLU  72  11.818   7.018  -7.343
  538    HA   GLU  72           HA       GLU  72  10.952   8.092  -9.877
  539   1HB   GLU  72          2HB       GLU  72  13.251   8.570 -10.308
  540   2HB   GLU  72          1HB       GLU  72  12.872   8.979  -8.632
  541   1HG   GLU  72          1HG       GLU  72  13.940   6.790  -7.949
  542   2HG   GLU  72          2HG       GLU  72  14.458   6.567  -9.622
  543    H    ALA  73           HN       ALA  73  12.559   4.978  -8.937
  544    HA   ALA  73           HA       ALA  73  12.956   4.000 -11.557
  545   1HB   ALA  73          1HB       ALA  73  13.853   2.923  -9.523
  546   2HB   ALA  73          3HB       ALA  73  12.208   2.449  -9.038
  547   3HB   ALA  73          2HB       ALA  73  12.932   1.772 -10.509
  548    H    ALA  74           HN       ALA  74  10.057   3.886  -9.483
  549    HA   ALA  74           HA       ALA  74   8.427   2.450 -11.442
  550   1HB   ALA  74          2HB       ALA  74   7.785   3.775  -8.782
  551   2HB   ALA  74          3HB       ALA  74   6.674   2.759  -9.725
  552   3HB   ALA  74          1HB       ALA  74   8.159   2.064  -9.054
  553    H    GLY  75           HN       GLY  75   9.573   5.581 -11.516
  554   1HA   GLY  75          1HA       GLY  75   8.933   7.478 -12.563
  555   2HA   GLY  75          2HA       GLY  75   7.813   6.462 -13.493
  556    H    ILE  76           HN       ILE  76   7.753   7.103  -9.949
  557    HA   ILE  76           HA       ILE  76   4.930   7.840 -10.157
  558    HB   ILE  76           HB       ILE  76   6.799   7.990  -7.753
  559   1HG1  ILE  76          1HG11     ILE  76   6.693   5.726  -8.622
  560   2HG1  ILE  76          2HG12     ILE  76   5.879   5.845  -7.066
  561   1HG2  ILE  76          3HG23     ILE  76   3.776   8.150  -8.084
  562   2HG2  ILE  76          1HG21     ILE  76   4.555   7.823  -6.530
  563   3HG2  ILE  76          2HG22     ILE  76   4.852   9.355  -7.357
  564   1HD1  ILE  76          1HD11     ILE  76   4.526   5.682  -9.806
  565   2HD1  ILE  76          2HD12     ILE  76   4.694   4.383  -8.626
  566   3HD1  ILE  76          3HD13     ILE  76   3.690   5.781  -8.234
  567    H    THR  77           HN       THR  77   4.096   9.791 -10.212
  568    HA   THR  77           HA       THR  77   5.766  12.230  -9.758
  569    HB   THR  77           HB       THR  77   4.652  13.191 -11.801
  570    HG1  THR  77           HG1      THR  77   3.882  11.471 -13.279
  571   1HG2  THR  77          2HG22     THR  77   6.982  12.248 -11.876
  572   2HG2  THR  77          1HG21     THR  77   6.308  10.694 -12.409
  573   3HG2  THR  77          3HG23     THR  77   6.129  12.134 -13.425
  574    H    ALA  78           HN       ALA  78   2.499  11.599 -10.929
  575    HA   ALA  78           HA       ALA  78   1.282  13.513  -9.121
  576   1HB   ALA  78          3HB       ALA  78   0.064  11.439 -10.985
  577   2HB   ALA  78          2HB       ALA  78  -0.824  12.752 -10.179
  578   3HB   ALA  78          1HB       ALA  78   0.427  13.131 -11.380
  579    H    MET  79           HN       MET  79   2.358  12.349  -7.212
  580    HA   MET  79           HA       MET  79   1.055  10.001  -6.195
  581   1HB   MET  79          1HB       MET  79   2.275  10.370  -4.170
  582   2HB   MET  79          2HB       MET  79   3.309  10.763  -5.538
  583   1HG   MET  79          2HG       MET  79   3.738  12.477  -4.027
  584   2HG   MET  79          1HG       MET  79   2.584  13.209  -5.136
  585   1HE   MET  79          1HE       MET  79   2.395  15.113  -3.483
  586   2HE   MET  79          3HE       MET  79   0.802  14.756  -4.185
  587   3HE   MET  79          2HE       MET  79   0.946  15.135  -2.457
  588    HA   PRO  80           HA       PRO  80   0.220   9.325  -4.005
  589   1HB   PRO  80          2HB       PRO  80  -2.156   8.224  -3.247
  590   2HB   PRO  80          1HB       PRO  80  -1.258   9.419  -2.268
  591   1HG   PRO  80          1HG       PRO  80  -3.594   9.937  -4.113
  592   2HG   PRO  80          2HG       PRO  80  -3.285  10.566  -2.461
  593   1HD   PRO  80          2HD       PRO  80  -2.730  12.015  -4.736
  594   2HD   PRO  80          1HD       PRO  80  -1.783  12.179  -3.230
  595    H    THR  81           HN       THR  81   0.581   7.607  -5.279
  596    HA   THR  81           HA       THR  81  -1.126   7.170  -7.695
  597    HB   THR  81           HB       THR  81   1.835   6.708  -7.318
  598    HG1  THR  81           HG1      THR  81   0.395   8.926  -8.214
  599   1HG2  THR  81          3HG23     THR  81   0.080   6.592  -9.813
  600   2HG2  THR  81          1HG21     THR  81   1.845   6.458  -9.795
  601   3HG2  THR  81          2HG22     THR  81   0.852   5.221  -9.005
  602    H    PHE  82           HN       PHE  82  -1.976   5.204  -7.904
  603    HA   PHE  82           HA       PHE  82  -1.438   3.126  -5.840
  604   1HB   PHE  82          2HB       PHE  82  -3.850   3.916  -7.443
  605   2HB   PHE  82          1HB       PHE  82  -3.744   2.342  -6.677
  606    HD1  PHE  82           HD2      PHE  82  -3.442   2.208  -4.159
  607    HD2  PHE  82           HD1      PHE  82  -4.198   5.969  -6.141
  608    HE1  PHE  82           HE2      PHE  82  -3.906   3.282  -1.975
  609    HE2  PHE  82           HE1      PHE  82  -4.557   7.047  -3.950
  610    HZ   PHE  82           HZ       PHE  82  -4.308   5.708  -1.839
  611    H    HIS  83           HN       HIS  83   0.114   1.729  -6.711
  612    HA   HIS  83           HA       HIS  83  -0.204   0.907  -9.595
  613   1HB   HIS  83          2HB       HIS  83   2.098   0.795  -7.638
  614   2HB   HIS  83          1HB       HIS  83   2.019  -0.235  -9.075
  615    HD2  HIS  83           HD2      HIS  83   0.707   3.148 -10.035
  616    HE1  HIS  83           HE1      HIS  83   4.769   2.964 -11.197
  617    HE2  HIS  83           HE2      HIS  83   2.558   4.223 -11.537
  618    H    VAL  84           HN       VAL  84  -0.209  -1.343 -10.085
  619    HA   VAL  84           HA       VAL  84  -0.728  -3.158  -7.754
  620    HB   VAL  84           HB       VAL  84  -2.127  -3.362 -10.431
  621   1HG1  VAL  84          2HG22     VAL  84  -2.478  -4.711  -7.707
  622   2HG1  VAL  84          3HG23     VAL  84  -3.538  -4.938  -9.106
  623   3HG1  VAL  84          1HG21     VAL  84  -1.852  -5.471  -9.187
  624   1HG2  VAL  84          3HG13     VAL  84  -3.143  -2.226  -7.784
  625   2HG2  VAL  84          2HG12     VAL  84  -2.966  -1.328  -9.309
  626   3HG2  VAL  84          1HG11     VAL  84  -4.153  -2.632  -9.186
  627    H    TYR  85           HN       TYR  85   1.213  -4.271  -7.639
  628    HA   TYR  85           HA       TYR  85   2.536  -5.038 -10.199
  629   1HB   TYR  85          1HB       TYR  85   3.556  -5.067  -7.355
  630   2HB   TYR  85          2HB       TYR  85   4.376  -5.840  -8.689
  631    HD1  TYR  85           HD2      TYR  85   3.052  -2.578  -7.501
  632    HD2  TYR  85           HD1      TYR  85   5.806  -4.580 -10.128
  633    HE1  TYR  85           HE2      TYR  85   4.117  -0.406  -8.051
  634    HE2  TYR  85           HE1      TYR  85   6.745  -2.383 -10.813
  635    HH   TYR  85           HH       TYR  85   5.186   0.651  -9.847
  636    H    LYS  86           HN       LYS  86   0.562  -6.492 -10.572
  637    HA   LYS  86           HA       LYS  86   0.537  -9.061  -9.129
  638   1HB   LYS  86          1HB       LYS  86  -0.692  -8.024 -11.697
  639   2HB   LYS  86          2HB       LYS  86  -0.707  -9.741 -11.351
  640   1HG   LYS  86          1HG       LYS  86  -1.741  -7.788  -9.293
  641   2HG   LYS  86          2HG       LYS  86  -2.732  -8.228 -10.681
  642   1HD   LYS  86          1HD       LYS  86  -1.597 -10.267  -8.702
  643   2HD   LYS  86          2HD       LYS  86  -3.232  -9.597  -8.682
  644   1HE   LYS  86          2HE       LYS  86  -3.381 -10.445 -11.163
  645   2HE   LYS  86          1HE       LYS  86  -2.034 -11.502 -10.691
  646   1HZ   LYS  86          3HZ       LYS  86  -3.451 -12.266  -8.870
  647   2HZ   LYS  86          1HZ       LYS  86  -4.677 -11.322  -9.421
  648   3HZ   LYS  86          2HZ       LYS  86  -4.114 -12.568 -10.344
  649    H    ASP  87           HN       ASP  87   1.393 -10.999  -9.935
  650    HA   ASP  87           HA       ASP  87   2.657 -12.498 -11.036
  651   1HB   ASP  87          2HB       ASP  87   1.842 -11.658 -13.180
  652   2HB   ASP  87          1HB       ASP  87   3.057 -10.384 -13.213
  653    H    GLY  88           HN       GLY  88   4.096  -9.399 -11.628
  654   1HA   GLY  88          1HA       GLY  88   5.954  -9.030  -9.663
  655   2HA   GLY  88          2HA       GLY  88   6.808 -10.120 -10.782
  656    H    VAL  89           HN       VAL  89   4.389  -7.586 -11.710
  657    HA   VAL  89           HA       VAL  89   6.409  -5.686 -12.531
  658    HB   VAL  89           HB       VAL  89   6.578  -7.331 -14.363
  659   1HG1  VAL  89          3HG13     VAL  89   4.339  -8.379 -14.216
  660   2HG1  VAL  89          1HG11     VAL  89   3.596  -6.889 -14.837
  661   3HG1  VAL  89          2HG12     VAL  89   4.703  -7.826 -15.854
  662   1HG2  VAL  89          3HG23     VAL  89   6.788  -4.902 -14.867
  663   2HG2  VAL  89          1HG21     VAL  89   6.229  -5.873 -16.239
  664   3HG2  VAL  89          2HG22     VAL  89   5.073  -4.875 -15.343
  665    H    LYS  90           HN       LYS  90   5.340  -3.674 -13.120
  666    HA   LYS  90           HA       LYS  90   2.953  -3.134 -11.696
  667   1HB   LYS  90          1HB       LYS  90   4.750  -1.468 -12.373
  668   2HB   LYS  90          2HB       LYS  90   4.123  -1.562 -14.015
  669   1HG   LYS  90          1HG       LYS  90   1.788  -0.994 -12.803
  670   2HG   LYS  90          2HG       LYS  90   2.829  -0.497 -11.482
  671   1HD   LYS  90          2HD       LYS  90   2.223   1.411 -12.844
  672   2HD   LYS  90          1HD       LYS  90   3.966   1.126 -12.977
  673   1HE   LYS  90          1HE       LYS  90   2.761   1.731 -15.119
  674   2HE   LYS  90          2HE       LYS  90   3.748   0.273 -15.217
  675   1HZ   LYS  90          3HZ       LYS  90   0.843   0.283 -14.772
  676   2HZ   LYS  90          1HZ       LYS  90   1.581   0.023 -16.224
  677   3HZ   LYS  90          2HZ       LYS  90   1.803  -1.045 -14.992
  678    H    ALA  91           HN       ALA  91   1.258  -4.510 -12.289
  679    HA   ALA  91           HA       ALA  91   0.504  -4.920 -15.076
  680   1HB   ALA  91          1HB       ALA  91   0.261  -6.670 -13.356
  681   2HB   ALA  91          2HB       ALA  91  -0.911  -5.653 -12.477
  682   3HB   ALA  91          3HB       ALA  91  -1.301  -6.263 -14.098
  683    H    ASP  92           HN       ASP  92  -0.372  -2.687 -12.483
  684    HA   ASP  92           HA       ASP  92  -2.035  -1.219 -14.388
  685   1HB   ASP  92          1HB       ASP  92  -3.372  -3.063 -12.978
  686   2HB   ASP  92          2HB       ASP  92  -3.365  -1.806 -11.737
  687    H    ASP  93           HN       ASP  93  -2.892   0.800 -13.332
  688    HA   ASP  93           HA       ASP  93  -1.117   2.011 -11.321
  689   1HB   ASP  93          1HB       ASP  93  -0.237   2.269 -13.764
  690   2HB   ASP  93          2HB       ASP  93  -1.542   3.423 -13.986
  691    H    LEU  94           HN       LEU  94  -1.985   4.398 -11.316
  692    HA   LEU  94           HA       LEU  94  -4.477   5.376 -11.924
  693   1HB   LEU  94          1HB       LEU  94  -5.660   3.578 -10.868
  694   2HB   LEU  94          2HB       LEU  94  -4.558   3.570  -9.490
  695    HG   LEU  94           HG       LEU  94  -5.577   5.836  -8.824
  696   1HD1  LEU  94          3HD13     LEU  94  -7.532   5.052 -11.035
  697   2HD1  LEU  94          1HD11     LEU  94  -7.737   6.414  -9.912
  698   3HD1  LEU  94          2HD12     LEU  94  -6.448   6.442 -11.114
  699   1HD2  LEU  94          1HD21     LEU  94  -6.270   3.733  -7.772
  700   2HD2  LEU  94          3HD23     LEU  94  -7.620   4.857  -7.934
  701   3HD2  LEU  94          2HD22     LEU  94  -7.479   3.482  -9.048
  702    H    VAL  95           HN       VAL  95  -4.780   7.449 -10.796
  703    HA   VAL  95           HA       VAL  95  -2.759   8.158  -8.770
  704    HB   VAL  95           HB       VAL  95  -2.498  10.349  -9.964
  705   1HG1  VAL  95          1HG11     VAL  95  -1.538   7.857 -11.429
  706   2HG1  VAL  95          3HG13     VAL  95  -0.897   9.490 -11.662
  707   3HG1  VAL  95          2HG12     VAL  95  -0.745   8.708 -10.081
  708   1HG2  VAL  95          1HG21     VAL  95  -4.500  10.244 -11.447
  709   2HG2  VAL  95          2HG22     VAL  95  -3.003  10.524 -12.343
  710   3HG2  VAL  95          3HG23     VAL  95  -3.744   8.917 -12.358
  711    H    GLY  96           HN       GLY  96  -3.456   9.724  -7.339
  712   1HA   GLY  96          1HA       GLY  96  -4.882  11.375  -6.474
  713   2HA   GLY  96          2HA       GLY  96  -6.058  11.066  -7.766
  714    H    ALA  97           HN       ALA  97  -7.131  11.452  -5.448
  715    HA   ALA  97           HA       ALA  97  -7.323   9.200  -3.659
  716   1HB   ALA  97          1HB       ALA  97  -7.527  11.679  -3.093
  717   2HB   ALA  97          2HB       ALA  97  -9.104  11.666  -3.888
  718   3HB   ALA  97          3HB       ALA  97  -8.832  10.665  -2.445
  719    H    SER  98           HN       SER  98  -8.126   8.364  -6.351
  720    HA   SER  98           HA       SER  98 -11.054   8.257  -6.410
  721   1HB   SER  98          1HB       SER  98  -9.006   6.728  -8.042
  722   2HB   SER  98          2HB       SER  98 -10.718   6.984  -8.434
  723    HG   SER  98           HG       SER  98 -10.209   9.269  -8.466
  724    H    GLN  99           HN       GLN  99 -10.910   7.407  -4.109
  725    HA   GLN  99           HA       GLN  99 -10.089   4.897  -3.255
  726   1HB   GLN  99          2HB       GLN  99 -12.577   6.505  -2.586
  727   2HB   GLN  99          1HB       GLN  99 -12.046   5.105  -1.643
  728   1HG   GLN  99          1HG       GLN  99 -10.284   6.201  -0.691
  729   2HG   GLN  99          2HG       GLN  99  -9.914   7.161  -2.118
  730   1HE2  GLN  99          2HE22     GLN  99 -11.962   9.915  -1.210
  731   2HE2  GLN  99          1HE21     GLN  99 -11.077   9.163  -2.531
  732    H    ASP 100           HN       ASP 100 -13.049   5.679  -5.080
  733    HA   ASP 100           HA       ASP 100 -14.324   3.126  -4.969
  734   1HB   ASP 100          1HB       ASP 100 -15.569   3.947  -6.905
  735   2HB   ASP 100          2HB       ASP 100 -15.448   5.218  -5.684
  736    H    LYS 101           HN       LYS 101 -12.038   4.612  -7.283
  737    HA   LYS 101           HA       LYS 101 -11.937   2.282  -8.979
  738   1HB   LYS 101          1HB       LYS 101 -11.537   4.724  -9.573
  739   2HB   LYS 101          2HB       LYS 101  -9.917   4.554  -8.891
  740   1HG   LYS 101          2HG       LYS 101  -9.283   2.954 -10.535
  741   2HG   LYS 101          1HG       LYS 101 -10.946   2.608 -11.007
  742   1HD   LYS 101          1HD       LYS 101  -9.760   5.379 -11.402
  743   2HD   LYS 101          2HD       LYS 101  -9.539   4.081 -12.592
  744   1HE   LYS 101          1HE       LYS 101 -11.993   3.845 -12.823
  745   2HE   LYS 101          2HE       LYS 101 -12.247   5.138 -11.639
  746   1HZ   LYS 101          3HZ       LYS 101 -10.868   5.429 -14.208
  747   2HZ   LYS 101          2HZ       LYS 101 -12.394   5.942 -13.854
  748   3HZ   LYS 101          1HZ       LYS 101 -11.100   6.627 -13.099
  749    H    LEU 102           HN       LEU 102 -10.111   3.448  -6.178
  750    HA   LEU 102           HA       LEU 102  -7.927   1.656  -6.238
  751   1HB   LEU 102          2HB       LEU 102  -8.581   3.646  -4.585
  752   2HB   LEU 102          1HB       LEU 102  -9.324   2.353  -3.641
  753    HG   LEU 102           HG       LEU 102  -6.432   2.785  -4.400
  754   1HD1  LEU 102          1HD11     LEU 102  -7.407   4.108  -2.539
  755   2HD1  LEU 102          2HD12     LEU 102  -7.944   2.611  -1.744
  756   3HD1  LEU 102          3HD13     LEU 102  -6.220   2.959  -1.926
  757   1HD2  LEU 102          2HD22     LEU 102  -7.625   0.354  -2.996
  758   2HD2  LEU 102          1HD21     LEU 102  -6.769   0.369  -4.560
  759   3HD2  LEU 102          3HD23     LEU 102  -5.895   0.757  -3.087
  760    H    LYS 103           HN       LYS 103 -11.165   1.351  -4.653
  761    HA   LYS 103           HA       LYS 103 -10.916  -1.343  -3.812
  762   1HB   LYS 103          2HB       LYS 103 -13.337   0.347  -4.584
  763   2HB   LYS 103          1HB       LYS 103 -13.437  -1.266  -3.873
  764   1HG   LYS 103          2HG       LYS 103 -12.221  -0.538  -1.890
  765   2HG   LYS 103          1HG       LYS 103 -11.993   1.081  -2.565
  766   1HD   LYS 103          2HD       LYS 103 -14.445   1.422  -2.603
  767   2HD   LYS 103          1HD       LYS 103 -14.687  -0.207  -1.936
  768   1HE   LYS 103          1HE       LYS 103 -13.389   0.441   0.097
  769   2HE   LYS 103          2HE       LYS 103 -13.165   2.070  -0.571
  770   1HZ   LYS 103          1HZ       LYS 103 -15.538   2.338  -0.527
  771   2HZ   LYS 103          2HZ       LYS 103 -15.740   0.823   0.091
  772   3HZ   LYS 103          3HZ       LYS 103 -14.966   1.977   0.976
  773    H    ALA 104           HN       ALA 104 -12.258   0.026  -6.863
  774    HA   ALA 104           HA       ALA 104 -12.944  -2.396  -8.091
  775   1HB   ALA 104          1HB       ALA 104 -13.464  -0.110  -8.972
  776   2HB   ALA 104          3HB       ALA 104 -11.772   0.037  -9.505
  777   3HB   ALA 104          2HB       ALA 104 -12.810  -1.215 -10.199
  778    H    LEU 105           HN       LEU 105  -9.737  -0.714  -8.212
  779    HA   LEU 105           HA       LEU 105  -8.392  -2.560  -9.870
  780   1HB   LEU 105          1HB       LEU 105  -7.425  -0.828  -7.559
  781   2HB   LEU 105          2HB       LEU 105  -6.330  -1.846  -8.475
  782    HG   LEU 105           HG       LEU 105  -8.008   0.326  -9.783
  783   1HD1  LEU 105          2HD22     LEU 105  -5.136   0.368  -8.728
  784   2HD1  LEU 105          1HD21     LEU 105  -5.896   1.630  -9.710
  785   3HD1  LEU 105          3HD23     LEU 105  -6.501   1.298  -8.076
  786   1HD2  LEU 105          1HD11     LEU 105  -5.509  -1.193 -10.654
  787   2HD2  LEU 105          2HD12     LEU 105  -7.134  -1.393 -11.349
  788   3HD2  LEU 105          3HD13     LEU 105  -6.267   0.141 -11.540
  789    H    VAL 106           HN       VAL 106  -8.547  -2.457  -6.261
  790    HA   VAL 106           HA       VAL 106  -7.022  -4.811  -5.868
  791    HB   VAL 106           HB       VAL 106  -9.240  -3.597  -4.152
  792   1HG1  VAL 106          1HG21     VAL 106  -7.199  -5.777  -3.554
  793   2HG1  VAL 106          2HG22     VAL 106  -8.157  -4.944  -2.307
  794   3HG1  VAL 106          3HG23     VAL 106  -8.960  -5.952  -3.515
  795   1HG2  VAL 106          1HG11     VAL 106  -6.190  -3.485  -4.024
  796   2HG2  VAL 106          3HG13     VAL 106  -7.247  -2.148  -4.512
  797   3HG2  VAL 106          2HG12     VAL 106  -7.299  -2.753  -2.849
  798    H    ALA 107           HN       ALA 107 -10.557  -4.462  -5.996
  799    HA   ALA 107           HA       ALA 107 -11.243  -7.188  -5.740
  800   1HB   ALA 107          2HB       ALA 107 -12.886  -5.354  -5.685
  801   2HB   ALA 107          3HB       ALA 107 -12.637  -5.044  -7.414
  802   3HB   ALA 107          1HB       ALA 107 -13.352  -6.580  -6.881
  803    H    LYS 108           HN       LYS 108 -10.778  -5.350  -8.781
  804    HA   LYS 108           HA       LYS 108 -11.160  -7.380 -10.656
  805   1HB   LYS 108          2HB       LYS 108 -11.026  -5.002 -11.166
  806   2HB   LYS 108          1HB       LYS 108  -9.325  -4.941 -10.680
  807   1HG   LYS 108          2HG       LYS 108  -8.814  -6.576 -12.572
  808   2HG   LYS 108          1HG       LYS 108 -10.488  -6.362 -13.103
  809   1HD   LYS 108          2HD       LYS 108  -8.330  -4.209 -12.823
  810   2HD   LYS 108          1HD       LYS 108  -8.904  -4.925 -14.334
  811   1HE   LYS 108          2HE       LYS 108 -11.190  -3.979 -13.869
  812   2HE   LYS 108          1HE       LYS 108 -10.534  -3.177 -12.427
  813   1HZ   LYS 108          1HZ       LYS 108  -9.011  -2.007 -13.832
  814   2HZ   LYS 108          2HZ       LYS 108  -9.629  -2.732 -15.177
  815   3HZ   LYS 108          3HZ       LYS 108 -10.570  -1.717 -14.284
  816    H    HIS 109           HN       HIS 109  -8.007  -6.233  -9.324
  817    HA   HIS 109           HA       HIS 109  -6.566  -8.330 -10.725
  818   1HB   HIS 109          1HB       HIS 109  -5.760  -6.249  -8.665
  819   2HB   HIS 109          2HB       HIS 109  -4.645  -7.433  -9.363
  820    HD2  HIS 109           HD2      HIS 109  -6.679  -4.288 -10.589
  821    HE1  HIS 109           HE1      HIS 109  -4.032  -5.509 -13.641
  822    HE2  HIS 109           HE2      HIS 109  -5.660  -3.681 -12.921
  823    H    ALA 110           HN       ALA 110  -8.029  -8.127  -7.484
  824    HA   ALA 110           HA       ALA 110  -6.600 -10.389  -6.403
  825   1HB   ALA 110          3HB       ALA 110  -9.387  -9.314  -5.765
  826   2HB   ALA 110          1HB       ALA 110  -8.502 -10.537  -4.834
  827   3HB   ALA 110          2HB       ALA 110  -7.875  -8.884  -4.939
  828    H    ALA 111           HN       ALA 111  -9.853 -10.062  -7.873
  829    HA   ALA 111           HA       ALA 111 -11.159 -11.421  -9.075
  830   1HB   ALA 111          2HB       ALA 111  -9.136 -11.731 -10.514
  831   2HB   ALA 111          3HB       ALA 111  -8.740 -13.207  -9.606
  832   3HB   ALA 111          1HB       ALA 111 -10.249 -13.113 -10.519
  833    H    ALA 112           HN       ALA 112  -8.950 -13.576  -7.224
  834    HA   ALA 112           HA       ALA 112 -11.061 -14.581  -5.552
  835   1HB   ALA 112          1HB       ALA 112  -9.777 -16.438  -7.614
  836   2HB   ALA 112          2HB       ALA 112 -10.794 -16.950  -6.250
  837   3HB   ALA 112          3HB       ALA 112 -11.496 -15.979  -7.562
   
  No H/Q in entry =         837
  Start of MODEL   12
    1   1H    GLY   1          2HN       GLY   1  -6.742  -9.198   8.579
    2   2H    GLY   1          3HN       GLY   1  -7.291  -7.647   8.919
    3   3H    GLY   1          1HN       GLY   1  -6.838  -8.060   7.395
    4   1HA   GLY   1          1HA       GLY   1  -5.024  -6.851   8.312
    5   2HA   GLY   1          2HA       GLY   1  -5.158  -7.787   9.811
    6    H    GLY   2           HN       GLY   2  -2.704  -7.557   8.225
    7   1HA   GLY   2          1HA       GLY   2  -1.524  -9.953   8.292
    8   2HA   GLY   2          2HA       GLY   2  -2.364 -10.046   6.726
    9    H    SER   3           HN       SER   3  -0.744  -9.630   5.179
   10    HA   SER   3           HA       SER   3   1.390  -7.775   5.556
   11   1HB   SER   3          1HB       SER   3   0.255  -8.875   2.947
   12   2HB   SER   3          2HB       SER   3   1.918  -8.357   3.283
   13    HG   SER   3           HG       SER   3   1.994 -10.109   4.821
   14    H    VAL   4           HN       VAL   4  -0.170  -6.000   6.361
   15    HA   VAL   4           HA       VAL   4  -0.981  -4.223   4.122
   16    HB   VAL   4           HB       VAL   4  -2.843  -3.629   5.565
   17   1HG1  VAL   4          3HG13     VAL   4  -3.234  -5.591   4.058
   18   2HG1  VAL   4          2HG12     VAL   4  -2.691  -6.684   5.345
   19   3HG1  VAL   4          1HG11     VAL   4  -4.141  -5.736   5.581
   20   1HG2  VAL   4          1HG21     VAL   4  -1.916  -3.888   7.775
   21   2HG2  VAL   4          3HG23     VAL   4  -3.477  -4.689   7.577
   22   3HG2  VAL   4          2HG22     VAL   4  -1.989  -5.651   7.590
   23    H    ILE   5           HN       ILE   5   1.565  -4.253   5.554
   24    HA   ILE   5           HA       ILE   5   1.424  -2.182   7.584
   25    HB   ILE   5           HB       ILE   5   3.821  -2.496   7.808
   26   1HG1  ILE   5          2HG12     ILE   5   4.753  -4.472   6.288
   27   2HG1  ILE   5          1HG11     ILE   5   3.625  -3.825   5.094
   28   1HG2  ILE   5          3HG23     ILE   5   2.212  -4.156   8.761
   29   2HG2  ILE   5          1HG21     ILE   5   2.482  -5.195   7.344
   30   3HG2  ILE   5          2HG22     ILE   5   3.820  -4.817   8.439
   31   1HD1  ILE   5          2HD12     ILE   5   5.823  -2.278   6.552
   32   2HD1  ILE   5          1HD11     ILE   5   5.931  -2.899   4.899
   33   3HD1  ILE   5          3HD13     ILE   5   4.788  -1.607   5.273
   34    H    VAL   6           HN       VAL   6   2.835  -0.337   7.646
   35    HA   VAL   6           HA       VAL   6   3.045   1.154   5.123
   36    HB   VAL   6           HB       VAL   6   1.205   2.136   6.390
   37   1HG1  VAL   6          2HG12     VAL   6   1.616   1.206   8.624
   38   2HG1  VAL   6          1HG11     VAL   6   3.035   2.259   8.818
   39   3HG1  VAL   6          3HG13     VAL   6   1.415   2.959   8.680
   40   1HG2  VAL   6          1HG21     VAL   6   2.898   3.701   5.357
   41   2HG2  VAL   6          3HG23     VAL   6   1.979   4.388   6.708
   42   3HG2  VAL   6          2HG22     VAL   6   3.652   3.859   6.955
   43    H    ILE   7           HN       ILE   7   5.025   2.100   4.735
   44    HA   ILE   7           HA       ILE   7   6.918   2.372   6.899
   45    HB   ILE   7           HB       ILE   7   6.855  -0.126   6.410
   46   1HG1  ILE   7          2HG12     ILE   7   9.645   0.634   5.755
   47   2HG1  ILE   7          1HG11     ILE   7   8.958   1.418   7.188
   48   1HG2  ILE   7          1HG21     ILE   7   6.560   0.127   3.922
   49   2HG2  ILE   7          3HG23     ILE   7   8.260   0.625   3.807
   50   3HG2  ILE   7          2HG22     ILE   7   7.834  -0.994   4.396
   51   1HD1  ILE   7          2HD12     ILE   7   8.816  -1.576   6.817
   52   2HD1  ILE   7          3HD13     ILE   7  10.089  -0.722   7.720
   53   3HD1  ILE   7          1HD11     ILE   7   8.396  -0.619   8.243
   54    H    ASP   8           HN       ASP   8   9.080   3.024   6.083
   55    HA   ASP   8           HA       ASP   8   8.943   4.669   3.620
   56   1HB   ASP   8          2HB       ASP   8   9.986   6.415   5.036
   57   2HB   ASP   8          1HB       ASP   8   8.473   5.897   5.767
   58    H    SER   9           HN       SER   9  10.124   2.105   3.490
   59    HA   SER   9           HA       SER   9  12.932   2.852   3.006
   60   1HB   SER   9          2HB       SER   9  12.126   0.765   5.070
   61   2HB   SER   9          1HB       SER   9  13.728   0.820   4.316
   62    HG   SER   9           HG       SER   9  12.812   3.230   5.355
   63    H    LYS  10           HN       LYS  10  13.529   2.015   1.141
   64    HA   LYS  10           HA       LYS  10  12.092   0.408  -0.578
   65   1HB   LYS  10          2HB       LYS  10  14.107   1.676  -1.176
   66   2HB   LYS  10          1HB       LYS  10  15.117   0.576  -0.246
   67   1HG   LYS  10          2HG       LYS  10  14.632  -1.286  -1.680
   68   2HG   LYS  10          1HG       LYS  10  13.350  -0.397  -2.524
   69   1HD   LYS  10          1HD       LYS  10  14.937   1.011  -3.636
   70   2HD   LYS  10          2HD       LYS  10  16.256   0.512  -2.561
   71   1HE   LYS  10          2HE       LYS  10  16.320  -0.559  -4.852
   72   2HE   LYS  10          1HE       LYS  10  16.348  -1.694  -3.493
   73   1HZ   LYS  10          1HZ       LYS  10  13.926  -1.012  -4.997
   74   2HZ   LYS  10          2HZ       LYS  10  14.856  -2.352  -5.250
   75   3HZ   LYS  10          3HZ       LYS  10  14.085  -2.158  -3.813
   76    H    ALA  11           HN       ALA  11  14.645  -0.547   1.630
   77    HA   ALA  11           HA       ALA  11  14.856  -3.290   1.198
   78   1HB   ALA  11          3HB       ALA  11  16.269  -2.061   2.806
   79   2HB   ALA  11          2HB       ALA  11  14.891  -1.890   3.917
   80   3HB   ALA  11          1HB       ALA  11  15.558  -3.498   3.566
   81    H    ALA  12           HN       ALA  12  12.433  -1.658   3.272
   82    HA   ALA  12           HA       ALA  12  11.140  -4.121   4.095
   83   1HB   ALA  12          3HB       ALA  12  11.045  -2.102   5.482
   84   2HB   ALA  12          2HB       ALA  12  10.180  -1.236   4.190
   85   3HB   ALA  12          1HB       ALA  12   9.429  -2.644   4.977
   86    H    TRP  13           HN       TRP  13  10.598  -1.637   1.558
   87    HA   TRP  13           HA       TRP  13   8.128  -2.593   0.539
   88   1HB   TRP  13          2HB       TRP  13   8.549  -0.739  -0.620
   89   2HB   TRP  13          1HB       TRP  13  10.265  -0.805  -0.334
   90    HD1  TRP  13           HD1      TRP  13  11.727  -2.312  -2.152
   91    HE1  TRP  13           HE1      TRP  13  11.449  -2.600  -4.655
   92    HE3  TRP  13           HE3      TRP  13   6.931  -0.597  -2.618
   93    HZ2  TRP  13           HZ2      TRP  13   9.544  -1.882  -6.650
   94    HZ3  TRP  13           HZ3      TRP  13   6.049  -0.106  -4.876
   95    HH2  TRP  13           HH2      TRP  13   7.366  -0.716  -6.899
   96    H    ASP  14           HN       ASP  14  11.467  -3.562  -0.350
   97    HA   ASP  14           HA       ASP  14  10.663  -5.609  -2.182
   98   1HB   ASP  14          2HB       ASP  14  13.249  -5.260  -0.599
   99   2HB   ASP  14          1HB       ASP  14  12.987  -6.488  -1.847
  100    H    ALA  15           HN       ALA  15  11.606  -5.762   1.253
  101    HA   ALA  15           HA       ALA  15  11.389  -8.528   1.637
  102   1HB   ALA  15          3HB       ALA  15  12.221  -6.937   3.353
  103   2HB   ALA  15          1HB       ALA  15  10.561  -6.353   3.611
  104   3HB   ALA  15          2HB       ALA  15  10.982  -8.029   4.001
  105    H    GLN  16           HN       GLN  16   8.826  -6.090   1.969
  106    HA   GLN  16           HA       GLN  16   6.644  -7.844   2.554
  107   1HB   GLN  16          2HB       GLN  16   6.973  -5.017   1.685
  108   2HB   GLN  16          1HB       GLN  16   5.476  -5.787   1.176
  109   1HG   GLN  16          2HG       GLN  16   5.245  -4.622   3.332
  110   2HG   GLN  16          1HG       GLN  16   4.784  -6.323   3.351
  111   1HE2  GLN  16          1HE21     GLN  16   8.350  -5.504   5.271
  112   2HE2  GLN  16          2HE22     GLN  16   8.093  -4.832   3.667
  113    H    LEU  17           HN       LEU  17   7.768  -6.459  -0.576
  114    HA   LEU  17           HA       LEU  17   5.933  -7.635  -2.285
  115   1HB   LEU  17          2HB       LEU  17   8.048  -6.048  -2.634
  116   2HB   LEU  17          1HB       LEU  17   8.863  -7.540  -3.078
  117    HG   LEU  17           HG       LEU  17   6.286  -6.488  -4.348
  118   1HD1  LEU  17          1HD21     LEU  17   8.143  -4.907  -4.689
  119   2HD1  LEU  17          2HD22     LEU  17   9.173  -6.225  -5.287
  120   3HD1  LEU  17          3HD23     LEU  17   7.732  -5.732  -6.201
  121   1HD2  LEU  17          3HD13     LEU  17   8.264  -8.642  -5.224
  122   2HD2  LEU  17          2HD12     LEU  17   6.574  -8.898  -4.730
  123   3HD2  LEU  17          1HD11     LEU  17   6.931  -8.024  -6.220
  124    H    ALA  18           HN       ALA  18   9.017  -9.054  -1.137
  125    HA   ALA  18           HA       ALA  18   8.676 -11.570  -2.452
  126   1HB   ALA  18          1HB       ALA  18  10.835 -10.700  -1.706
  127   2HB   ALA  18          2HB       ALA  18  10.329 -10.807  -0.008
  128   3HB   ALA  18          3HB       ALA  18  10.513 -12.287  -0.977
  129    H    LYS  19           HN       LYS  19   8.280 -10.832   1.108
  130    HA   LYS  19           HA       LYS  19   7.350 -13.480   1.662
  131   1HB   LYS  19          1HB       LYS  19   6.949 -12.678   3.876
  132   2HB   LYS  19          2HB       LYS  19   8.439 -11.923   3.283
  133   1HG   LYS  19          2HG       LYS  19   6.931  -9.955   2.589
  134   2HG   LYS  19          1HG       LYS  19   5.671 -10.679   3.551
  135   1HD   LYS  19          2HD       LYS  19   8.427  -9.811   4.560
  136   2HD   LYS  19          1HD       LYS  19   6.909  -8.932   4.795
  137   1HE   LYS  19          1HE       LYS  19   5.987 -10.899   6.053
  138   2HE   LYS  19          2HE       LYS  19   7.575 -11.683   5.933
  139   1HZ   LYS  19          3HZ       LYS  19   7.035  -9.100   7.217
  140   2HZ   LYS  19          2HZ       LYS  19   7.301 -10.530   7.992
  141   3HZ   LYS  19          1HZ       LYS  19   8.507  -9.834   7.113
  142    H    GLY  20           HN       GLY  20   5.692 -10.788   0.223
  143   1HA   GLY  20          1HA       GLY  20   3.036 -11.266   1.058
  144   2HA   GLY  20          2HA       GLY  20   3.590 -10.520  -0.455
  145    H    LYS  21           HN       LYS  21   5.198 -13.140  -0.946
  146    HA   LYS  21           HA       LYS  21   4.998 -15.186  -1.850
  147   1HB   LYS  21          1HB       LYS  21   2.027 -15.254  -1.157
  148   2HB   LYS  21          2HB       LYS  21   3.071 -16.586  -1.648
  149   1HG   LYS  21          1HG       LYS  21   4.483 -16.274   0.357
  150   2HG   LYS  21          2HG       LYS  21   3.459 -14.915   0.847
  151   1HD   LYS  21          2HD       LYS  21   1.504 -16.402   1.042
  152   2HD   LYS  21          1HD       LYS  21   2.502 -17.784   0.553
  153   1HE   LYS  21          2HE       LYS  21   2.265 -17.708   3.006
  154   2HE   LYS  21          1HE       LYS  21   3.955 -17.461   2.537
  155   1HZ   LYS  21          2HZ       LYS  21   2.063 -15.328   3.253
  156   2HZ   LYS  21          3HZ       LYS  21   3.237 -15.937   4.234
  157   3HZ   LYS  21          1HZ       LYS  21   3.651 -15.115   2.870
  158    H    GLU  22           HN       GLU  22   5.578 -14.090  -3.631
  159    HA   GLU  22           HA       GLU  22   3.862 -12.942  -5.599
  160   1HB   GLU  22          2HB       GLU  22   6.716 -14.026  -5.809
  161   2HB   GLU  22          1HB       GLU  22   5.896 -12.982  -6.974
  162   1HG   GLU  22          2HG       GLU  22   5.683 -11.213  -5.226
  163   2HG   GLU  22          1HG       GLU  22   6.592 -12.228  -4.095
  164    H    GLU  23           HN       GLU  23   2.447 -14.935  -5.280
  165    HA   GLU  23           HA       GLU  23   3.082 -17.151  -7.168
  166   1HB   GLU  23          1HB       GLU  23   0.473 -16.831  -5.633
  167   2HB   GLU  23          2HB       GLU  23   1.202 -18.274  -6.329
  168   1HG   GLU  23          2HG       GLU  23   2.021 -16.747  -3.839
  169   2HG   GLU  23          1HG       GLU  23   1.471 -18.412  -3.961
  170    H    HIS  24           HN       HIS  24   0.270 -15.003  -6.652
  171    HA   HIS  24           HA       HIS  24   0.235 -14.041  -9.383
  172   1HB   HIS  24          2HB       HIS  24  -1.891 -15.164 -10.009
  173   2HB   HIS  24          1HB       HIS  24  -0.749 -16.424  -9.553
  174    HD2  HIS  24           HD2      HIS  24  -4.101 -14.835  -8.348
  175    HE1  HIS  24           HE1      HIS  24  -3.003 -17.730  -5.471
  176    HE2  HIS  24           HE2      HIS  24  -4.861 -16.131  -6.213
  177    H    LYS  25           HN       LYS  25  -0.114 -13.250  -6.428
  178    HA   LYS  25           HA       LYS  25  -2.908 -12.327  -6.365
  179   1HB   LYS  25          1HB       LYS  25  -0.702 -12.200  -4.291
  180   2HB   LYS  25          2HB       LYS  25  -2.333 -11.581  -4.043
  181   1HG   LYS  25          1HG       LYS  25  -3.341 -13.741  -4.441
  182   2HG   LYS  25          2HG       LYS  25  -1.768 -14.483  -4.800
  183   1HD   LYS  25          2HD       LYS  25  -0.977 -14.081  -2.537
  184   2HD   LYS  25          1HD       LYS  25  -2.414 -13.111  -2.150
  185   1HE   LYS  25          2HE       LYS  25  -3.878 -15.045  -2.446
  186   2HE   LYS  25          1HE       LYS  25  -2.503 -16.041  -2.950
  187   1HZ   LYS  25          3HZ       LYS  25  -2.818 -14.737  -0.327
  188   2HZ   LYS  25          1HZ       LYS  25  -3.095 -16.340  -0.623
  189   3HZ   LYS  25          2HZ       LYS  25  -1.571 -15.722  -0.762
  190    HA   PRO  26           HA       PRO  26  -1.960  -8.017  -7.303
  191   1HB   PRO  26          2HB       PRO  26  -3.882  -6.725  -5.862
  192   2HB   PRO  26          1HB       PRO  26  -4.219  -7.636  -7.355
  193   1HG   PRO  26          1HG       PRO  26  -4.371  -8.706  -4.533
  194   2HG   PRO  26          2HG       PRO  26  -5.709  -8.676  -5.727
  195   1HD   PRO  26          1HD       PRO  26  -4.175 -10.839  -5.324
  196   2HD   PRO  26          2HD       PRO  26  -4.438 -10.353  -7.024
  197    H    ILE  27           HN       ILE  27  -0.079  -7.227  -6.522
  198    HA   ILE  27           HA       ILE  27   0.201  -6.748  -3.602
  199    HB   ILE  27           HB       ILE  27   2.280  -6.448  -5.793
  200   1HG1  ILE  27          1HG11     ILE  27   1.715  -8.767  -3.888
  201   2HG1  ILE  27          2HG12     ILE  27   1.655  -8.797  -5.652
  202   1HG2  ILE  27          1HG21     ILE  27   2.562  -5.063  -3.707
  203   2HG2  ILE  27          2HG22     ILE  27   2.561  -6.565  -2.764
  204   3HG2  ILE  27          3HG23     ILE  27   3.846  -6.239  -3.947
  205   1HD1  ILE  27          1HD11     ILE  27   4.108  -8.317  -5.716
  206   2HD1  ILE  27          2HD12     ILE  27   4.144  -8.486  -3.940
  207   3HD1  ILE  27          3HD13     ILE  27   3.672  -9.857  -4.944
  208    H    VAL  28           HN       VAL  28  -1.172  -5.059  -3.308
  209    HA   VAL  28           HA       VAL  28  -1.261  -2.832  -5.249
  210    HB   VAL  28           HB       VAL  28  -2.880  -3.225  -2.708
  211   1HG1  VAL  28          1HG11     VAL  28  -3.291  -1.530  -5.225
  212   2HG1  VAL  28          2HG12     VAL  28  -4.426  -1.653  -3.871
  213   3HG1  VAL  28          3HG13     VAL  28  -2.835  -0.904  -3.633
  214   1HG2  VAL  28          3HG23     VAL  28  -3.256  -5.139  -4.233
  215   2HG2  VAL  28          2HG22     VAL  28  -4.665  -4.087  -4.148
  216   3HG2  VAL  28          1HG21     VAL  28  -3.596  -4.011  -5.563
  217    H    VAL  29           HN       VAL  29   0.324  -1.348  -4.991
  218    HA   VAL  29           HA       VAL  29   1.137  -0.641  -2.200
  219    HB   VAL  29           HB       VAL  29   2.963  -1.634  -3.316
  220   1HG1  VAL  29          1HG11     VAL  29   2.323  -1.117  -5.683
  221   2HG1  VAL  29          2HG12     VAL  29   3.024   0.501  -5.396
  222   3HG1  VAL  29          3HG13     VAL  29   4.024  -0.954  -5.232
  223   1HG2  VAL  29          3HG23     VAL  29   3.128   0.515  -1.824
  224   2HG2  VAL  29          1HG21     VAL  29   4.544   0.096  -2.809
  225   3HG2  VAL  29          2HG22     VAL  29   3.430   1.386  -3.316
  226    H    ASP  30           HN       ASP  30   0.669   1.260  -1.492
  227    HA   ASP  30           HA       ASP  30  -0.361   3.398  -3.287
  228   1HB   ASP  30          2HB       ASP  30  -1.762   2.811  -1.430
  229   2HB   ASP  30          1HB       ASP  30  -0.448   3.045  -0.270
  230    H    PHE  31           HN       PHE  31   1.347   4.488  -4.071
  231    HA   PHE  31           HA       PHE  31   3.714   5.148  -2.397
  232   1HB   PHE  31          1HB       PHE  31   2.902   5.656  -5.278
  233   2HB   PHE  31          2HB       PHE  31   4.297   6.391  -4.550
  234    HD1  PHE  31           HD2      PHE  31   6.255   5.009  -3.798
  235    HD2  PHE  31           HD1      PHE  31   2.951   3.321  -5.996
  236    HE1  PHE  31           HE2      PHE  31   7.800   3.435  -4.902
  237    HE2  PHE  31           HE1      PHE  31   4.512   1.728  -7.087
  238    HZ   PHE  31           HZ       PHE  31   6.946   1.898  -6.691
  239    H    THR  32           HN       THR  32   2.937   6.593  -0.822
  240    HA   THR  32           HA       THR  32   1.452   9.018  -1.803
  241    HB   THR  32           HB       THR  32   0.005   7.572  -0.440
  242    HG1  THR  32           HG1      THR  32  -0.493   9.303   1.049
  243   1HG2  THR  32          3HG23     THR  32   1.763   6.572   1.056
  244   2HG2  THR  32          1HG21     THR  32   1.946   8.154   1.848
  245   3HG2  THR  32          2HG22     THR  32   0.403   7.289   1.941
  246    H    ALA  33           HN       ALA  33   2.189  10.983  -1.011
  247    HA   ALA  33           HA       ALA  33   4.933  10.961   0.234
  248   1HB   ALA  33          2HB       ALA  33   3.538  13.037  -1.495
  249   2HB   ALA  33          1HB       ALA  33   5.080  13.286  -0.647
  250   3HB   ALA  33          3HB       ALA  33   4.946  12.056  -1.912
  251    H    THR  34           HN       THR  34   3.251  10.254   1.914
  252    HA   THR  34           HA       THR  34   1.580  10.871   3.557
  253    HB   THR  34           HB       THR  34   3.167  11.224   5.533
  254    HG1  THR  34           HG1      THR  34   5.269  10.807   3.711
  255   1HG2  THR  34          1HG21     THR  34   3.831   8.991   3.549
  256   2HG2  THR  34          2HG22     THR  34   4.256   9.020   5.272
  257   3HG2  THR  34          3HG23     THR  34   2.554   8.969   4.778
  258    H    TRP  35           HN       TRP  35   4.101  13.280   4.006
  259    HA   TRP  35           HA       TRP  35   2.759  15.173   5.457
  260   1HB   TRP  35          2HB       TRP  35   4.429  16.780   4.638
  261   2HB   TRP  35          1HB       TRP  35   5.124  15.233   5.096
  262    HD1  TRP  35           HD1      TRP  35   6.598  14.031   3.364
  263    HE1  TRP  35           HE1      TRP  35   7.492  14.629   1.028
  264    HE3  TRP  35           HE3      TRP  35   3.544  18.013   2.280
  265    HZ2  TRP  35           HZ2      TRP  35   6.814  16.400  -1.109
  266    HZ3  TRP  35           HZ3      TRP  35   3.684  19.112   0.071
  267    HH2  TRP  35           HH2      TRP  35   5.303  18.312  -1.635
  268    H    CYS  36           HN       CYS  36   2.262  14.790   1.920
  269    HA   CYS  36           HA       CYS  36   1.079  17.454   1.675
  270   1HB   CYS  36          2HB       CYS  36   0.227  16.608  -0.541
  271   2HB   CYS  36          1HB       CYS  36   1.950  16.750  -0.273
  272    H    GLY  37           HN       GLY  37  -0.176  17.069   3.695
  273   1HA   GLY  37          1HA       GLY  37  -2.115  16.678   4.864
  274   2HA   GLY  37          2HA       GLY  37  -2.754  17.606   3.508
  275    HA   PRO  38           HA       PRO  38  -5.684  14.333   2.566
  276   1HB   PRO  38          1HB       PRO  38  -4.530  14.719  -0.209
  277   2HB   PRO  38          2HB       PRO  38  -6.230  14.399   0.253
  278   1HG   PRO  38          2HG       PRO  38  -5.450  16.945  -0.209
  279   2HG   PRO  38          1HG       PRO  38  -6.427  16.584   1.246
  280   1HD   PRO  38          2HD       PRO  38  -3.460  17.071   1.062
  281   2HD   PRO  38          1HD       PRO  38  -4.630  17.589   2.309
  282    H    CYS  39           HN       CYS  39  -2.497  14.143   1.035
  283    HA   CYS  39           HA       CYS  39  -2.227  11.479   0.354
  284   1HB   CYS  39          2HB       CYS  39  -0.200  13.402   1.551
  285   2HB   CYS  39          1HB       CYS  39   0.233  11.887   0.792
  286    H    LYS  40           HN       LYS  40  -1.944  12.931   3.603
  287    HA   LYS  40           HA       LYS  40  -0.868  10.521   4.792
  288   1HB   LYS  40          1HB       LYS  40  -0.876  13.170   5.526
  289   2HB   LYS  40          2HB       LYS  40  -2.177  12.580   6.545
  290   1HG   LYS  40          1HG       LYS  40   0.660  11.495   6.373
  291   2HG   LYS  40          2HG       LYS  40  -0.002  12.506   7.664
  292   1HD   LYS  40          1HD       LYS  40  -1.670  10.705   8.198
  293   2HD   LYS  40          2HD       LYS  40  -0.896   9.648   7.007
  294   1HE   LYS  40          1HE       LYS  40   0.449  10.832   9.479
  295   2HE   LYS  40          2HE       LYS  40  -0.113   9.163   9.289
  296   1HZ   LYS  40          2HZ       LYS  40   1.443   8.908   7.489
  297   2HZ   LYS  40          3HZ       LYS  40   1.995  10.447   7.703
  298   3HZ   LYS  40          1HZ       LYS  40   2.207   9.325   8.887
  299    H    MET  41           HN       MET  41  -3.952  12.259   5.157
  300    HA   MET  41           HA       MET  41  -5.257  10.239   6.677
  301   1HB   MET  41          2HB       MET  41  -7.353  11.455   6.146
  302   2HB   MET  41          1HB       MET  41  -6.051  12.492   6.742
  303   1HG   MET  41          2HG       MET  41  -5.578  13.274   4.491
  304   2HG   MET  41          1HG       MET  41  -6.774  12.163   3.804
  305   1HE   MET  41          3HE       MET  41  -6.068  15.397   5.774
  306   2HE   MET  41          1HE       MET  41  -7.693  16.022   6.140
  307   3HE   MET  41          2HE       MET  41  -7.082  14.596   7.003
  308    H    ILE  42           HN       ILE  42  -4.900  10.464   3.173
  309    HA   ILE  42           HA       ILE  42  -6.931   8.529   2.544
  310    HB   ILE  42           HB       ILE  42  -4.396   9.450   1.151
  311   1HG1  ILE  42          1HG11     ILE  42  -7.327   9.787   0.352
  312   2HG1  ILE  42          2HG12     ILE  42  -6.568  10.893   1.487
  313   1HG2  ILE  42          2HG22     ILE  42  -6.487   7.463   0.147
  314   2HG2  ILE  42          1HG21     ILE  42  -5.304   8.272  -0.895
  315   3HG2  ILE  42          3HG23     ILE  42  -4.746   7.167   0.357
  316   1HD1  ILE  42          1HD11     ILE  42  -4.798  11.405  -0.230
  317   2HD1  ILE  42          3HD13     ILE  42  -5.737  10.454  -1.393
  318   3HD1  ILE  42          2HD12     ILE  42  -6.443  11.903  -0.662
  319    H    ALA  43           HN       ALA  43  -3.654   8.154   3.922
  320    HA   ALA  43           HA       ALA  43  -3.283   5.437   3.184
  321   1HB   ALA  43          3HB       ALA  43  -2.153   6.986   5.552
  322   2HB   ALA  43          2HB       ALA  43  -1.692   5.343   5.081
  323   3HB   ALA  43          1HB       ALA  43  -1.431   6.700   3.974
  324    HA   PRO  44           HA       PRO  44  -5.588   4.257   7.407
  325   1HB   PRO  44          2HB       PRO  44  -7.400   6.685   7.228
  326   2HB   PRO  44          1HB       PRO  44  -7.073   5.659   8.656
  327   1HG   PRO  44          1HG       PRO  44  -5.770   8.022   8.238
  328   2HG   PRO  44          2HG       PRO  44  -4.907   6.603   8.911
  329   1HD   PRO  44          1HD       PRO  44  -4.677   7.792   6.204
  330   2HD   PRO  44          2HD       PRO  44  -3.548   6.775   7.129
  331    H    LEU  45           HN       LEU  45  -7.222   6.038   4.770
  332    HA   LEU  45           HA       LEU  45  -9.598   4.387   4.748
  333   1HB   LEU  45          2HB       LEU  45  -8.364   5.944   2.422
  334   2HB   LEU  45          1HB       LEU  45  -9.998   5.306   2.541
  335    HG   LEU  45           HG       LEU  45  -8.754   7.523   4.224
  336   1HD1  LEU  45          2HD12     LEU  45  -9.379   8.134   1.899
  337   2HD1  LEU  45          3HD13     LEU  45 -11.041   7.595   2.218
  338   3HD1  LEU  45          1HD11     LEU  45 -10.366   8.975   3.108
  339   1HD2  LEU  45          1HD21     LEU  45 -11.536   6.266   4.393
  340   2HD2  LEU  45          3HD23     LEU  45 -10.310   6.316   5.680
  341   3HD2  LEU  45          2HD22     LEU  45 -11.091   7.808   5.154
  342    H    PHE  46           HN       PHE  46  -6.665   4.452   2.720
  343    HA   PHE  46           HA       PHE  46  -7.228   2.052   1.282
  344   1HB   PHE  46          1HB       PHE  46  -5.618   3.710   0.591
  345   2HB   PHE  46          2HB       PHE  46  -4.661   3.463   2.041
  346    HD1  PHE  46           HD2      PHE  46  -6.066   1.049  -0.564
  347    HD2  PHE  46           HD1      PHE  46  -2.636   2.554   1.547
  348    HE1  PHE  46           HE2      PHE  46  -4.606  -0.505  -1.808
  349    HE2  PHE  46           HE1      PHE  46  -1.208   0.835   0.434
  350    HZ   PHE  46           HZ       PHE  46  -2.128  -0.602  -1.289
  351    H    GLU  47           HN       GLU  47  -5.654   2.603   4.435
  352    HA   GLU  47           HA       GLU  47  -4.683  -0.005   4.898
  353   1HB   GLU  47          2HB       GLU  47  -4.081   2.042   6.191
  354   2HB   GLU  47          1HB       GLU  47  -5.676   1.986   6.966
  355   1HG   GLU  47          2HG       GLU  47  -5.193  -0.145   8.001
  356   2HG   GLU  47          1HG       GLU  47  -3.677  -0.303   7.106
  357    H    THR  48           HN       THR  48  -7.919   1.449   5.299
  358    HA   THR  48           HA       THR  48  -9.082  -0.695   6.797
  359    HB   THR  48           HB       THR  48 -10.488   1.111   4.777
  360    HG1  THR  48           HG1      THR  48  -9.183   2.279   6.382
  361   1HG2  THR  48          3HG23     THR  48 -11.455  -0.239   7.323
  362   2HG2  THR  48          1HG21     THR  48 -12.396   0.849   6.284
  363   3HG2  THR  48          2HG22     THR  48 -11.873  -0.730   5.662
  364    H    LEU  49           HN       LEU  49  -8.994  -0.030   3.242
  365    HA   LEU  49           HA       LEU  49 -10.179  -2.481   2.377
  366   1HB   LEU  49          2HB       LEU  49  -8.100  -0.661   1.076
  367   2HB   LEU  49          1HB       LEU  49  -8.711  -2.126   0.319
  368    HG   LEU  49           HG       LEU  49 -10.998  -1.250   0.318
  369   1HD1  LEU  49          1HD21     LEU  49  -9.736   1.319   1.373
  370   2HD1  LEU  49          2HD22     LEU  49 -11.371   1.186   0.705
  371   3HD1  LEU  49          3HD23     LEU  49 -10.978   0.341   2.200
  372   1HD2  LEU  49          2HD12     LEU  49  -8.829   0.510  -0.910
  373   2HD2  LEU  49          1HD11     LEU  49  -9.534  -0.956  -1.625
  374   3HD2  LEU  49          3HD13     LEU  49 -10.517   0.506  -1.434
  375    H    SER  50           HN       SER  50  -6.834  -1.561   3.096
  376    HA   SER  50           HA       SER  50  -5.480  -3.890   2.387
  377   1HB   SER  50          2HB       SER  50  -4.685  -2.234   4.757
  378   2HB   SER  50          1HB       SER  50  -3.724  -3.272   3.708
  379    HG   SER  50           HG       SER  50  -5.036  -1.053   2.607
  380    H    ASN  51           HN       ASN  51  -6.802  -3.095   5.602
  381    HA   ASN  51           HA       ASN  51  -6.229  -5.536   6.872
  382   1HB   ASN  51          2HB       ASN  51  -7.048  -3.752   8.224
  383   2HB   ASN  51          1HB       ASN  51  -8.481  -3.516   7.218
  384   1HD2  ASN  51          2HD22     ASN  51 -10.434  -5.943   8.893
  385   2HD2  ASN  51          1HD21     ASN  51 -10.389  -4.763   7.602
  386    H    ASP  52           HN       ASP  52  -9.119  -4.528   5.066
  387    HA   ASP  52           HA       ASP  52 -10.669  -6.810   5.532
  388   1HB   ASP  52          2HB       ASP  52 -10.775  -4.879   3.177
  389   2HB   ASP  52          1HB       ASP  52 -12.059  -5.982   3.681
  390    H    TYR  53           HN       TYR  53  -8.805  -6.161   2.439
  391    HA   TYR  53           HA       TYR  53  -9.411  -9.006   1.693
  392   1HB   TYR  53          2HB       TYR  53  -7.836  -6.966   0.129
  393   2HB   TYR  53          1HB       TYR  53  -8.362  -8.544  -0.392
  394    HD1  TYR  53           HD2      TYR  53  -9.621  -5.155   0.497
  395    HD2  TYR  53           HD1      TYR  53 -10.226  -8.813  -1.693
  396    HE1  TYR  53           HE2      TYR  53 -10.914  -3.930  -1.212
  397    HE2  TYR  53           HE1      TYR  53 -11.494  -7.592  -3.396
  398    HH   TYR  53           HH       TYR  53 -12.258  -5.505  -4.100
  399    H    ALA  54           HN       ALA  54  -7.427  -8.245   3.985
  400    HA   ALA  54           HA       ALA  54  -4.784  -8.550   3.071
  401   1HB   ALA  54          3HB       ALA  54  -5.381  -7.871   5.364
  402   2HB   ALA  54          2HB       ALA  54  -6.017  -9.506   5.683
  403   3HB   ALA  54          1HB       ALA  54  -4.281  -9.263   5.369
  404    H    GLY  55           HN       GLY  55  -3.356 -10.333   2.942
  405   1HA   GLY  55          1HA       GLY  55  -2.704 -12.568   2.812
  406   2HA   GLY  55          2HA       GLY  55  -4.341 -13.096   3.247
  407    H    LYS  56           HN       LYS  56  -6.039 -12.198   1.477
  408    HA   LYS  56           HA       LYS  56  -5.499 -13.547  -0.986
  409   1HB   LYS  56          2HB       LYS  56  -7.576 -11.549  -0.017
  410   2HB   LYS  56          1HB       LYS  56  -7.596 -12.081  -1.692
  411   1HG   LYS  56          1HG       LYS  56  -7.408 -14.245   0.400
  412   2HG   LYS  56          2HG       LYS  56  -8.918 -13.340   0.300
  413   1HD   LYS  56          2HD       LYS  56  -9.069 -15.316  -1.044
  414   2HD   LYS  56          1HD       LYS  56  -9.197 -13.880  -2.058
  415   1HE   LYS  56          1HE       LYS  56  -6.611 -15.501  -1.774
  416   2HE   LYS  56          2HE       LYS  56  -7.858 -15.847  -2.972
  417   1HZ   LYS  56          3HZ       LYS  56  -7.612 -13.611  -3.809
  418   2HZ   LYS  56          1HZ       LYS  56  -6.283 -13.387  -2.860
  419   3HZ   LYS  56          2HZ       LYS  56  -6.304 -14.570  -4.011
  420    H    VAL  57           HN       VAL  57  -5.386 -10.120  -0.009
  421    HA   VAL  57           HA       VAL  57  -3.900  -9.428  -2.508
  422    HB   VAL  57           HB       VAL  57  -5.745  -7.790  -0.742
  423   1HG1  VAL  57          3HG13     VAL  57  -3.965  -6.377  -1.722
  424   2HG1  VAL  57          1HG11     VAL  57  -4.395  -6.949  -3.335
  425   3HG1  VAL  57          2HG12     VAL  57  -5.547  -6.000  -2.400
  426   1HG2  VAL  57          1HG21     VAL  57  -6.271  -8.890  -3.508
  427   2HG2  VAL  57          2HG22     VAL  57  -7.082  -9.345  -2.024
  428   3HG2  VAL  57          3HG23     VAL  57  -7.288  -7.710  -2.663
  429    H    ILE  58           HN       ILE  58  -1.984  -8.276  -2.223
  430    HA   ILE  58           HA       ILE  58  -0.956  -8.189   0.607
  431    HB   ILE  58           HB       ILE  58   0.513  -8.192  -2.056
  432   1HG1  ILE  58          1HG11     ILE  58   1.530 -10.231  -1.381
  433   2HG1  ILE  58          2HG12     ILE  58   0.693 -10.259   0.175
  434   1HG2  ILE  58          3HG23     ILE  58   1.573  -8.002   0.792
  435   2HG2  ILE  58          2HG22     ILE  58   2.568  -8.217  -0.659
  436   3HG2  ILE  58          1HG21     ILE  58   1.656  -6.725  -0.437
  437   1HD1  ILE  58          3HD13     ILE  58  -0.724 -10.401  -2.525
  438   2HD1  ILE  58          2HD12     ILE  58  -0.136 -11.831  -1.659
  439   3HD1  ILE  58          1HD11     ILE  58  -1.387 -10.836  -0.921
  440    H    PHE  59           HN       PHE  59  -0.666  -6.084   1.462
  441    HA   PHE  59           HA       PHE  59  -1.079  -3.839  -0.474
  442   1HB   PHE  59          1HB       PHE  59  -2.141  -4.151   2.306
  443   2HB   PHE  59          2HB       PHE  59  -2.200  -2.667   1.373
  444    HD1  PHE  59           HD2      PHE  59  -3.490  -6.168   1.604
  445    HD2  PHE  59           HD1      PHE  59  -3.757  -2.391  -0.437
  446    HE1  PHE  59           HE2      PHE  59  -5.860  -6.577   1.148
  447    HE2  PHE  59           HE1      PHE  59  -6.106  -2.882  -1.067
  448    HZ   PHE  59           HZ       PHE  59  -7.196  -4.924  -0.208
  449    H    LEU  60           HN       LEU  60   0.244  -2.168  -0.347
  450    HA   LEU  60           HA       LEU  60   2.309  -2.058   1.830
  451   1HB   LEU  60          1HB       LEU  60   2.491  -2.423  -1.115
  452   2HB   LEU  60          2HB       LEU  60   3.509  -1.124  -0.499
  453    HG   LEU  60           HG       LEU  60   3.623  -3.763   0.930
  454   1HD1  LEU  60          2HD12     LEU  60   4.939  -3.057  -1.725
  455   2HD1  LEU  60          1HD11     LEU  60   5.433  -4.412  -0.687
  456   3HD1  LEU  60          3HD13     LEU  60   3.808  -4.395  -1.405
  457   1HD2  LEU  60          1HD21     LEU  60   4.783  -1.641   1.719
  458   2HD2  LEU  60          2HD22     LEU  60   5.911  -2.955   1.325
  459   3HD2  LEU  60          3HD23     LEU  60   5.680  -1.617   0.185
  460    H    LYS  61           HN       LYS  61   2.332  -0.132   2.812
  461    HA   LYS  61           HA       LYS  61   1.318   2.304   1.325
  462   1HB   LYS  61          1HB       LYS  61   1.229   1.452   4.194
  463   2HB   LYS  61          2HB       LYS  61   1.260   3.185   3.793
  464   1HG   LYS  61          1HG       LYS  61  -0.723   3.025   2.552
  465   2HG   LYS  61          2HG       LYS  61  -0.678   1.250   2.520
  466   1HD   LYS  61          2HD       LYS  61  -1.057   2.867   5.068
  467   2HD   LYS  61          1HD       LYS  61  -2.400   2.260   4.093
  468   1HE   LYS  61          2HE       LYS  61  -0.292   0.510   5.459
  469   2HE   LYS  61          1HE       LYS  61  -1.943   0.773   5.986
  470   1HZ   LYS  61          2HZ       LYS  61  -2.693  -0.263   3.939
  471   2HZ   LYS  61          1HZ       LYS  61  -1.128  -0.503   3.477
  472   3HZ   LYS  61          3HZ       LYS  61  -1.704  -1.248   4.824
  473    H    VAL  62           HN       VAL  62   3.063   3.136   0.303
  474    HA   VAL  62           HA       VAL  62   5.713   3.047   1.694
  475    HB   VAL  62           HB       VAL  62   4.882   3.051  -1.216
  476   1HG1  VAL  62          3HG13     VAL  62   7.668   3.560  -0.082
  477   2HG1  VAL  62          2HG12     VAL  62   7.317   3.121  -1.766
  478   3HG1  VAL  62          1HG11     VAL  62   6.734   4.657  -1.126
  479   1HG2  VAL  62          2HG22     VAL  62   5.019   0.884   0.019
  480   2HG2  VAL  62          3HG23     VAL  62   6.290   1.024  -1.210
  481   3HG2  VAL  62          1HG21     VAL  62   6.685   1.269   0.499
  482    H    ASP  63           HN       ASP  63   6.394   4.854   2.569
  483    HA   ASP  63           HA       ASP  63   5.253   7.447   1.887
  484   1HB   ASP  63          1HB       ASP  63   6.056   7.151   4.132
  485   2HB   ASP  63          2HB       ASP  63   7.674   6.720   3.538
  486    H    VAL  64           HN       VAL  64   5.588   8.081  -0.149
  487    HA   VAL  64           HA       VAL  64   7.772   7.572  -1.866
  488    HB   VAL  64           HB       VAL  64   5.689   9.785  -1.702
  489   1HG1  VAL  64          2HG12     VAL  64   7.807   9.411  -3.845
  490   2HG1  VAL  64          1HG11     VAL  64   6.289  10.288  -4.107
  491   3HG1  VAL  64          3HG13     VAL  64   7.449  10.879  -2.913
  492   1HG2  VAL  64          2HG22     VAL  64   5.041   7.401  -2.239
  493   2HG2  VAL  64          1HG21     VAL  64   4.649   8.579  -3.511
  494   3HG2  VAL  64          3HG23     VAL  64   6.070   7.518  -3.679
  495    H    ASP  65           HN       ASP  65   7.278  10.182   0.521
  496    HA   ASP  65           HA       ASP  65   9.314  11.925  -0.309
  497   1HB   ASP  65          1HB       ASP  65   7.570  12.325   1.478
  498   2HB   ASP  65          2HB       ASP  65   8.556  11.372   2.594
  499    H    ALA  66           HN       ALA  66   9.500   9.255   2.097
  500    HA   ALA  66           HA       ALA  66  12.360   9.348   2.352
  501   1HB   ALA  66          3HB       ALA  66  10.315   7.182   2.968
  502   2HB   ALA  66          1HB       ALA  66  12.004   7.182   3.525
  503   3HB   ALA  66          2HB       ALA  66  10.886   8.445   4.087
  504    H    VAL  67           HN       VAL  67  10.193   6.928   0.707
  505    HA   VAL  67           HA       VAL  67  12.578   5.706  -0.545
  506    HB   VAL  67           HB       VAL  67   9.672   4.895  -0.895
  507   1HG1  VAL  67          2HG22     VAL  67  11.465   3.943  -2.447
  508   2HG1  VAL  67          1HG21     VAL  67  12.277   3.295  -1.024
  509   3HG1  VAL  67          3HG23     VAL  67  10.650   2.725  -1.453
  510   1HG2  VAL  67          3HG13     VAL  67  11.702   4.064   1.230
  511   2HG2  VAL  67          2HG12     VAL  67  10.122   4.825   1.518
  512   3HG2  VAL  67          1HG11     VAL  67  10.205   3.176   0.885
  513    H    ALA  68           HN       ALA  68  12.698   8.103  -1.383
  514    HA   ALA  68           HA       ALA  68  11.180   8.940  -3.612
  515   1HB   ALA  68          2HB       ALA  68  12.695  10.405  -2.339
  516   2HB   ALA  68          1HB       ALA  68  14.105   9.496  -2.930
  517   3HB   ALA  68          3HB       ALA  68  13.103  10.425  -4.068
  518    H    ALA  69           HN       ALA  69  14.153   6.956  -3.448
  519    HA   ALA  69           HA       ALA  69  14.808   6.795  -6.143
  520   1HB   ALA  69          3HB       ALA  69  15.019   4.614  -4.013
  521   2HB   ALA  69          1HB       ALA  69  15.902   4.651  -5.554
  522   3HB   ALA  69          2HB       ALA  69  16.203   5.899  -4.330
  523    H    VAL  70           HN       VAL  70  12.686   4.445  -4.382
  524    HA   VAL  70           HA       VAL  70  12.063   2.947  -6.747
  525    HB   VAL  70           HB       VAL  70  10.370   3.205  -4.227
  526   1HG1  VAL  70          2HG12     VAL  70   9.233   2.164  -6.236
  527   2HG1  VAL  70          1HG11     VAL  70  10.517   0.951  -6.272
  528   3HG1  VAL  70          3HG13     VAL  70   9.443   1.081  -4.859
  529   1HG2  VAL  70          2HG22     VAL  70  12.689   2.394  -3.693
  530   2HG2  VAL  70          3HG23     VAL  70  11.468   1.117  -3.511
  531   3HG2  VAL  70          1HG21     VAL  70  12.511   1.151  -4.951
  532    H    ALA  71           HN       ALA  71  10.352   5.601  -5.008
  533    HA   ALA  71           HA       ALA  71   8.058   5.740  -6.622
  534   1HB   ALA  71          1HB       ALA  71   8.419   7.049  -4.554
  535   2HB   ALA  71          2HB       ALA  71   9.591   8.081  -5.399
  536   3HB   ALA  71          3HB       ALA  71   7.892   8.077  -5.903
  537    H    GLU  72           HN       GLU  72  11.223   7.385  -7.152
  538    HA   GLU  72           HA       GLU  72  10.599   8.610  -9.598
  539   1HB   GLU  72          2HB       GLU  72  12.903   8.323  -7.911
  540   2HB   GLU  72          1HB       GLU  72  13.402   7.693  -9.478
  541   1HG   GLU  72          1HG       GLU  72  12.589   9.740 -10.564
  542   2HG   GLU  72          2HG       GLU  72  12.047  10.350  -8.971
  543    H    ALA  73           HN       ALA  73  12.336   5.502  -9.030
  544    HA   ALA  73           HA       ALA  73  12.649   4.824 -11.729
  545   1HB   ALA  73          2HB       ALA  73  13.801   3.693  -9.846
  546   2HB   ALA  73          3HB       ALA  73  12.264   2.965  -9.328
  547   3HB   ALA  73          1HB       ALA  73  12.984   2.510 -10.888
  548    H    ALA  74           HN       ALA  74   9.927   4.138  -9.550
  549    HA   ALA  74           HA       ALA  74   8.412   2.573 -11.487
  550   1HB   ALA  74          2HB       ALA  74   7.801   3.659  -8.724
  551   2HB   ALA  74          1HB       ALA  74   6.712   2.624  -9.671
  552   3HB   ALA  74          3HB       ALA  74   8.296   2.025  -9.169
  553    H    GLY  75           HN       GLY  75   9.030   5.918 -11.342
  554   1HA   GLY  75          1HA       GLY  75   8.104   7.666 -12.441
  555   2HA   GLY  75          2HA       GLY  75   7.120   6.494 -13.337
  556    H    ILE  76           HN       ILE  76   7.166   7.372  -9.838
  557    HA   ILE  76           HA       ILE  76   4.243   7.575  -9.796
  558    HB   ILE  76           HB       ILE  76   6.485   7.884  -7.792
  559   1HG1  ILE  76          2HG12     ILE  76   5.474   6.069  -6.701
  560   2HG1  ILE  76          1HG11     ILE  76   3.932   6.250  -7.549
  561   1HG2  ILE  76          2HG22     ILE  76   3.596   8.731  -7.363
  562   2HG2  ILE  76          1HG21     ILE  76   4.716   8.330  -6.045
  563   3HG2  ILE  76          3HG23     ILE  76   5.065   9.693  -7.103
  564   1HD1  ILE  76          1HD11     ILE  76   6.504   5.371  -8.867
  565   2HD1  ILE  76          2HD12     ILE  76   5.252   4.268  -8.273
  566   3HD1  ILE  76          3HD13     ILE  76   4.884   5.364  -9.603
  567    H    THR  77           HN       THR  77   3.188   9.355 -10.567
  568    HA   THR  77           HA       THR  77   4.618  11.937 -10.788
  569    HB   THR  77           HB       THR  77   2.613  12.420 -12.256
  570    HG1  THR  77           HG1      THR  77   1.484  10.420 -12.862
  571   1HG2  THR  77          1HG21     THR  77   4.771  11.590 -13.189
  572   2HG2  THR  77          3HG23     THR  77   4.210   9.918 -12.990
  573   3HG2  THR  77          2HG22     THR  77   3.378  11.006 -14.115
  574    H    ALA  78           HN       ALA  78   1.175  11.342 -10.360
  575    HA   ALA  78           HA       ALA  78   1.028  13.547  -8.370
  576   1HB   ALA  78          2HB       ALA  78  -1.116  12.018  -9.886
  577   2HB   ALA  78          1HB       ALA  78  -1.403  13.368  -8.767
  578   3HB   ALA  78          3HB       ALA  78  -0.485  13.632 -10.264
  579    H    MET  79           HN       MET  79   1.619  12.788  -6.365
  580    HA   MET  79           HA       MET  79   0.845  10.177  -5.402
  581   1HB   MET  79          2HB       MET  79   1.705  12.502  -3.651
  582   2HB   MET  79          1HB       MET  79   1.830  10.768  -3.350
  583   1HG   MET  79          1HG       MET  79   3.988  11.162  -3.945
  584   2HG   MET  79          2HG       MET  79   3.350  10.861  -5.562
  585   1HE   MET  79          3HE       MET  79   5.130  12.049  -6.929
  586   2HE   MET  79          2HE       MET  79   5.822  13.636  -6.545
  587   3HE   MET  79          1HE       MET  79   6.113  12.260  -5.458
  588    HA   PRO  80           HA       PRO  80  -0.106   9.132  -3.466
  589   1HB   PRO  80          2HB       PRO  80  -3.008   8.329  -3.508
  590   2HB   PRO  80          1HB       PRO  80  -1.748   7.911  -2.312
  591   1HG   PRO  80          2HG       PRO  80  -3.537   9.788  -1.680
  592   2HG   PRO  80          1HG       PRO  80  -1.811  10.108  -1.384
  593   1HD   PRO  80          1HD       PRO  80  -3.425  10.987  -3.814
  594   2HD   PRO  80          2HD       PRO  80  -2.435  11.998  -2.723
  595    H    THR  81           HN       THR  81   0.430   7.428  -4.792
  596    HA   THR  81           HA       THR  81  -1.062   7.064  -7.366
  597    HB   THR  81           HB       THR  81   1.904   7.118  -6.789
  598    HG1  THR  81           HG1      THR  81   0.345   9.001  -7.566
  599   1HG2  THR  81          2HG22     THR  81   0.410   6.089  -9.246
  600   2HG2  THR  81          3HG23     THR  81   2.121   6.554  -9.261
  601   3HG2  THR  81          1HG21     THR  81   1.591   5.215  -8.236
  602    H    PHE  82           HN       PHE  82  -2.191   5.243  -7.146
  603    HA   PHE  82           HA       PHE  82  -1.226   3.029  -5.462
  604   1HB   PHE  82          2HB       PHE  82  -3.749   3.471  -7.088
  605   2HB   PHE  82          1HB       PHE  82  -3.403   2.019  -6.160
  606    HD1  PHE  82           HD2      PHE  82  -3.274   2.073  -3.687
  607    HD2  PHE  82           HD1      PHE  82  -4.363   5.593  -5.950
  608    HE1  PHE  82           HE2      PHE  82  -3.903   3.249  -1.600
  609    HE2  PHE  82           HE1      PHE  82  -4.955   6.750  -3.847
  610    HZ   PHE  82           HZ       PHE  82  -4.573   5.599  -1.648
  611    H    HIS  83           HN       HIS  83  -0.195   1.306  -6.292
  612    HA   HIS  83           HA       HIS  83  -0.059   0.849  -9.253
  613   1HB   HIS  83          1HB       HIS  83   1.989   1.221  -7.122
  614   2HB   HIS  83          2HB       HIS  83   2.242  -0.169  -8.157
  615    HD2  HIS  83           HD2      HIS  83   0.930   3.318  -9.481
  616    HE1  HIS  83           HE1      HIS  83   4.818   2.696 -10.976
  617    HE2  HIS  83           HE2      HIS  83   2.808   4.228 -11.071
  618    H    VAL  84           HN       VAL  84  -0.517  -1.284  -9.841
  619    HA   VAL  84           HA       VAL  84  -0.906  -3.244  -7.597
  620    HB   VAL  84           HB       VAL  84  -2.236  -3.300 -10.328
  621   1HG1  VAL  84          3HG23     VAL  84  -2.763  -4.688  -7.657
  622   2HG1  VAL  84          2HG22     VAL  84  -3.746  -4.865  -9.122
  623   3HG1  VAL  84          1HG21     VAL  84  -2.074  -5.452  -9.099
  624   1HG2  VAL  84          2HG12     VAL  84  -3.313  -2.164  -7.716
  625   2HG2  VAL  84          3HG13     VAL  84  -3.039  -1.267  -9.229
  626   3HG2  VAL  84          1HG11     VAL  84  -4.281  -2.520  -9.164
  627    H    TYR  85           HN       TYR  85   1.201  -4.127  -7.533
  628    HA   TYR  85           HA       TYR  85   2.368  -5.095 -10.090
  629   1HB   TYR  85          2HB       TYR  85   3.449  -5.200  -7.277
  630   2HB   TYR  85          1HB       TYR  85   4.214  -5.930  -8.668
  631    HD1  TYR  85           HD1      TYR  85   3.150  -2.698  -7.172
  632    HD2  TYR  85           HD2      TYR  85   5.729  -4.671  -9.995
  633    HE1  TYR  85           HE1      TYR  85   4.333  -0.554  -7.621
  634    HE2  TYR  85           HE2      TYR  85   6.795  -2.493 -10.541
  635    HH   TYR  85           HH       TYR  85   5.268   0.526  -9.511
  636    H    LYS  86           HN       LYS  86   0.293  -6.377 -10.352
  637    HA   LYS  86           HA       LYS  86  -0.294  -8.502  -8.548
  638   1HB   LYS  86          1HB       LYS  86  -1.844  -7.668 -10.320
  639   2HB   LYS  86          2HB       LYS  86  -0.828  -8.467 -11.545
  640   1HG   LYS  86          2HG       LYS  86  -1.407 -10.644 -10.745
  641   2HG   LYS  86          1HG       LYS  86  -1.924 -10.024  -9.182
  642   1HD   LYS  86          1HD       LYS  86  -3.837 -10.751 -10.368
  643   2HD   LYS  86          2HD       LYS  86  -3.937  -9.005 -10.166
  644   1HE   LYS  86          2HE       LYS  86  -2.926 -10.337 -12.729
  645   2HE   LYS  86          1HE       LYS  86  -4.633  -9.975 -12.430
  646   1HZ   LYS  86          2HZ       LYS  86  -4.095  -7.675 -12.209
  647   2HZ   LYS  86          3HZ       LYS  86  -2.500  -7.974 -12.494
  648   3HZ   LYS  86          1HZ       LYS  86  -3.611  -8.256 -13.672
  649    H    ASP  87           HN       ASP  87   0.568 -10.408  -8.211
  650    HA   ASP  87           HA       ASP  87   1.894 -12.222  -8.222
  651   1HB   ASP  87          2HB       ASP  87   1.547 -12.618 -10.650
  652   2HB   ASP  87          1HB       ASP  87   2.784 -11.441 -11.065
  653    H    GLY  88           HN       GLY  88   3.539  -9.777 -10.073
  654   1HA   GLY  88          1HA       GLY  88   4.951  -8.441  -8.041
  655   2HA   GLY  88          2HA       GLY  88   6.040  -9.690  -8.685
  656    H    VAL  89           HN       VAL  89   3.544  -8.162 -10.760
  657    HA   VAL  89           HA       VAL  89   5.633  -6.530 -12.119
  658    HB   VAL  89           HB       VAL  89   3.658  -8.424 -13.466
  659   1HG1  VAL  89          2HG22     VAL  89   5.919  -6.707 -14.587
  660   2HG1  VAL  89          1HG21     VAL  89   4.928  -7.851 -15.515
  661   3HG1  VAL  89          3HG23     VAL  89   4.180  -6.414 -14.811
  662   1HG2  VAL  89          2HG12     VAL  89   6.667  -8.708 -13.075
  663   2HG2  VAL  89          3HG13     VAL  89   5.401  -9.788 -12.441
  664   3HG2  VAL  89          1HG11     VAL  89   5.685  -9.695 -14.179
  665    H    LYS  90           HN       LYS  90   4.874  -4.521 -12.134
  666    HA   LYS  90           HA       LYS  90   2.492  -3.397 -11.492
  667   1HB   LYS  90          1HB       LYS  90   4.732  -2.326 -12.127
  668   2HB   LYS  90          2HB       LYS  90   4.197  -2.415 -13.799
  669   1HG   LYS  90          1HG       LYS  90   2.113  -1.077 -13.038
  670   2HG   LYS  90          2HG       LYS  90   2.878  -0.952 -11.459
  671   1HD   LYS  90          2HD       LYS  90   3.316   1.068 -12.682
  672   2HD   LYS  90          1HD       LYS  90   4.838   0.202 -12.462
  673   1HE   LYS  90          1HE       LYS  90   4.530   1.233 -14.730
  674   2HE   LYS  90          2HE       LYS  90   4.814  -0.509 -14.814
  675   1HZ   LYS  90          2HZ       LYS  90   2.161   0.755 -14.896
  676   2HZ   LYS  90          1HZ       LYS  90   3.010   0.266 -16.228
  677   3HZ   LYS  90          3HZ       LYS  90   2.498  -0.843 -15.124
  678    H    ALA  91           HN       ALA  91   0.700  -4.638 -12.166
  679    HA   ALA  91           HA       ALA  91   0.183  -5.140 -15.002
  680   1HB   ALA  91          2HB       ALA  91  -0.339  -6.801 -13.260
  681   2HB   ALA  91          3HB       ALA  91  -1.475  -5.663 -12.496
  682   3HB   ALA  91          1HB       ALA  91  -1.806  -6.292 -14.125
  683    H    ASP  92           HN       ASP  92  -0.904  -2.874 -12.511
  684    HA   ASP  92           HA       ASP  92  -2.267  -1.228 -14.479
  685   1HB   ASP  92          1HB       ASP  92  -3.914  -3.049 -13.852
  686   2HB   ASP  92          2HB       ASP  92  -3.842  -2.472 -12.173
  687    H    ASP  93           HN       ASP  93  -3.041   0.807 -13.344
  688    HA   ASP  93           HA       ASP  93  -1.715   1.413 -10.796
  689   1HB   ASP  93          1HB       ASP  93  -1.075   3.008 -13.313
  690   2HB   ASP  93          2HB       ASP  93  -0.473   3.328 -11.683
  691    H    LEU  94           HN       LEU  94  -2.345   3.635 -10.090
  692    HA   LEU  94           HA       LEU  94  -4.559   4.984 -11.454
  693   1HB   LEU  94          2HB       LEU  94  -5.817   3.215 -10.490
  694   2HB   LEU  94          1HB       LEU  94  -4.913   3.262  -8.978
  695    HG   LEU  94           HG       LEU  94  -5.959   5.466  -8.428
  696   1HD1  LEU  94          3HD13     LEU  94  -7.408   4.980 -11.068
  697   2HD1  LEU  94          1HD11     LEU  94  -7.870   6.209  -9.875
  698   3HD1  LEU  94          2HD12     LEU  94  -6.317   6.333 -10.694
  699   1HD2  LEU  94          1HD21     LEU  94  -7.897   3.241  -9.154
  700   2HD2  LEU  94          3HD23     LEU  94  -6.940   3.364  -7.663
  701   3HD2  LEU  94          2HD22     LEU  94  -8.191   4.565  -8.001
  702    H    VAL  95           HN       VAL  95  -4.003   7.102 -11.152
  703    HA   VAL  95           HA       VAL  95  -2.478   7.897  -8.760
  704    HB   VAL  95           HB       VAL  95  -2.247  10.034  -9.892
  705   1HG1  VAL  95          3HG23     VAL  95  -0.597   8.247 -10.278
  706   2HG1  VAL  95          2HG22     VAL  95  -1.514   7.689 -11.694
  707   3HG1  VAL  95          1HG21     VAL  95  -0.768   9.299 -11.692
  708   1HG2  VAL  95          2HG12     VAL  95  -4.370  10.102 -11.181
  709   2HG2  VAL  95          1HG11     VAL  95  -2.954  10.387 -12.198
  710   3HG2  VAL  95          3HG13     VAL  95  -3.763   8.813 -12.243
  711    H    GLY  96           HN       GLY  96  -3.133   9.623  -7.404
  712   1HA   GLY  96          1HA       GLY  96  -4.554  11.259  -6.552
  713   2HA   GLY  96          2HA       GLY  96  -5.851  10.747  -7.652
  714    H    ALA  97           HN       ALA  97  -6.585  11.260  -5.171
  715    HA   ALA  97           HA       ALA  97  -6.440   9.276  -3.187
  716   1HB   ALA  97          3HB       ALA  97  -7.386  11.584  -2.893
  717   2HB   ALA  97          1HB       ALA  97  -8.798  11.116  -3.859
  718   3HB   ALA  97          2HB       ALA  97  -8.490  10.325  -2.299
  719    H    SER  98           HN       SER  98  -8.518   9.606  -5.978
  720    HA   SER  98           HA       SER  98 -10.388   8.320  -6.741
  721   1HB   SER  98          2HB       SER  98  -7.753   6.864  -7.084
  722   2HB   SER  98          1HB       SER  98  -9.121   6.930  -8.220
  723    HG   SER  98           HG       SER  98  -7.261   8.500  -8.503
  724    H    GLN  99           HN       GLN  99 -10.993   7.742  -4.228
  725    HA   GLN  99           HA       GLN  99 -10.425   5.223  -3.179
  726   1HB   GLN  99          2HB       GLN  99 -12.928   6.956  -2.922
  727   2HB   GLN  99          1HB       GLN  99 -12.560   5.579  -1.876
  728   1HG   GLN  99          1HG       GLN  99 -10.763   8.043  -2.161
  729   2HG   GLN  99          2HG       GLN  99 -11.938   7.762  -0.879
  730   1HE2  GLN  99          2HE22     GLN  99  -8.318   5.998  -0.571
  731   2HE2  GLN  99          1HE21     GLN  99  -8.692   6.936  -2.017
  732    H    ASP 100           HN       ASP 100 -13.513   5.993  -4.916
  733    HA   ASP 100           HA       ASP 100 -14.535   3.411  -4.968
  734   1HB   ASP 100          2HB       ASP 100 -14.789   5.500  -7.183
  735   2HB   ASP 100          1HB       ASP 100 -15.908   4.173  -6.837
  736    H    LYS 101           HN       LYS 101 -12.376   4.988  -7.273
  737    HA   LYS 101           HA       LYS 101 -12.142   2.865  -9.180
  738   1HB   LYS 101          2HB       LYS 101 -10.471   5.268  -8.405
  739   2HB   LYS 101          1HB       LYS 101  -9.998   4.217  -9.734
  740   1HG   LYS 101          2HG       LYS 101 -12.161   4.640 -10.856
  741   2HG   LYS 101          1HG       LYS 101 -12.658   5.694  -9.519
  742   1HD   LYS 101          1HD       LYS 101 -10.773   7.233 -10.012
  743   2HD   LYS 101          2HD       LYS 101 -10.198   6.136 -11.279
  744   1HE   LYS 101          1HE       LYS 101 -11.410   7.995 -12.284
  745   2HE   LYS 101          2HE       LYS 101 -12.295   6.487 -12.558
  746   1HZ   LYS 101          2HZ       LYS 101 -12.897   8.471 -10.471
  747   2HZ   LYS 101          1HZ       LYS 101 -13.721   8.281 -11.885
  748   3HZ   LYS 101          3HZ       LYS 101 -13.744   7.085 -10.755
  749    H    LEU 102           HN       LEU 102 -10.238   3.732  -6.253
  750    HA   LEU 102           HA       LEU 102  -8.246   1.765  -6.398
  751   1HB   LEU 102          2HB       LEU 102  -8.762   3.748  -4.651
  752   2HB   LEU 102          1HB       LEU 102  -9.526   2.456  -3.740
  753    HG   LEU 102           HG       LEU 102  -6.628   2.781  -4.575
  754   1HD1  LEU 102          3HD13     LEU 102  -8.112   2.694  -1.901
  755   2HD1  LEU 102          2HD12     LEU 102  -6.362   2.826  -2.081
  756   3HD1  LEU 102          1HD11     LEU 102  -7.403   4.127  -2.676
  757   1HD2  LEU 102          1HD21     LEU 102  -7.911   0.392  -3.186
  758   2HD2  LEU 102          2HD22     LEU 102  -7.059   0.396  -4.751
  759   3HD2  LEU 102          3HD23     LEU 102  -6.165   0.722  -3.264
  760    H    LYS 103           HN       LYS 103 -11.444   1.643  -4.728
  761    HA   LYS 103           HA       LYS 103 -11.370  -1.042  -3.877
  762   1HB   LYS 103          2HB       LYS 103 -13.706   0.737  -4.718
  763   2HB   LYS 103          1HB       LYS 103 -13.875  -0.832  -3.931
  764   1HG   LYS 103          2HG       LYS 103 -12.695  -0.067  -1.960
  765   2HG   LYS 103          1HG       LYS 103 -12.324   1.492  -2.732
  766   1HD   LYS 103          2HD       LYS 103 -14.753   2.009  -2.854
  767   2HD   LYS 103          1HD       LYS 103 -15.124   0.440  -2.124
  768   1HE   LYS 103          2HE       LYS 103 -15.243   2.193  -0.427
  769   2HE   LYS 103          1HE       LYS 103 -13.902   1.097  -0.060
  770   1HZ   LYS 103          2HZ       LYS 103 -13.667   3.711  -1.385
  771   2HZ   LYS 103          1HZ       LYS 103 -13.304   3.399   0.192
  772   3HZ   LYS 103          3HZ       LYS 103 -12.412   2.712  -1.008
  773    H    ALA 104           HN       ALA 104 -12.724   0.328  -6.929
  774    HA   ALA 104           HA       ALA 104 -13.545  -2.098  -8.089
  775   1HB   ALA 104          2HB       ALA 104 -14.091   0.151  -8.977
  776   2HB   ALA 104          1HB       ALA 104 -12.408   0.355  -9.508
  777   3HB   ALA 104          3HB       ALA 104 -13.417  -0.912 -10.229
  778    H    LEU 105           HN       LEU 105 -10.298  -0.497  -8.283
  779    HA   LEU 105           HA       LEU 105  -9.164  -2.478  -9.995
  780   1HB   LEU 105          1HB       LEU 105  -7.805  -0.658  -7.963
  781   2HB   LEU 105          2HB       LEU 105  -6.980  -1.752  -9.064
  782    HG   LEU 105           HG       LEU 105  -8.418   0.810  -9.705
  783   1HD1  LEU 105          2HD12     LEU 105  -5.788  -0.472 -10.575
  784   2HD1  LEU 105          1HD11     LEU 105  -6.358   1.129 -11.055
  785   3HD1  LEU 105          3HD13     LEU 105  -5.986   0.800  -9.348
  786   1HD2  LEU 105          3HD23     LEU 105  -7.959  -1.436 -11.697
  787   2HD2  LEU 105          2HD22     LEU 105  -9.511  -0.660 -11.290
  788   3HD2  LEU 105          1HD21     LEU 105  -8.262   0.254 -12.138
  789    H    VAL 106           HN       VAL 106  -9.041  -2.227  -6.369
  790    HA   VAL 106           HA       VAL 106  -7.556  -4.636  -6.090
  791    HB   VAL 106           HB       VAL 106  -9.662  -3.601  -4.132
  792   1HG1  VAL 106          3HG23     VAL 106  -7.213  -5.408  -3.844
  793   2HG1  VAL 106          1HG21     VAL 106  -8.201  -4.828  -2.490
  794   3HG1  VAL 106          2HG22     VAL 106  -8.891  -5.935  -3.686
  795   1HG2  VAL 106          3HG13     VAL 106  -6.674  -3.007  -4.327
  796   2HG2  VAL 106          1HG11     VAL 106  -7.975  -1.843  -4.585
  797   3HG2  VAL 106          2HG12     VAL 106  -7.740  -2.533  -2.983
  798    H    ALA 107           HN       ALA 107 -11.068  -4.115  -6.178
  799    HA   ALA 107           HA       ALA 107 -11.935  -6.766  -5.836
  800   1HB   ALA 107          2HB       ALA 107 -13.449  -4.806  -5.892
  801   2HB   ALA 107          1HB       ALA 107 -13.179  -4.639  -7.637
  802   3HB   ALA 107          3HB       ALA 107 -13.983  -6.083  -7.000
  803    H    LYS 108           HN       LYS 108 -11.321  -5.182  -9.102
  804    HA   LYS 108           HA       LYS 108 -11.806  -7.649 -10.451
  805   1HB   LYS 108          1HB       LYS 108 -10.928  -6.590 -12.372
  806   2HB   LYS 108          2HB       LYS 108 -11.937  -5.418 -11.497
  807   1HG   LYS 108          1HG       LYS 108  -9.841  -4.389 -10.666
  808   2HG   LYS 108          2HG       LYS 108  -8.901  -5.505 -11.680
  809   1HD   LYS 108          1HD       LYS 108  -9.058  -3.338 -12.712
  810   2HD   LYS 108          2HD       LYS 108  -9.805  -4.589 -13.707
  811   1HE   LYS 108          1HE       LYS 108 -12.037  -3.824 -13.115
  812   2HE   LYS 108          2HE       LYS 108 -11.410  -2.824 -11.790
  813   1HZ   LYS 108          3HZ       LYS 108 -10.925  -2.386 -14.655
  814   2HZ   LYS 108          2HZ       LYS 108 -11.968  -1.531 -13.708
  815   3HZ   LYS 108          1HZ       LYS 108 -10.346  -1.447 -13.430
  816    H    HIS 109           HN       HIS 109  -8.736  -6.099  -9.514
  817    HA   HIS 109           HA       HIS 109  -7.103  -8.112 -10.715
  818   1HB   HIS 109          2HB       HIS 109  -6.556  -6.011  -8.583
  819   2HB   HIS 109          1HB       HIS 109  -5.338  -7.113  -9.223
  820    HD2  HIS 109           HD2      HIS 109  -7.215  -3.905 -10.419
  821    HE1  HIS 109           HE1      HIS 109  -4.811  -5.263 -13.588
  822    HE2  HIS 109           HE2      HIS 109  -6.227  -3.316 -12.747
  823    H    ALA 110           HN       ALA 110  -8.609  -7.955  -7.461
  824    HA   ALA 110           HA       ALA 110  -7.215 -10.361  -6.540
  825   1HB   ALA 110          1HB       ALA 110  -8.021  -8.522  -5.025
  826   2HB   ALA 110          2HB       ALA 110  -9.689  -8.965  -5.434
  827   3HB   ALA 110          3HB       ALA 110  -8.643 -10.127  -4.591
  828    H    ALA 111           HN       ALA 111  -8.259 -10.955  -9.021
  829    HA   ALA 111           HA       ALA 111 -10.864 -12.101  -9.015
  830   1HB   ALA 111          2HB       ALA 111  -9.595 -11.559 -11.069
  831   2HB   ALA 111          1HB       ALA 111  -8.403 -12.819 -10.671
  832   3HB   ALA 111          3HB       ALA 111 -10.080 -13.266 -11.052
  833    H    ALA 112           HN       ALA 112  -7.774 -13.318  -7.781
  834    HA   ALA 112           HA       ALA 112  -8.921 -15.516  -6.435
  835   1HB   ALA 112          2HB       ALA 112  -7.061 -16.097  -8.798
  836   2HB   ALA 112          1HB       ALA 112  -7.548 -17.267  -7.553
  837   3HB   ALA 112          3HB       ALA 112  -8.760 -16.611  -8.671
   
  No H/Q in entry =         837
  Start of MODEL   13
    1   1H    GLY   1          2HN       GLY   1  -5.215  -6.829   5.755
    2   2H    GLY   1          1HN       GLY   1  -5.873  -7.746   4.500
    3   3H    GLY   1          3HN       GLY   1  -6.659  -7.572   5.917
    4   1HA   GLY   1          1HA       GLY   1  -5.626  -9.414   6.682
    5   2HA   GLY   1          2HA       GLY   1  -4.705  -9.462   5.155
    6    H    GLY   2           HN       GLY   2  -3.095 -10.292   7.008
    7   1HA   GLY   2          1HA       GLY   2  -1.909  -8.479   8.812
    8   2HA   GLY   2          2HA       GLY   2  -1.115  -9.891   8.088
    9    H    SER   3           HN       SER   3  -1.030  -9.248   5.408
   10    HA   SER   3           HA       SER   3   1.183  -7.528   5.208
   11   1HB   SER   3          1HB       SER   3  -0.614  -8.544   2.972
   12   2HB   SER   3          2HB       SER   3   1.137  -8.252   2.923
   13    HG   SER   3           HG       SER   3   1.356  -9.985   4.421
   14    H    VAL   4           HN       VAL   4  -0.673  -5.748   6.312
   15    HA   VAL   4           HA       VAL   4  -0.797  -3.730   4.198
   16    HB   VAL   4           HB       VAL   4  -3.103  -4.301   6.109
   17   1HG1  VAL   4          3HG23     VAL   4  -2.357  -2.076   4.306
   18   2HG1  VAL   4          1HG21     VAL   4  -4.039  -2.596   4.159
   19   3HG1  VAL   4          2HG22     VAL   4  -3.376  -2.116   5.744
   20   1HG2  VAL   4          3HG13     VAL   4  -2.939  -5.136   3.208
   21   2HG2  VAL   4          2HG12     VAL   4  -3.408  -6.076   4.608
   22   3HG2  VAL   4          1HG11     VAL   4  -4.477  -4.821   4.006
   23    H    ILE   5           HN       ILE   5   0.980  -2.687   5.164
   24    HA   ILE   5           HA       ILE   5   0.441  -1.401   7.757
   25    HB   ILE   5           HB       ILE   5   2.779  -2.006   8.531
   26   1HG1  ILE   5          1HG11     ILE   5   2.532  -4.224   6.440
   27   2HG1  ILE   5          2HG12     ILE   5   3.606  -2.828   6.319
   28   1HG2  ILE   5          1HG21     ILE   5   0.638  -3.049   9.404
   29   2HG2  ILE   5          3HG23     ILE   5   0.926  -4.418   8.309
   30   3HG2  ILE   5          2HG22     ILE   5   2.079  -4.043   9.600
   31   1HD1  ILE   5          2HD12     ILE   5   4.744  -3.555   8.430
   32   2HD1  ILE   5          1HD11     ILE   5   3.746  -5.030   8.413
   33   3HD1  ILE   5          3HD13     ILE   5   4.880  -4.719   7.095
   34    H    VAL   6           HN       VAL   6   1.630   0.445   8.095
   35    HA   VAL   6           HA       VAL   6   2.341   1.893   5.669
   36    HB   VAL   6           HB       VAL   6   2.426   2.816   8.573
   37   1HG1  VAL   6          1HG21     VAL   6   3.427   4.363   6.770
   38   2HG1  VAL   6          3HG23     VAL   6   1.793   4.444   6.082
   39   3HG1  VAL   6          2HG22     VAL   6   2.096   5.032   7.720
   40   1HG2  VAL   6          1HG11     VAL   6   0.068   2.736   6.651
   41   2HG2  VAL   6          3HG13     VAL   6   0.182   1.938   8.237
   42   3HG2  VAL   6          2HG12     VAL   6   0.106   3.696   8.143
   43    H    ILE   7           HN       ILE   7   4.150  -0.024   5.635
   44    HA   ILE   7           HA       ILE   7   6.537   0.839   7.197
   45    HB   ILE   7           HB       ILE   7   5.787  -1.468   7.361
   46   1HG1  ILE   7          2HG12     ILE   7   8.564  -1.102   6.142
   47   2HG1  ILE   7          1HG11     ILE   7   8.105  -0.595   7.759
   48   1HG2  ILE   7          1HG21     ILE   7   5.101  -1.748   4.900
   49   2HG2  ILE   7          3HG23     ILE   7   6.813  -1.950   4.524
   50   3HG2  ILE   7          2HG22     ILE   7   6.018  -3.076   5.617
   51   1HD1  ILE   7          3HD13     ILE   7   7.903  -3.497   6.897
   52   2HD1  ILE   7          1HD11     ILE   7   9.200  -2.771   7.867
   53   3HD1  ILE   7          2HD12     ILE   7   7.540  -2.812   8.486
   54    H    ASP   8           HN       ASP   8   6.910   2.685   6.145
   55    HA   ASP   8           HA       ASP   8   7.487   2.888   3.287
   56   1HB   ASP   8          1HB       ASP   8   7.680   4.809   5.655
   57   2HB   ASP   8          2HB       ASP   8   8.262   5.219   4.035
   58    H    SER   9           HN       SER   9   8.945   0.987   3.658
   59    HA   SER   9           HA       SER   9  11.736   2.058   3.745
   60   1HB   SER   9          1HB       SER   9  10.844  -0.436   5.229
   61   2HB   SER   9          2HB       SER   9  12.492   0.218   5.135
   62    HG   SER   9           HG       SER   9  11.045   2.233   5.915
   63    H    LYS  10           HN       LYS  10  12.760   1.529   1.900
   64    HA   LYS  10           HA       LYS  10  11.784   0.001  -0.177
   65   1HB   LYS  10          1HB       LYS  10  13.751   1.575  -0.200
   66   2HB   LYS  10          2HB       LYS  10  14.730   0.319   0.564
   67   1HG   LYS  10          2HG       LYS  10  14.340  -1.180  -1.367
   68   2HG   LYS  10          1HG       LYS  10  13.281   0.032  -2.109
   69   1HD   LYS  10          1HD       LYS  10  15.206   1.644  -2.143
   70   2HD   LYS  10          2HD       LYS  10  16.256   0.376  -1.499
   71   1HE   LYS  10          1HE       LYS  10  14.733   0.274  -4.154
   72   2HE   LYS  10          2HE       LYS  10  16.460   0.615  -3.964
   73   1HZ   LYS  10          2HZ       LYS  10  16.727  -1.568  -3.021
   74   2HZ   LYS  10          3HZ       LYS  10  15.127  -1.897  -3.235
   75   3HZ   LYS  10          1HZ       LYS  10  16.097  -1.648  -4.541
   76    H    ALA  11           HN       ALA  11  13.903  -1.028   2.470
   77    HA   ALA  11           HA       ALA  11  14.409  -3.701   1.666
   78   1HB   ALA  11          3HB       ALA  11  15.601  -2.581   3.516
   79   2HB   ALA  11          1HB       ALA  11  14.110  -2.564   4.487
   80   3HB   ALA  11          2HB       ALA  11  14.878  -4.108   4.060
   81    H    ALA  12           HN       ALA  12  11.654  -2.273   3.434
   82    HA   ALA  12           HA       ALA  12  10.404  -4.814   4.083
   83   1HB   ALA  12          1HB       ALA  12  10.031  -2.768   5.423
   84   2HB   ALA  12          2HB       ALA  12   9.228  -1.995   4.035
   85   3HB   ALA  12          3HB       ALA  12   8.529  -3.448   4.758
   86    H    TRP  13           HN       TRP  13   9.972  -2.245   1.617
   87    HA   TRP  13           HA       TRP  13   7.787  -3.314   0.189
   88   1HB   TRP  13          2HB       TRP  13   8.312  -1.315  -0.721
   89   2HB   TRP  13          1HB       TRP  13  10.007  -1.443  -0.338
   90    HD1  TRP  13           HD1      TRP  13  11.646  -2.561  -2.150
   91    HE1  TRP  13           HE1      TRP  13  11.533  -2.641  -4.701
   92    HE3  TRP  13           HE3      TRP  13   6.674  -1.486  -2.802
   93    HZ2  TRP  13           HZ2      TRP  13   9.633  -2.166  -6.743
   94    HZ3  TRP  13           HZ3      TRP  13   5.812  -1.114  -5.103
   95    HH2  TRP  13           HH2      TRP  13   7.252  -1.505  -7.066
   96    H    ASP  14           HN       ASP  14  11.275  -3.937  -0.316
   97    HA   ASP  14           HA       ASP  14  10.983  -5.906  -2.329
   98   1HB   ASP  14          1HB       ASP  14  13.047  -4.688  -1.775
   99   2HB   ASP  14          2HB       ASP  14  13.213  -5.570  -0.262
  100    H    ALA  15           HN       ALA  15  11.719  -6.359   1.107
  101    HA   ALA  15           HA       ALA  15  11.680  -9.157   1.169
  102   1HB   ALA  15          2HB       ALA  15  12.496  -7.730   3.015
  103   2HB   ALA  15          1HB       ALA  15  10.829  -7.239   3.386
  104   3HB   ALA  15          3HB       ALA  15  11.333  -8.929   3.601
  105    H    GLN  16           HN       GLN  16   8.967  -6.947   1.816
  106    HA   GLN  16           HA       GLN  16   7.042  -8.983   2.377
  107   1HB   GLN  16          1HB       GLN  16   6.936  -6.624   3.094
  108   2HB   GLN  16          2HB       GLN  16   6.514  -6.150   1.430
  109   1HG   GLN  16          2HG       GLN  16   4.484  -7.547   1.552
  110   2HG   GLN  16          1HG       GLN  16   4.976  -8.188   3.122
  111   1HE2  GLN  16          1HE21     GLN  16   4.299  -4.322   3.913
  112   2HE2  GLN  16          2HE22     GLN  16   5.770  -4.878   3.133
  113    H    LEU  17           HN       LEU  17   7.765  -7.055  -0.599
  114    HA   LEU  17           HA       LEU  17   5.888  -8.146  -2.356
  115   1HB   LEU  17          1HB       LEU  17   7.229  -6.264  -2.981
  116   2HB   LEU  17          2HB       LEU  17   8.741  -7.138  -2.711
  117    HG   LEU  17           HG       LEU  17   8.379  -8.527  -4.657
  118   1HD1  LEU  17          2HD12     LEU  17   5.877  -6.838  -5.113
  119   2HD1  LEU  17          3HD13     LEU  17   6.562  -7.997  -6.266
  120   3HD1  LEU  17          1HD11     LEU  17   5.898  -8.575  -4.732
  121   1HD2  LEU  17          1HD21     LEU  17   9.587  -6.395  -4.852
  122   2HD2  LEU  17          2HD22     LEU  17   8.699  -6.764  -6.342
  123   3HD2  LEU  17          3HD23     LEU  17   8.067  -5.549  -5.210
  124    H    ALA  18           HN       ALA  18   9.207  -9.323  -1.679
  125    HA   ALA  18           HA       ALA  18   9.102 -11.606  -3.328
  126   1HB   ALA  18          1HB       ALA  18  11.162 -10.639  -2.418
  127   2HB   ALA  18          3HB       ALA  18  10.689 -11.100  -0.770
  128   3HB   ALA  18          2HB       ALA  18  11.033 -12.357  -1.981
  129    H    LYS  19           HN       LYS  19   8.657 -11.539   0.313
  130    HA   LYS  19           HA       LYS  19   7.992 -14.319   0.373
  131   1HB   LYS  19          2HB       LYS  19   7.294 -14.008   2.625
  132   2HB   LYS  19          1HB       LYS  19   8.729 -13.013   2.337
  133   1HG   LYS  19          2HG       LYS  19   7.291 -11.039   2.147
  134   2HG   LYS  19          1HG       LYS  19   5.834 -12.000   2.342
  135   1HD   LYS  19          1HD       LYS  19   6.368 -10.896   4.444
  136   2HD   LYS  19          2HD       LYS  19   6.427 -12.653   4.597
  137   1HE   LYS  19          1HE       LYS  19   8.272 -11.536   5.814
  138   2HE   LYS  19          2HE       LYS  19   8.877 -12.635   4.573
  139   1HZ   LYS  19          3HZ       LYS  19   8.636  -9.716   4.320
  140   2HZ   LYS  19          2HZ       LYS  19  10.032 -10.561   4.556
  141   3HZ   LYS  19          1HZ       LYS  19   9.193 -10.729   3.145
  142    H    GLY  20           HN       GLY  20   6.020 -11.514  -0.442
  143   1HA   GLY  20          1HA       GLY  20   3.443 -12.564  -0.087
  144   2HA   GLY  20          2HA       GLY  20   3.941 -11.375  -1.306
  145    H    LYS  21           HN       LYS  21   5.906 -13.498  -2.480
  146    HA   LYS  21           HA       LYS  21   5.861 -14.885  -4.291
  147   1HB   LYS  21          2HB       LYS  21   3.498 -16.148  -2.828
  148   2HB   LYS  21          1HB       LYS  21   4.410 -16.885  -4.153
  149   1HG   LYS  21          1HG       LYS  21   6.462 -16.897  -2.822
  150   2HG   LYS  21          2HG       LYS  21   5.667 -15.986  -1.541
  151   1HD   LYS  21          2HD       LYS  21   3.998 -17.929  -1.329
  152   2HD   LYS  21          1HD       LYS  21   5.080 -18.839  -2.395
  153   1HE   LYS  21          1HE       LYS  21   5.659 -19.399  -0.116
  154   2HE   LYS  21          2HE       LYS  21   6.961 -18.369  -0.737
  155   1HZ   LYS  21          1HZ       LYS  21   5.873 -16.509   0.404
  156   2HZ   LYS  21          2HZ       LYS  21   4.724 -17.528   0.982
  157   3HZ   LYS  21          3HZ       LYS  21   6.292 -17.714   1.448
  158    H    GLU  22           HN       GLU  22   5.171 -12.739  -5.032
  159    HA   GLU  22           HA       GLU  22   2.608 -11.899  -5.763
  160   1HB   GLU  22          1HB       GLU  22   3.867 -10.155  -6.947
  161   2HB   GLU  22          2HB       GLU  22   4.563 -10.450  -5.358
  162   1HG   GLU  22          1HG       GLU  22   5.760 -11.928  -7.720
  163   2HG   GLU  22          2HG       GLU  22   6.036 -10.202  -7.570
  164    H    GLU  23           HN       GLU  23   2.826 -14.559  -6.928
  165    HA   GLU  23           HA       GLU  23   3.299 -14.481  -9.733
  166   1HB   GLU  23          1HB       GLU  23   1.395 -16.228  -8.089
  167   2HB   GLU  23          2HB       GLU  23   1.873 -16.527  -9.767
  168   1HG   GLU  23          1HG       GLU  23   4.206 -16.819  -9.088
  169   2HG   GLU  23          2HG       GLU  23   3.829 -16.379  -7.416
  170    H    HIS  24           HN       HIS  24  -0.008 -14.837  -8.336
  171    HA   HIS  24           HA       HIS  24  -0.980 -12.728 -10.198
  172   1HB   HIS  24          1HB       HIS  24  -3.041 -13.974 -10.284
  173   2HB   HIS  24          2HB       HIS  24  -1.763 -15.169 -10.528
  174    HD2  HIS  24           HD2      HIS  24  -4.622 -14.288  -8.067
  175    HE1  HIS  24           HE1      HIS  24  -2.470 -17.473  -6.316
  176    HE2  HIS  24           HE2      HIS  24  -4.627 -16.067  -6.177
  177    H    LYS  25           HN       LYS  25   0.073 -12.702  -7.322
  178    HA   LYS  25           HA       LYS  25  -2.321 -12.219  -5.748
  179   1HB   LYS  25          1HB       LYS  25   0.410 -11.393  -4.814
  180   2HB   LYS  25          2HB       LYS  25  -0.978 -11.868  -3.865
  181   1HG   LYS  25          2HG       LYS  25   0.700 -13.727  -5.603
  182   2HG   LYS  25          1HG       LYS  25   0.764 -13.586  -3.846
  183   1HD   LYS  25          1HD       LYS  25  -1.629 -14.262  -3.713
  184   2HD   LYS  25          2HD       LYS  25  -1.648 -14.539  -5.464
  185   1HE   LYS  25          1HE       LYS  25   0.151 -15.926  -3.422
  186   2HE   LYS  25          2HE       LYS  25  -1.282 -16.638  -4.182
  187   1HZ   LYS  25          2HZ       LYS  25  -0.154 -16.367  -6.311
  188   2HZ   LYS  25          3HZ       LYS  25   1.196 -15.813  -5.527
  189   3HZ   LYS  25          1HZ       LYS  25   0.681 -17.354  -5.288
  190    HA   PRO  26           HA       PRO  26  -2.325  -7.789  -6.726
  191   1HB   PRO  26          1HB       PRO  26  -4.117  -6.889  -4.875
  192   2HB   PRO  26          2HB       PRO  26  -4.605  -7.881  -6.276
  193   1HG   PRO  26          1HG       PRO  26  -3.861  -8.925  -3.543
  194   2HG   PRO  26          2HG       PRO  26  -5.441  -9.158  -4.363
  195   1HD   PRO  26          1HD       PRO  26  -3.499 -10.990  -4.437
  196   2HD   PRO  26          2HD       PRO  26  -4.270 -10.572  -5.996
  197    H    ILE  27           HN       ILE  27  -0.108  -7.366  -6.215
  198    HA   ILE  27           HA       ILE  27   0.442  -6.455  -3.449
  199    HB   ILE  27           HB       ILE  27   2.146  -6.548  -5.969
  200   1HG1  ILE  27          2HG12     ILE  27   3.621  -7.974  -4.663
  201   2HG1  ILE  27          1HG11     ILE  27   2.599  -7.834  -3.234
  202   1HG2  ILE  27          3HG23     ILE  27   2.762  -5.363  -3.238
  203   2HG2  ILE  27          1HG21     ILE  27   3.987  -5.689  -4.477
  204   3HG2  ILE  27          2HG22     ILE  27   2.748  -4.485  -4.782
  205   1HD1  ILE  27          2HD12     ILE  27   1.797  -9.146  -5.861
  206   2HD1  ILE  27          3HD13     ILE  27   2.388  -9.993  -4.415
  207   3HD1  ILE  27          1HD11     ILE  27   0.846  -9.138  -4.347
  208    H    VAL  28           HN       VAL  28  -0.907  -4.708  -3.144
  209    HA   VAL  28           HA       VAL  28  -1.326  -2.746  -5.331
  210    HB   VAL  28           HB       VAL  28  -2.683  -2.773  -2.613
  211   1HG1  VAL  28          2HG12     VAL  28  -2.763  -0.683  -4.018
  212   2HG1  VAL  28          1HG11     VAL  28  -3.468  -1.628  -5.340
  213   3HG1  VAL  28          3HG13     VAL  28  -4.360  -1.434  -3.822
  214   1HG2  VAL  28          1HG21     VAL  28  -3.548  -4.182  -5.177
  215   2HG2  VAL  28          3HG23     VAL  28  -3.206  -4.938  -3.602
  216   3HG2  VAL  28          2HG22     VAL  28  -4.601  -3.875  -3.780
  217    H    VAL  29           HN       VAL  29   0.023  -1.009  -5.319
  218    HA   VAL  29           HA       VAL  29   1.576  -0.412  -2.849
  219    HB   VAL  29           HB       VAL  29   2.278   0.558  -5.616
  220   1HG1  VAL  29          1HG21     VAL  29   3.357   1.459  -3.542
  221   2HG1  VAL  29          3HG23     VAL  29   3.885  -0.192  -3.151
  222   3HG1  VAL  29          2HG22     VAL  29   4.496   0.621  -4.603
  223   1HG2  VAL  29          3HG13     VAL  29   3.013  -2.160  -4.492
  224   2HG2  VAL  29          1HG11     VAL  29   2.028  -1.858  -5.945
  225   3HG2  VAL  29          2HG12     VAL  29   3.722  -1.389  -5.934
  226    H    ASP  30           HN       ASP  30   0.883   1.314  -1.748
  227    HA   ASP  30           HA       ASP  30  -0.550   3.551  -3.070
  228   1HB   ASP  30          1HB       ASP  30  -1.453   2.661  -1.017
  229   2HB   ASP  30          2HB       ASP  30   0.072   2.899  -0.162
  230    H    PHE  31           HN       PHE  31   0.872   4.841  -4.132
  231    HA   PHE  31           HA       PHE  31   3.377   5.727  -2.774
  232   1HB   PHE  31          1HB       PHE  31   2.371   6.058  -5.619
  233   2HB   PHE  31          2HB       PHE  31   3.807   6.824  -4.970
  234    HD1  PHE  31           HD2      PHE  31   5.837   5.542  -4.433
  235    HD2  PHE  31           HD1      PHE  31   2.376   3.611  -6.137
  236    HE1  PHE  31           HE2      PHE  31   7.277   3.751  -5.317
  237    HE2  PHE  31           HE1      PHE  31   3.846   1.821  -7.046
  238    HZ   PHE  31           HZ       PHE  31   6.291   1.848  -6.593
  239    H    THR  32           HN       THR  32   3.348   7.756  -1.839
  240    HA   THR  32           HA       THR  32   1.465   9.839  -2.562
  241    HB   THR  32           HB       THR  32  -0.029   8.421  -1.246
  242    HG1  THR  32           HG1      THR  32  -0.647   9.958   0.159
  243   1HG2  THR  32          2HG22     THR  32   2.083   8.558   0.955
  244   2HG2  THR  32          3HG23     THR  32   0.435   7.915   1.135
  245   3HG2  THR  32          1HG21     THR  32   1.580   7.103   0.064
  246    H    ALA  33           HN       ALA  33   1.798  11.433  -0.321
  247    HA   ALA  33           HA       ALA  33   4.769  11.638   0.044
  248   1HB   ALA  33          3HB       ALA  33   4.257  12.966  -1.936
  249   2HB   ALA  33          2HB       ALA  33   3.022  13.871  -1.029
  250   3HB   ALA  33          1HB       ALA  33   4.729  13.978  -0.562
  251    H    THR  34           HN       THR  34   5.124  11.809   2.157
  252    HA   THR  34           HA       THR  34   3.571  12.021   4.333
  253    HB   THR  34           HB       THR  34   5.551  13.245   5.411
  254    HG1  THR  34           HG1      THR  34   7.389  13.323   3.852
  255   1HG2  THR  34          3HG23     THR  34   5.432  10.758   5.277
  256   2HG2  THR  34          2HG22     THR  34   6.263  10.815   3.712
  257   3HG2  THR  34          1HG21     THR  34   7.091  11.374   5.170
  258    H    TRP  35           HN       TRP  35   5.186  14.868   3.104
  259    HA   TRP  35           HA       TRP  35   3.895  16.834   4.612
  260   1HB   TRP  35          2HB       TRP  35   4.602  18.335   2.577
  261   2HB   TRP  35          1HB       TRP  35   5.793  17.566   3.609
  262    HD1  TRP  35           HD1      TRP  35   7.455  15.837   2.592
  263    HE1  TRP  35           HE1      TRP  35   8.099  15.178   0.244
  264    HE3  TRP  35           HE3      TRP  35   3.457  17.859   0.086
  265    HZ2  TRP  35           HZ2      TRP  35   7.038  15.485  -2.432
  266    HZ3  TRP  35           HZ3      TRP  35   3.303  17.626  -2.375
  267    HH2  TRP  35           HH2      TRP  35   5.093  16.462  -3.644
  268    H    CYS  36           HN       CYS  36   2.599  15.241   1.694
  269    HA   CYS  36           HA       CYS  36   0.551  17.360   1.368
  270   1HB   CYS  36          2HB       CYS  36   1.375  16.371  -0.658
  271   2HB   CYS  36          1HB       CYS  36   0.981  14.748  -0.075
  272    H    GLY  37           HN       GLY  37  -0.131  17.133   3.585
  273   1HA   GLY  37          1HA       GLY  37  -1.248  15.226   5.058
  274   2HA   GLY  37          2HA       GLY  37  -2.110  16.753   4.797
  275    HA   PRO  38           HA       PRO  38  -5.458  14.731   2.813
  276   1HB   PRO  38          2HB       PRO  38  -5.757  15.688   0.220
  277   2HB   PRO  38          1HB       PRO  38  -6.234  16.561   1.702
  278   1HG   PRO  38          2HG       PRO  38  -3.673  16.846   0.129
  279   2HG   PRO  38          1HG       PRO  38  -4.723  18.146   0.758
  280   1HD   PRO  38          1HD       PRO  38  -2.500  17.429   2.075
  281   2HD   PRO  38          2HD       PRO  38  -3.987  17.760   3.002
  282    H    CYS  39           HN       CYS  39  -2.434  14.530   0.972
  283    HA   CYS  39           HA       CYS  39  -3.316  12.293  -0.684
  284   1HB   CYS  39          1HB       CYS  39  -0.455  13.011   0.015
  285   2HB   CYS  39          2HB       CYS  39  -1.052  12.010  -1.294
  286    H    LYS  40           HN       LYS  40  -1.938  12.815   2.550
  287    HA   LYS  40           HA       LYS  40  -1.371   9.957   2.969
  288   1HB   LYS  40          1HB       LYS  40  -1.325  12.351   4.857
  289   2HB   LYS  40          2HB       LYS  40  -0.846  10.718   5.293
  290   1HG   LYS  40          1HG       LYS  40   0.459  12.481   3.171
  291   2HG   LYS  40          2HG       LYS  40   1.101  12.105   4.766
  292   1HD   LYS  40          2HD       LYS  40   0.701  10.117   2.470
  293   2HD   LYS  40          1HD       LYS  40   2.204  10.794   3.023
  294   1HE   LYS  40          2HE       LYS  40   1.898   9.745   5.265
  295   2HE   LYS  40          1HE       LYS  40   0.433   8.937   4.666
  296   1HZ   LYS  40          1HZ       LYS  40   3.093   8.645   3.471
  297   2HZ   LYS  40          3HZ       LYS  40   2.427   7.581   4.545
  298   3HZ   LYS  40          2HZ       LYS  40   1.732   7.814   3.069
  299    H    MET  41           HN       MET  41  -4.024  12.189   3.641
  300    HA   MET  41           HA       MET  41  -5.419  10.568   5.526
  301   1HB   MET  41          1HB       MET  41  -6.468  12.447   3.359
  302   2HB   MET  41          2HB       MET  41  -7.492  11.705   4.592
  303   1HG   MET  41          1HG       MET  41  -5.125  13.496   5.226
  304   2HG   MET  41          2HG       MET  41  -6.811  14.013   5.168
  305   1HE   MET  41          1HE       MET  41  -6.359  15.095   7.553
  306   2HE   MET  41          2HE       MET  41  -5.813  14.158   8.964
  307   3HE   MET  41          3HE       MET  41  -4.710  14.418   7.592
  308    H    ILE  42           HN       ILE  42  -4.931   9.995   2.111
  309    HA   ILE  42           HA       ILE  42  -7.092   8.130   1.767
  310    HB   ILE  42           HB       ILE  42  -4.392   8.371   0.392
  311   1HG1  ILE  42          1HG11     ILE  42  -7.067   9.330  -0.704
  312   2HG1  ILE  42          2HG12     ILE  42  -6.082  10.386   0.314
  313   1HG2  ILE  42          3HG23     ILE  42  -6.923   6.798  -0.262
  314   2HG2  ILE  42          2HG22     ILE  42  -5.712   7.167  -1.496
  315   3HG2  ILE  42          1HG21     ILE  42  -5.267   6.178  -0.101
  316   1HD1  ILE  42          1HD11     ILE  42  -4.137  10.059  -1.176
  317   2HD1  ILE  42          3HD13     ILE  42  -5.158   9.154  -2.301
  318   3HD1  ILE  42          2HD12     ILE  42  -5.511  10.860  -1.946
  319    H    ALA  43           HN       ALA  43  -3.868   7.898   3.238
  320    HA   ALA  43           HA       ALA  43  -3.391   5.165   2.962
  321   1HB   ALA  43          2HB       ALA  43  -1.722   6.781   3.765
  322   2HB   ALA  43          1HB       ALA  43  -2.581   6.966   5.300
  323   3HB   ALA  43          3HB       ALA  43  -1.872   5.404   4.879
  324    HA   PRO  44           HA       PRO  44  -5.606   4.200   7.145
  325   1HB   PRO  44          2HB       PRO  44  -7.643   5.898   7.976
  326   2HB   PRO  44          1HB       PRO  44  -5.965   5.930   8.588
  327   1HG   PRO  44          1HG       PRO  44  -7.161   7.615   6.382
  328   2HG   PRO  44          2HG       PRO  44  -6.175   8.171   7.767
  329   1HD   PRO  44          1HD       PRO  44  -4.982   7.801   5.414
  330   2HD   PRO  44          2HD       PRO  44  -4.200   7.156   6.874
  331    H    LEU  45           HN       LEU  45  -7.436   6.023   4.685
  332    HA   LEU  45           HA       LEU  45  -9.765   4.348   4.665
  333   1HB   LEU  45          1HB       LEU  45  -8.454   6.265   2.743
  334   2HB   LEU  45          2HB       LEU  45  -9.593   5.123   2.063
  335    HG   LEU  45           HG       LEU  45 -10.516   7.364   2.659
  336   1HD1  LEU  45          1HD21     LEU  45 -11.987   5.385   2.446
  337   2HD1  LEU  45          3HD23     LEU  45 -11.835   5.077   4.188
  338   3HD1  LEU  45          2HD22     LEU  45 -12.602   6.565   3.614
  339   1HD2  LEU  45          3HD13     LEU  45  -9.235   7.753   4.738
  340   2HD2  LEU  45          2HD12     LEU  45 -10.978   7.978   4.957
  341   3HD2  LEU  45          1HD11     LEU  45 -10.197   6.508   5.565
  342    H    PHE  46           HN       PHE  46  -6.837   4.236   2.643
  343    HA   PHE  46           HA       PHE  46  -7.319   1.847   1.217
  344   1HB   PHE  46          2HB       PHE  46  -5.616   3.382   0.591
  345   2HB   PHE  46          1HB       PHE  46  -4.866   3.335   2.155
  346    HD1  PHE  46           HD1      PHE  46  -5.524   1.172  -0.851
  347    HD2  PHE  46           HD2      PHE  46  -2.917   2.105   2.436
  348    HE1  PHE  46           HE1      PHE  46  -3.677  -0.071  -1.950
  349    HE2  PHE  46           HE2      PHE  46  -1.085   0.803   1.366
  350    HZ   PHE  46           HZ       PHE  46  -1.409  -0.166  -0.895
  351    H    GLU  47           HN       GLU  47  -5.678   2.282   4.419
  352    HA   GLU  47           HA       GLU  47  -5.369  -0.555   4.927
  353   1HB   GLU  47          1HB       GLU  47  -5.475   1.903   6.743
  354   2HB   GLU  47          2HB       GLU  47  -4.972   0.295   7.266
  355   1HG   GLU  47          1HG       GLU  47  -3.016   0.322   5.876
  356   2HG   GLU  47          2HG       GLU  47  -3.545   1.758   5.000
  357    H    THR  48           HN       THR  48  -8.152   1.606   5.489
  358    HA   THR  48           HA       THR  48  -9.476  -0.137   7.309
  359    HB   THR  48           HB       THR  48 -10.753   1.559   5.111
  360    HG1  THR  48           HG1      THR  48  -9.322   2.657   6.664
  361   1HG2  THR  48          3HG23     THR  48 -11.853   0.481   7.736
  362   2HG2  THR  48          1HG21     THR  48 -12.676   1.626   6.659
  363   3HG2  THR  48          2HG22     THR  48 -12.350  -0.025   6.106
  364    H    LEU  49           HN       LEU  49  -9.132  -0.197   3.741
  365    HA   LEU  49           HA       LEU  49 -10.906  -2.376   3.263
  366   1HB   LEU  49          2HB       LEU  49  -8.357  -1.837   1.737
  367   2HB   LEU  49          1HB       LEU  49  -9.809  -2.648   1.161
  368    HG   LEU  49           HG       LEU  49  -9.548   0.278   1.762
  369   1HD1  LEU  49          2HD22     LEU  49  -8.448  -0.419  -0.317
  370   2HD1  LEU  49          3HD23     LEU  49  -9.941  -1.213  -0.856
  371   3HD1  LEU  49          1HD21     LEU  49  -9.885   0.553  -0.658
  372   1HD2  LEU  49          1HD11     LEU  49 -11.954  -1.291   0.728
  373   2HD2  LEU  49          2HD12     LEU  49 -11.837  -0.512   2.325
  374   3HD2  LEU  49          3HD13     LEU  49 -11.838   0.480   0.868
  375    H    SER  50           HN       SER  50  -7.676  -2.369   4.750
  376    HA   SER  50           HA       SER  50  -6.854  -5.022   4.236
  377   1HB   SER  50          2HB       SER  50  -5.581  -3.275   5.603
  378   2HB   SER  50          1HB       SER  50  -6.693  -3.594   6.941
  379    HG   SER  50           HG       SER  50  -4.816  -4.896   7.087
  380    H    ASN  51           HN       ASN  51  -9.245  -3.673   6.440
  381    HA   ASN  51           HA       ASN  51  -9.820  -6.008   8.003
  382   1HB   ASN  51          2HB       ASN  51 -10.694  -3.753   8.534
  383   2HB   ASN  51          1HB       ASN  51 -11.738  -3.808   7.103
  384   1HD2  ASN  51          1HD21     ASN  51 -14.156  -5.958   8.579
  385   2HD2  ASN  51          2HD22     ASN  51 -13.586  -5.267   7.073
  386    H    ASP  52           HN       ASP  52 -10.964  -4.960   4.797
  387    HA   ASP  52           HA       ASP  52 -12.924  -7.118   4.516
  388   1HB   ASP  52          1HB       ASP  52 -13.307  -4.919   3.464
  389   2HB   ASP  52          2HB       ASP  52 -11.814  -5.083   2.520
  390    H    TYR  53           HN       TYR  53  -9.675  -6.252   3.096
  391    HA   TYR  53           HA       TYR  53  -9.629  -8.827   1.647
  392   1HB   TYR  53          2HB       TYR  53  -7.807  -6.411   1.708
  393   2HB   TYR  53          1HB       TYR  53  -7.567  -7.848   0.709
  394    HD1  TYR  53           HD1      TYR  53  -9.332  -8.476  -1.024
  395    HD2  TYR  53           HD2      TYR  53  -9.399  -4.725   1.050
  396    HE1  TYR  53           HE1      TYR  53 -10.920  -7.582  -2.703
  397    HE2  TYR  53           HE2      TYR  53 -10.968  -3.807  -0.632
  398    HH   TYR  53           HH       TYR  53 -12.231  -4.259  -2.503
  399    H    ALA  54           HN       ALA  54  -9.850  -9.669   3.911
  400    HA   ALA  54           HA       ALA  54  -7.757  -9.703   5.788
  401   1HB   ALA  54          2HB       ALA  54 -10.042 -10.502   6.228
  402   2HB   ALA  54          1HB       ALA  54  -9.791 -11.876   5.126
  403   3HB   ALA  54          3HB       ALA  54  -8.848 -11.753   6.628
  404    H    GLY  55           HN       GLY  55  -8.189 -11.531   2.814
  405   1HA   GLY  55          1HA       GLY  55  -6.280 -13.610   3.260
  406   2HA   GLY  55          2HA       GLY  55  -6.962 -13.087   1.710
  407    H    LYS  56           HN       LYS  56  -4.781 -13.715   1.047
  408    HA   LYS  56           HA       LYS  56  -2.410 -12.311   1.762
  409   1HB   LYS  56          1HB       LYS  56  -1.494 -13.576  -0.225
  410   2HB   LYS  56          2HB       LYS  56  -2.237 -14.524   1.047
  411   1HG   LYS  56          1HG       LYS  56  -2.729 -15.312  -1.241
  412   2HG   LYS  56          2HG       LYS  56  -4.167 -15.046  -0.270
  413   1HD   LYS  56          2HD       LYS  56  -4.623 -12.920  -1.466
  414   2HD   LYS  56          1HD       LYS  56  -3.064 -13.049  -2.302
  415   1HE   LYS  56          1HE       LYS  56  -4.800 -13.698  -3.802
  416   2HE   LYS  56          2HE       LYS  56  -3.809 -15.115  -3.425
  417   1HZ   LYS  56          2HZ       LYS  56  -6.431 -14.491  -2.266
  418   2HZ   LYS  56          1HZ       LYS  56  -6.092 -15.605  -3.437
  419   3HZ   LYS  56          3HZ       LYS  56  -5.510 -15.820  -1.905
  420    H    VAL  57           HN       VAL  57  -4.256 -10.249   1.073
  421    HA   VAL  57           HA       VAL  57  -3.319  -9.246  -1.567
  422    HB   VAL  57           HB       VAL  57  -5.285  -8.075   0.443
  423   1HG1  VAL  57          2HG22     VAL  57  -4.252  -6.398  -1.133
  424   2HG1  VAL  57          3HG23     VAL  57  -4.885  -7.329  -2.491
  425   3HG1  VAL  57          1HG21     VAL  57  -6.003  -6.604  -1.344
  426   1HG2  VAL  57          2HG12     VAL  57  -5.712  -9.807  -2.031
  427   2HG2  VAL  57          1HG11     VAL  57  -6.270 -10.117  -0.376
  428   3HG2  VAL  57          3HG13     VAL  57  -6.997  -8.816  -1.331
  429    H    ILE  58           HN       ILE  58  -1.569  -7.886  -1.680
  430    HA   ILE  58           HA       ILE  58  -0.368  -7.213   0.997
  431    HB   ILE  58           HB       ILE  58   0.950  -7.618  -1.687
  432   1HG1  ILE  58          2HG12     ILE  58   1.965  -9.444   0.191
  433   2HG1  ILE  58          1HG11     ILE  58   0.237  -9.449   0.530
  434   1HG2  ILE  58          3HG23     ILE  58   2.097  -5.943  -0.271
  435   2HG2  ILE  58          2HG22     ILE  58   2.122  -7.092   1.073
  436   3HG2  ILE  58          1HG21     ILE  58   3.041  -7.428  -0.416
  437   1HD1  ILE  58          1HD11     ILE  58  -0.147  -9.850  -1.958
  438   2HD1  ILE  58          2HD12     ILE  58   1.618  -9.999  -2.123
  439   3HD1  ILE  58          3HD13     ILE  58   0.725 -11.151  -1.118
  440    H    PHE  59           HN       PHE  59  -0.978  -5.242   1.578
  441    HA   PHE  59           HA       PHE  59  -1.307  -3.063  -0.439
  442   1HB   PHE  59          1HB       PHE  59  -2.009  -3.335   2.465
  443   2HB   PHE  59          2HB       PHE  59  -2.032  -1.809   1.628
  444    HD1  PHE  59           HD2      PHE  59  -3.425  -5.298   0.979
  445    HD2  PHE  59           HD1      PHE  59  -4.154  -1.059   1.242
  446    HE1  PHE  59           HE2      PHE  59  -5.849  -5.673   0.763
  447    HE2  PHE  59           HE1      PHE  59  -6.490  -1.417   0.607
  448    HZ   PHE  59           HZ       PHE  59  -7.400  -3.742   0.509
  449    H    LEU  60           HN       LEU  60   0.885  -2.637  -0.930
  450    HA   LEU  60           HA       LEU  60   2.833  -2.138   1.252
  451   1HB   LEU  60          1HB       LEU  60   3.012  -1.847  -1.773
  452   2HB   LEU  60          2HB       LEU  60   4.357  -1.582  -0.644
  453    HG   LEU  60           HG       LEU  60   2.912  -4.166  -1.289
  454   1HD1  LEU  60          1HD21     LEU  60   4.630  -3.363  -2.918
  455   2HD1  LEU  60          2HD22     LEU  60   5.834  -3.364  -1.609
  456   3HD1  LEU  60          3HD23     LEU  60   5.094  -4.886  -2.134
  457   1HD2  LEU  60          1HD11     LEU  60   5.067  -3.655   0.814
  458   2HD2  LEU  60          2HD12     LEU  60   3.424  -4.286   1.092
  459   3HD2  LEU  60          3HD13     LEU  60   4.606  -5.263   0.217
  460    H    LYS  61           HN       LYS  61   3.631  -0.114   1.775
  461    HA   LYS  61           HA       LYS  61   2.247   2.270   0.640
  462   1HB   LYS  61          1HB       LYS  61   1.604   1.886   2.990
  463   2HB   LYS  61          2HB       LYS  61   3.300   1.734   3.437
  464   1HG   LYS  61          1HG       LYS  61   2.603   3.939   4.082
  465   2HG   LYS  61          2HG       LYS  61   3.745   4.042   2.777
  466   1HD   LYS  61          1HD       LYS  61   2.270   5.646   2.168
  467   2HD   LYS  61          2HD       LYS  61   1.654   4.323   1.199
  468   1HE   LYS  61          2HE       LYS  61   0.560   5.252   3.907
  469   2HE   LYS  61          1HE       LYS  61  -0.119   5.644   2.319
  470   1HZ   LYS  61          2HZ       LYS  61  -0.538   3.334   1.969
  471   2HZ   LYS  61          1HZ       LYS  61   0.048   2.958   3.469
  472   3HZ   LYS  61          3HZ       LYS  61  -1.304   3.882   3.315
  473    H    VAL  62           HN       VAL  62   3.670   3.460  -0.547
  474    HA   VAL  62           HA       VAL  62   6.593   3.318   0.095
  475    HB   VAL  62           HB       VAL  62   5.361   3.065  -2.682
  476   1HG1  VAL  62          3HG13     VAL  62   7.657   4.118  -2.619
  477   2HG1  VAL  62          1HG11     VAL  62   8.225   2.710  -1.690
  478   3HG1  VAL  62          2HG12     VAL  62   7.661   2.506  -3.350
  479   1HG2  VAL  62          2HG22     VAL  62   6.675   0.934  -0.935
  480   2HG2  VAL  62          1HG21     VAL  62   4.972   0.966  -1.440
  481   3HG2  VAL  62          3HG23     VAL  62   6.241   0.763  -2.649
  482    H    ASP  63           HN       ASP  63   5.832   5.313   1.211
  483    HA   ASP  63           HA       ASP  63   4.804   7.525  -0.215
  484   1HB   ASP  63          1HB       ASP  63   4.874   7.226   2.277
  485   2HB   ASP  63          2HB       ASP  63   6.609   7.598   2.239
  486    H    VAL  64           HN       VAL  64   5.755   8.825  -1.699
  487    HA   VAL  64           HA       VAL  64   8.352   8.252  -2.716
  488    HB   VAL  64           HB       VAL  64   7.961   9.968  -4.292
  489   1HG1  VAL  64          3HG13     VAL  64   6.391   7.962  -4.381
  490   2HG1  VAL  64          1HG11     VAL  64   5.142   8.998  -3.674
  491   3HG1  VAL  64          2HG12     VAL  64   5.855   9.419  -5.236
  492   1HG2  VAL  64          3HG23     VAL  64   5.884  11.158  -2.420
  493   2HG2  VAL  64          2HG22     VAL  64   7.403  11.895  -2.961
  494   3HG2  VAL  64          1HG21     VAL  64   6.096  11.626  -4.117
  495    H    ASP  65           HN       ASP  65   7.291  10.481  -0.194
  496    HA   ASP  65           HA       ASP  65   9.574  12.255  -0.323
  497   1HB   ASP  65          1HB       ASP  65   7.373  12.717   0.834
  498   2HB   ASP  65          2HB       ASP  65   7.882  11.571   2.091
  499    H    ALA  66           HN       ALA  66   8.938   9.033   0.983
  500    HA   ALA  66           HA       ALA  66  11.472   9.023   2.562
  501   1HB   ALA  66          3HB       ALA  66   9.052   7.166   2.574
  502   2HB   ALA  66          2HB       ALA  66  10.513   6.977   3.566
  503   3HB   ALA  66          1HB       ALA  66   9.461   8.389   3.789
  504    H    VAL  67           HN       VAL  67   9.624   6.653   0.552
  505    HA   VAL  67           HA       VAL  67  12.203   5.362  -0.176
  506    HB   VAL  67           HB       VAL  67   9.365   4.453  -0.731
  507   1HG1  VAL  67          1HG21     VAL  67  11.192   3.423  -2.132
  508   2HG1  VAL  67          3HG23     VAL  67  12.054   2.990  -0.657
  509   3HG1  VAL  67          2HG22     VAL  67  10.487   2.241  -1.019
  510   1HG2  VAL  67          1HG11     VAL  67  11.256   3.722   1.563
  511   2HG2  VAL  67          2HG12     VAL  67   9.683   4.532   1.724
  512   3HG2  VAL  67          3HG13     VAL  67   9.762   2.856   1.168
  513    H    ALA  68           HN       ALA  68  12.461   7.616  -1.168
  514    HA   ALA  68           HA       ALA  68  11.258   8.418  -3.567
  515   1HB   ALA  68          3HB       ALA  68  12.807   9.807  -2.254
  516   2HB   ALA  68          1HB       ALA  68  14.163   8.740  -2.689
  517   3HB   ALA  68          2HB       ALA  68  13.340   9.692  -3.943
  518    H    ALA  69           HN       ALA  69  13.991   6.171  -3.083
  519    HA   ALA  69           HA       ALA  69  14.847   5.781  -5.698
  520   1HB   ALA  69          2HB       ALA  69  14.611   3.722  -3.459
  521   2HB   ALA  69          3HB       ALA  69  15.621   3.565  -4.913
  522   3HB   ALA  69          1HB       ALA  69  15.967   4.839  -3.729
  523    H    VAL  70           HN       VAL  70  12.243   3.923  -4.010
  524    HA   VAL  70           HA       VAL  70  11.649   2.331  -6.356
  525    HB   VAL  70           HB       VAL  70   9.926   2.896  -3.912
  526   1HG1  VAL  70          3HG13     VAL  70   9.800   0.691  -6.033
  527   2HG1  VAL  70          1HG11     VAL  70   8.792   0.777  -4.572
  528   3HG1  VAL  70          2HG12     VAL  70   8.615   1.987  -5.845
  529   1HG2  VAL  70          1HG21     VAL  70  12.129   1.793  -3.386
  530   2HG2  VAL  70          2HG22     VAL  70  10.733   0.728  -3.114
  531   3HG2  VAL  70          3HG23     VAL  70  11.737   0.534  -4.573
  532    H    ALA  71           HN       ALA  71  10.265   5.274  -4.860
  533    HA   ALA  71           HA       ALA  71   8.082   5.636  -6.602
  534   1HB   ALA  71          3HB       ALA  71   8.530   6.984  -4.587
  535   2HB   ALA  71          1HB       ALA  71   9.836   7.839  -5.435
  536   3HB   ALA  71          2HB       ALA  71   8.171   7.990  -6.012
  537    H    GLU  72           HN       GLU  72  11.444   6.901  -7.105
  538    HA   GLU  72           HA       GLU  72  10.753   7.966  -9.703
  539   1HB   GLU  72          2HB       GLU  72  13.093   8.375 -10.019
  540   2HB   GLU  72          1HB       GLU  72  12.598   8.867  -8.396
  541   1HG   GLU  72          2HG       GLU  72  13.585   6.728  -7.519
  542   2HG   GLU  72          1HG       GLU  72  14.210   6.382  -9.139
  543    H    ALA  73           HN       ALA  73  12.304   4.852  -8.655
  544    HA   ALA  73           HA       ALA  73  12.805   3.845 -11.243
  545   1HB   ALA  73          1HB       ALA  73  13.617   2.799  -9.155
  546   2HB   ALA  73          3HB       ALA  73  11.954   2.320  -8.742
  547   3HB   ALA  73          2HB       ALA  73  12.749   1.630 -10.171
  548    H    ALA  74           HN       ALA  74   9.820   3.757  -9.307
  549    HA   ALA  74           HA       ALA  74   8.271   2.213 -11.221
  550   1HB   ALA  74          2HB       ALA  74   7.901   2.106  -8.798
  551   2HB   ALA  74          3HB       ALA  74   7.442   3.821  -8.780
  552   3HB   ALA  74          1HB       ALA  74   6.449   2.637  -9.657
  553    H    GLY  75           HN       GLY  75   9.393   5.424 -11.330
  554   1HA   GLY  75          1HA       GLY  75   8.869   7.191 -12.633
  555   2HA   GLY  75          2HA       GLY  75   7.788   6.116 -13.541
  556    H    ILE  76           HN       ILE  76   7.582   7.109 -10.063
  557    HA   ILE  76           HA       ILE  76   4.772   7.801 -10.446
  558    HB   ILE  76           HB       ILE  76   6.618   8.333  -8.078
  559   1HG1  ILE  76          1HG11     ILE  76   6.405   5.929  -8.620
  560   2HG1  ILE  76          2HG12     ILE  76   5.712   6.377  -7.062
  561   1HG2  ILE  76          3HG23     ILE  76   3.585   8.502  -8.409
  562   2HG2  ILE  76          2HG22     ILE  76   4.393   8.420  -6.832
  563   3HG2  ILE  76          1HG21     ILE  76   4.703   9.785  -7.910
  564   1HD1  ILE  76          2HD12     ILE  76   4.119   5.872  -9.625
  565   2HD1  ILE  76          3HD13     ILE  76   4.376   4.712  -8.325
  566   3HD1  ILE  76          1HD11     ILE  76   3.450   6.184  -8.004
  567    H    THR  77           HN       THR  77   3.904   9.713 -10.859
  568    HA   THR  77           HA       THR  77   5.563  12.206 -10.784
  569    HB   THR  77           HB       THR  77   4.330  12.843 -12.882
  570    HG1  THR  77           HG1      THR  77   3.496  10.917 -14.034
  571   1HG2  THR  77          3HG23     THR  77   6.659  11.914 -12.944
  572   2HG2  THR  77          1HG21     THR  77   5.983  10.288 -13.170
  573   3HG2  THR  77          2HG22     THR  77   5.724  11.535 -14.403
  574    H    ALA  78           HN       ALA  78   2.235  11.530 -11.718
  575    HA   ALA  78           HA       ALA  78   1.174  13.674 -10.062
  576   1HB   ALA  78          1HB       ALA  78   0.259  13.118 -12.282
  577   2HB   ALA  78          2HB       ALA  78  -0.227  11.512 -11.696
  578   3HB   ALA  78          3HB       ALA  78  -0.984  12.974 -11.025
  579    H    MET  79           HN       MET  79   2.297  12.471  -8.109
  580    HA   MET  79           HA       MET  79   0.915  10.261  -6.968
  581   1HB   MET  79          1HB       MET  79   2.266  10.587  -5.031
  582   2HB   MET  79          2HB       MET  79   3.232  11.024  -6.432
  583   1HG   MET  79          2HG       MET  79   3.726  12.721  -4.942
  584   2HG   MET  79          1HG       MET  79   2.465  13.460  -5.929
  585   1HE   MET  79          3HE       MET  79   2.882  15.150  -3.861
  586   2HE   MET  79          1HE       MET  79   1.247  15.215  -4.570
  587   3HE   MET  79          2HE       MET  79   1.457  15.256  -2.805
  588    HA   PRO  80           HA       PRO  80   0.227   9.724  -4.609
  589   1HB   PRO  80          2HB       PRO  80  -2.111   8.645  -3.727
  590   2HB   PRO  80          1HB       PRO  80  -1.272   9.960  -2.853
  591   1HG   PRO  80          1HG       PRO  80  -3.557  10.222  -4.814
  592   2HG   PRO  80          2HG       PRO  80  -3.399  10.951  -3.188
  593   1HD   PRO  80          1HD       PRO  80  -2.765  12.329  -5.491
  594   2HD   PRO  80          2HD       PRO  80  -1.865  12.577  -3.975
  595    H    THR  81           HN       THR  81  -0.120   7.465  -5.258
  596    HA   THR  81           HA       THR  81  -1.604   7.027  -7.753
  597    HB   THR  81           HB       THR  81   1.418   7.223  -7.516
  598    HG1  THR  81           HG1      THR  81  -0.329   8.907  -8.375
  599   1HG2  THR  81          2HG22     THR  81  -0.142   5.909  -9.783
  600   2HG2  THR  81          3HG23     THR  81   1.570   6.360  -9.833
  601   3HG2  THR  81          1HG21     THR  81   1.022   5.125  -8.683
  602    H    PHE  82           HN       PHE  82  -2.128   4.962  -8.023
  603    HA   PHE  82           HA       PHE  82  -1.298   3.023  -5.921
  604   1HB   PHE  82          2HB       PHE  82  -3.928   3.479  -7.329
  605   2HB   PHE  82          1HB       PHE  82  -3.587   2.041  -6.384
  606    HD1  PHE  82           HD2      PHE  82  -3.075   2.268  -3.908
  607    HD2  PHE  82           HD1      PHE  82  -4.284   5.674  -6.272
  608    HE1  PHE  82           HE2      PHE  82  -3.302   3.635  -1.853
  609    HE2  PHE  82           HE1      PHE  82  -4.370   7.059  -4.228
  610    HZ   PHE  82           HZ       PHE  82  -3.770   6.053  -2.012
  611    H    HIS  83           HN       HIS  83  -0.112   1.342  -6.758
  612    HA   HIS  83           HA       HIS  83  -0.422   0.638  -9.676
  613   1HB   HIS  83          1HB       HIS  83   1.978   0.527  -7.823
  614   2HB   HIS  83          2HB       HIS  83   1.891  -0.317  -9.356
  615    HD2  HIS  83           HD2      HIS  83   0.369   3.048 -10.032
  616    HE1  HIS  83           HE1      HIS  83   4.498   3.439 -10.810
  617    HE2  HIS  83           HE2      HIS  83   2.224   4.518 -11.156
  618    H    VAL  84           HN       VAL  84  -0.555  -1.646 -10.142
  619    HA   VAL  84           HA       VAL  84  -0.773  -3.414  -7.723
  620    HB   VAL  84           HB       VAL  84  -2.236  -3.841 -10.344
  621   1HG1  VAL  84          1HG21     VAL  84  -2.458  -5.032  -7.532
  622   2HG1  VAL  84          2HG22     VAL  84  -3.463  -5.454  -8.924
  623   3HG1  VAL  84          3HG23     VAL  84  -1.743  -5.840  -8.945
  624   1HG2  VAL  84          3HG13     VAL  84  -3.203  -2.569  -7.733
  625   2HG2  VAL  84          2HG12     VAL  84  -3.170  -1.797  -9.334
  626   3HG2  VAL  84          1HG11     VAL  84  -4.269  -3.146  -9.027
  627    H    TYR  85           HN       TYR  85   1.150  -4.507  -7.649
  628    HA   TYR  85           HA       TYR  85   2.551  -5.159 -10.194
  629   1HB   TYR  85          2HB       TYR  85   3.340  -4.899  -7.327
  630   2HB   TYR  85          1HB       TYR  85   4.256  -5.988  -8.345
  631    HD1  TYR  85           HD1      TYR  85   2.871  -2.468  -8.376
  632    HD2  TYR  85           HD2      TYR  85   6.190  -5.071  -9.270
  633    HE1  TYR  85           HE1      TYR  85   4.263  -0.507  -9.005
  634    HE2  TYR  85           HE2      TYR  85   7.523  -3.127  -9.999
  635    HH   TYR  85           HH       TYR  85   7.612  -0.827 -10.185
  636    H    LYS  86           HN       LYS  86   1.337  -6.873 -11.036
  637    HA   LYS  86           HA       LYS  86   1.242  -9.431  -9.467
  638   1HB   LYS  86          2HB       LYS  86  -0.131  -8.438 -11.975
  639   2HB   LYS  86          1HB       LYS  86   0.101 -10.170 -11.708
  640   1HG   LYS  86          2HG       LYS  86  -1.147 -10.187  -9.715
  641   2HG   LYS  86          1HG       LYS  86  -1.172  -8.420  -9.580
  642   1HD   LYS  86          1HD       LYS  86  -2.728  -8.154 -11.317
  643   2HD   LYS  86          2HD       LYS  86  -2.367  -9.723 -12.044
  644   1HE   LYS  86          2HE       LYS  86  -4.620  -9.468 -10.837
  645   2HE   LYS  86          1HE       LYS  86  -3.669 -10.919 -10.491
  646   1HZ   LYS  86          1HZ       LYS  86  -3.549  -8.546  -8.793
  647   2HZ   LYS  86          3HZ       LYS  86  -4.633  -9.776  -8.559
  648   3HZ   LYS  86          2HZ       LYS  86  -3.023 -10.082  -8.473
  649    H    ASP  87           HN       ASP  87   2.296 -11.294 -10.443
  650    HA   ASP  87           HA       ASP  87   3.894 -12.480 -11.413
  651   1HB   ASP  87          2HB       ASP  87   4.229 -10.197 -13.430
  652   2HB   ASP  87          1HB       ASP  87   4.957 -11.798 -13.513
  653    H    GLY  88           HN       GLY  88   4.884  -9.155 -11.596
  654   1HA   GLY  88          1HA       GLY  88   6.436  -8.773  -9.368
  655   2HA   GLY  88          2HA       GLY  88   7.572  -9.452 -10.557
  656    H    VAL  89           HN       VAL  89   4.741  -7.421 -11.574
  657    HA   VAL  89           HA       VAL  89   6.346  -5.009 -11.755
  658    HB   VAL  89           HB       VAL  89   7.278  -6.300 -13.613
  659   1HG1  VAL  89          2HG12     VAL  89   5.364  -7.822 -14.081
  660   2HG1  VAL  89          1HG11     VAL  89   4.458  -6.457 -14.766
  661   3HG1  VAL  89          3HG13     VAL  89   5.957  -7.003 -15.531
  662   1HG2  VAL  89          1HG21     VAL  89   6.989  -3.844 -13.838
  663   2HG2  VAL  89          2HG22     VAL  89   6.961  -4.705 -15.386
  664   3HG2  VAL  89          3HG23     VAL  89   5.446  -4.119 -14.682
  665    H    LYS  90           HN       LYS  90   5.037  -3.288 -11.894
  666    HA   LYS  90           HA       LYS  90   2.436  -2.949 -11.458
  667   1HB   LYS  90          2HB       LYS  90   4.165  -1.191 -11.827
  668   2HB   LYS  90          1HB       LYS  90   4.043  -1.471 -13.564
  669   1HG   LYS  90          1HG       LYS  90   1.559  -0.794 -13.373
  670   2HG   LYS  90          2HG       LYS  90   1.889  -0.408 -11.684
  671   1HD   LYS  90          1HD       LYS  90   2.074   1.636 -12.904
  672   2HD   LYS  90          2HD       LYS  90   3.732   1.167 -12.500
  673   1HE   LYS  90          1HE       LYS  90   4.140   0.413 -14.770
  674   2HE   LYS  90          2HE       LYS  90   2.409   0.454 -15.151
  675   1HZ   LYS  90          3HZ       LYS  90   4.069   2.798 -14.544
  676   2HZ   LYS  90          1HZ       LYS  90   3.583   2.321 -16.046
  677   3HZ   LYS  90          2HZ       LYS  90   2.466   2.813 -14.942
  678    H    ALA  91           HN       ALA  91   1.020  -4.479 -12.269
  679    HA   ALA  91           HA       ALA  91   0.672  -5.013 -15.122
  680   1HB   ALA  91          2HB       ALA  91  -0.901  -5.850 -12.640
  681   2HB   ALA  91          3HB       ALA  91  -1.135  -6.491 -14.278
  682   3HB   ALA  91          1HB       ALA  91   0.404  -6.769 -13.429
  683    H    ASP  92           HN       ASP  92  -0.856  -3.127 -12.557
  684    HA   ASP  92           HA       ASP  92  -2.521  -1.700 -14.526
  685   1HB   ASP  92          2HB       ASP  92  -3.836  -3.600 -13.417
  686   2HB   ASP  92          1HB       ASP  92  -3.697  -2.693 -11.904
  687    H    ASP  93           HN       ASP  93  -3.393   0.390 -13.356
  688    HA   ASP  93           HA       ASP  93  -2.102   1.211 -11.018
  689   1HB   ASP  93          2HB       ASP  93  -0.709   3.076 -12.006
  690   2HB   ASP  93          1HB       ASP  93  -0.080   1.457 -12.288
  691    H    LEU  94           HN       LEU  94  -2.444   3.541 -10.637
  692    HA   LEU  94           HA       LEU  94  -4.663   4.885 -12.028
  693   1HB   LEU  94          1HB       LEU  94  -5.872   3.214 -10.797
  694   2HB   LEU  94          2HB       LEU  94  -4.772   3.354  -9.436
  695    HG   LEU  94           HG       LEU  94  -5.774   5.659  -8.951
  696   1HD1  LEU  94          1HD11     LEU  94  -7.679   4.689 -11.127
  697   2HD1  LEU  94          3HD13     LEU  94  -7.988   6.087 -10.074
  698   3HD1  LEU  94          2HD12     LEU  94  -6.649   6.124 -11.227
  699   1HD2  LEU  94          3HD23     LEU  94  -7.629   3.247  -8.965
  700   2HD2  LEU  94          1HD21     LEU  94  -6.426   3.648  -7.722
  701   3HD2  LEU  94          2HD22     LEU  94  -7.815   4.700  -7.962
  702    H    VAL  95           HN       VAL  95  -4.880   7.100 -11.173
  703    HA   VAL  95           HA       VAL  95  -2.726   7.972  -9.333
  704    HB   VAL  95           HB       VAL  95  -2.459   9.968 -10.707
  705   1HG1  VAL  95          2HG22     VAL  95  -0.990   7.999 -11.082
  706   2HG1  VAL  95          3HG23     VAL  95  -2.072   7.447 -12.376
  707   3HG1  VAL  95          1HG21     VAL  95  -1.206   8.984 -12.537
  708   1HG2  VAL  95          3HG13     VAL  95  -4.692  10.071 -11.787
  709   2HG2  VAL  95          1HG11     VAL  95  -3.384  10.120 -12.974
  710   3HG2  VAL  95          2HG12     VAL  95  -4.301   8.622 -12.739
  711    H    GLY  96           HN       GLY  96  -3.158   9.976  -8.237
  712   1HA   GLY  96          1HA       GLY  96  -4.447  11.657  -7.326
  713   2HA   GLY  96          2HA       GLY  96  -5.806  11.201  -8.374
  714    H    ALA  97           HN       ALA  97  -6.588  11.861  -5.978
  715    HA   ALA  97           HA       ALA  97  -6.551   9.716  -4.006
  716   1HB   ALA  97          3HB       ALA  97  -6.638  12.184  -3.468
  717   2HB   ALA  97          2HB       ALA  97  -8.265  12.239  -4.169
  718   3HB   ALA  97          1HB       ALA  97  -7.955  11.255  -2.722
  719    H    SER  98           HN       SER  98  -7.472   8.717  -6.440
  720    HA   SER  98           HA       SER  98 -10.344   8.688  -6.681
  721   1HB   SER  98          1HB       SER  98  -8.198   6.935  -7.928
  722   2HB   SER  98          2HB       SER  98  -9.818   7.277  -8.583
  723    HG   SER  98           HG       SER  98  -7.570   8.637  -9.014
  724    H    GLN  99           HN       GLN  99 -10.181   8.016  -4.202
  725    HA   GLN  99           HA       GLN  99  -9.540   5.488  -3.239
  726   1HB   GLN  99          2HB       GLN  99 -11.740   7.444  -2.516
  727   2HB   GLN  99          1HB       GLN  99 -11.368   6.019  -1.531
  728   1HG   GLN  99          1HG       GLN  99  -9.328   6.807  -0.829
  729   2HG   GLN  99          2HG       GLN  99  -9.023   7.766  -2.274
  730   1HE2  GLN  99          2HE22     GLN  99 -10.694  10.679  -1.104
  731   2HE2  GLN  99          1HE21     GLN  99 -10.152   9.850  -2.562
  732    H    ASP 100           HN       ASP 100 -12.528   6.438  -4.948
  733    HA   ASP 100           HA       ASP 100 -14.012   4.025  -4.527
  734   1HB   ASP 100          2HB       ASP 100 -15.338   4.804  -6.419
  735   2HB   ASP 100          1HB       ASP 100 -15.007   6.155  -5.330
  736    H    LYS 101           HN       LYS 101 -11.784   5.125  -7.103
  737    HA   LYS 101           HA       LYS 101 -12.014   2.634  -8.559
  738   1HB   LYS 101          1HB       LYS 101 -11.574   4.970  -9.439
  739   2HB   LYS 101          2HB       LYS 101  -9.891   4.780  -8.946
  740   1HG   LYS 101          1HG       LYS 101  -9.555   2.974 -10.477
  741   2HG   LYS 101          2HG       LYS 101 -11.273   2.680 -10.681
  742   1HD   LYS 101          1HD       LYS 101  -9.809   5.167 -11.686
  743   2HD   LYS 101          2HD       LYS 101 -10.245   3.760 -12.661
  744   1HE   LYS 101          1HE       LYS 101 -12.130   5.797 -11.388
  745   2HE   LYS 101          2HE       LYS 101 -11.835   5.494 -13.097
  746   1HZ   LYS 101          1HZ       LYS 101 -12.801   3.317 -12.813
  747   2HZ   LYS 101          2HZ       LYS 101 -13.112   3.635 -11.224
  748   3HZ   LYS 101          3HZ       LYS 101 -13.860   4.511 -12.397
  749    H    LEU 102           HN       LEU 102  -9.934   3.891  -6.003
  750    HA   LEU 102           HA       LEU 102  -7.870   1.956  -6.085
  751   1HB   LEU 102          2HB       LEU 102  -8.272   4.071  -4.504
  752   2HB   LEU 102          1HB       LEU 102  -9.030   2.882  -3.443
  753    HG   LEU 102           HG       LEU 102  -6.182   3.106  -4.413
  754   1HD1  LEU 102          1HD11     LEU 102  -7.520   3.108  -1.663
  755   2HD1  LEU 102          2HD12     LEU 102  -5.784   3.259  -1.940
  756   3HD1  LEU 102          3HD13     LEU 102  -6.875   4.523  -2.524
  757   1HD2  LEU 102          1HD21     LEU 102  -7.320   0.790  -2.800
  758   2HD2  LEU 102          2HD22     LEU 102  -6.670   0.697  -4.461
  759   3HD2  LEU 102          3HD23     LEU 102  -5.600   1.113  -3.134
  760    H    LYS 103           HN       LYS 103 -11.021   1.975  -4.276
  761    HA   LYS 103           HA       LYS 103 -10.927  -0.653  -3.259
  762   1HB   LYS 103          1HB       LYS 103 -13.286   1.036  -4.205
  763   2HB   LYS 103          2HB       LYS 103 -13.431  -0.466  -3.300
  764   1HG   LYS 103          2HG       LYS 103 -12.331   0.451  -1.381
  765   2HG   LYS 103          1HG       LYS 103 -11.867   1.917  -2.256
  766   1HD   LYS 103          2HD       LYS 103 -14.301   2.462  -2.582
  767   2HD   LYS 103          1HD       LYS 103 -14.724   1.027  -1.638
  768   1HE   LYS 103          2HE       LYS 103 -14.865   3.036  -0.251
  769   2HE   LYS 103          1HE       LYS 103 -13.571   1.990   0.347
  770   1HZ   LYS 103          2HZ       LYS 103 -13.209   4.343  -1.379
  771   2HZ   LYS 103          3HZ       LYS 103 -12.929   4.293   0.244
  772   3HZ   LYS 103          1HZ       LYS 103 -12.002   3.396  -0.781
  773    H    ALA 104           HN       ALA 104 -12.263   0.560  -6.377
  774    HA   ALA 104           HA       ALA 104 -13.088  -1.904  -7.429
  775   1HB   ALA 104          3HB       ALA 104 -13.524   0.349  -8.445
  776   2HB   ALA 104          1HB       ALA 104 -11.848   0.361  -9.046
  777   3HB   ALA 104          2HB       ALA 104 -12.978  -0.876  -9.607
  778    H    LEU 105           HN       LEU 105  -9.785  -0.403  -7.658
  779    HA   LEU 105           HA       LEU 105  -8.609  -2.458  -9.217
  780   1HB   LEU 105          1HB       LEU 105  -7.410  -0.673  -7.052
  781   2HB   LEU 105          2HB       LEU 105  -6.467  -1.861  -7.924
  782    HG   LEU 105           HG       LEU 105  -7.883   0.461  -9.275
  783   1HD1  LEU 105          1HD21     LEU 105  -4.997   0.008  -8.358
  784   2HD1  LEU 105          3HD23     LEU 105  -5.522   1.308  -9.431
  785   3HD1  LEU 105          2HD22     LEU 105  -6.118   1.248  -7.756
  786   1HD2  LEU 105          1HD11     LEU 105  -5.761  -1.513 -10.244
  787   2HD2  LEU 105          3HD13     LEU 105  -7.443  -1.432 -10.824
  788   3HD2  LEU 105          2HD12     LEU 105  -6.331  -0.092 -11.136
  789    H    VAL 106           HN       VAL 106  -8.727  -2.126  -5.596
  790    HA   VAL 106           HA       VAL 106  -7.336  -4.573  -5.212
  791    HB   VAL 106           HB       VAL 106  -9.418  -3.561  -3.227
  792   1HG1  VAL 106          2HG22     VAL 106  -8.296  -5.802  -2.866
  793   2HG1  VAL 106          3HG23     VAL 106  -6.726  -4.995  -2.967
  794   3HG1  VAL 106          1HG21     VAL 106  -7.831  -4.612  -1.642
  795   1HG2  VAL 106          1HG11     VAL 106  -6.594  -2.537  -3.738
  796   2HG2  VAL 106          2HG12     VAL 106  -8.094  -1.599  -3.608
  797   3HG2  VAL 106          3HG13     VAL 106  -7.421  -2.358  -2.176
  798    H    ALA 107           HN       ALA 107 -10.843  -3.961  -5.416
  799    HA   ALA 107           HA       ALA 107 -11.735  -6.612  -4.987
  800   1HB   ALA 107          3HB       ALA 107 -13.235  -4.653  -5.085
  801   2HB   ALA 107          1HB       ALA 107 -12.930  -4.482  -6.824
  802   3HB   ALA 107          2HB       ALA 107 -13.764  -5.922  -6.206
  803    H    LYS 108           HN       LYS 108 -11.016  -5.005  -8.117
  804    HA   LYS 108           HA       LYS 108 -11.457  -7.205  -9.836
  805   1HB   LYS 108          2HB       LYS 108 -11.253  -5.011 -10.737
  806   2HB   LYS 108          1HB       LYS 108  -9.721  -4.703  -9.916
  807   1HG   LYS 108          1HG       LYS 108  -8.522  -6.249 -11.378
  808   2HG   LYS 108          2HG       LYS 108  -9.997  -6.632 -12.254
  809   1HD   LYS 108          2HD       LYS 108  -8.722  -3.861 -12.006
  810   2HD   LYS 108          1HD       LYS 108  -8.495  -4.973 -13.363
  811   1HE   LYS 108          2HE       LYS 108 -10.969  -4.898 -13.803
  812   2HE   LYS 108          1HE       LYS 108 -11.126  -3.667 -12.534
  813   1HZ   LYS 108          2HZ       LYS 108  -9.627  -2.287 -13.769
  814   2HZ   LYS 108          3HZ       LYS 108  -9.495  -3.421 -14.957
  815   3HZ   LYS 108          1HZ       LYS 108 -10.943  -2.686 -14.678
  816    H    HIS 109           HN       HIS 109  -8.367  -6.077  -8.424
  817    HA   HIS 109           HA       HIS 109  -6.954  -8.277  -9.682
  818   1HB   HIS 109          1HB       HIS 109  -6.134  -6.075  -7.760
  819   2HB   HIS 109          2HB       HIS 109  -5.020  -7.275  -8.422
  820    HD2  HIS 109           HD2      HIS 109  -6.694  -3.998  -9.549
  821    HE1  HIS 109           HE1      HIS 109  -5.076  -5.782 -13.006
  822    HE2  HIS 109           HE2      HIS 109  -6.140  -3.676 -12.080
  823    H    ALA 110           HN       ALA 110  -8.427  -7.890  -6.456
  824    HA   ALA 110           HA       ALA 110  -7.066 -10.318  -5.472
  825   1HB   ALA 110          3HB       ALA 110  -7.668  -8.382  -3.977
  826   2HB   ALA 110          1HB       ALA 110  -9.381  -8.738  -4.287
  827   3HB   ALA 110          2HB       ALA 110  -8.361  -9.932  -3.461
  828    H    ALA 111           HN       ALA 111  -8.414 -10.779  -7.936
  829    HA   ALA 111           HA       ALA 111 -11.018 -11.871  -7.597
  830   1HB   ALA 111          1HB       ALA 111 -10.053 -11.288  -9.794
  831   2HB   ALA 111          3HB       ALA 111  -8.828 -12.565  -9.609
  832   3HB   ALA 111          2HB       ALA 111 -10.547 -12.990  -9.759
  833    H    ALA 112           HN       ALA 112  -7.803 -13.234  -6.925
  834    HA   ALA 112           HA       ALA 112  -8.775 -15.426  -5.453
  835   1HB   ALA 112          2HB       ALA 112  -7.520 -16.040  -8.178
  836   2HB   ALA 112          3HB       ALA 112  -7.821 -17.223  -6.887
  837   3HB   ALA 112          1HB       ALA 112  -9.188 -16.437  -7.698
   
  No H/Q in entry =         837
  Start of MODEL   14
    1   1H    GLY   1          2HN       GLY   1  -2.016  -5.289   8.192
    2   2H    GLY   1          1HN       GLY   1  -3.549  -5.265   8.853
    3   3H    GLY   1          3HN       GLY   1  -2.179  -5.518   9.787
    4   1HA   GLY   1          1HA       GLY   1  -3.158  -7.622   9.559
    5   2HA   GLY   1          2HA       GLY   1  -3.342  -7.343   7.816
    6    H    GLY   2           HN       GLY   2  -2.047  -9.360   7.473
    7   1HA   GLY   2          1HA       GLY   2   0.740  -9.450   8.304
    8   2HA   GLY   2          2HA       GLY   2  -0.070 -10.518   7.143
    9    H    SER   3           HN       SER   3  -0.161  -9.886   4.888
   10    HA   SER   3           HA       SER   3   1.846  -8.039   3.961
   11   1HB   SER   3          1HB       SER   3  -0.417  -9.349   2.394
   12   2HB   SER   3          2HB       SER   3   1.172  -8.816   1.817
   13    HG   SER   3           HG       SER   3   1.025 -11.119   2.233
   14    H    VAL   4           HN       VAL   4   0.298  -6.538   5.588
   15    HA   VAL   4           HA       VAL   4  -0.967  -4.501   3.949
   16    HB   VAL   4           HB       VAL   4  -2.456  -6.096   6.104
   17   1HG1  VAL   4          1HG21     VAL   4  -2.939  -3.400   4.857
   18   2HG1  VAL   4          3HG23     VAL   4  -4.304  -4.386   5.441
   19   3HG1  VAL   4          2HG22     VAL   4  -3.048  -3.865   6.558
   20   1HG2  VAL   4          3HG13     VAL   4  -3.187  -5.673   3.213
   21   2HG2  VAL   4          1HG11     VAL   4  -2.685  -7.212   3.950
   22   3HG2  VAL   4          2HG12     VAL   4  -4.193  -6.462   4.441
   23    H    ILE   5           HN       ILE   5   0.838  -3.242   4.774
   24    HA   ILE   5           HA       ILE   5   0.612  -2.460   7.600
   25    HB   ILE   5           HB       ILE   5   3.162  -2.619   7.776
   26   1HG1  ILE   5          1HG11     ILE   5   2.817  -4.631   5.504
   27   2HG1  ILE   5          2HG12     ILE   5   3.551  -3.039   5.321
   28   1HG2  ILE   5          2HG22     ILE   5   1.518  -4.147   8.939
   29   2HG2  ILE   5          1HG21     ILE   5   1.736  -5.308   7.614
   30   3HG2  ILE   5          3HG23     ILE   5   3.103  -4.864   8.649
   31   1HD1  ILE   5          1HD11     ILE   5   5.272  -3.711   7.058
   32   2HD1  ILE   5          3HD13     ILE   5   4.601  -5.358   6.986
   33   3HD1  ILE   5          2HD12     ILE   5   5.320  -4.635   5.542
   34    H    VAL   6           HN       VAL   6   1.451  -0.473   8.024
   35    HA   VAL   6           HA       VAL   6   1.489   1.395   5.783
   36    HB   VAL   6           HB       VAL   6   0.197   1.762   7.822
   37   1HG1  VAL   6          3HG23     VAL   6   1.765   0.828   9.534
   38   2HG1  VAL   6          2HG22     VAL   6   2.774   2.275   9.356
   39   3HG1  VAL   6          1HG21     VAL   6   1.111   2.419   9.926
   40   1HG2  VAL   6          3HG13     VAL   6   0.775   3.668   6.450
   41   2HG2  VAL   6          1HG11     VAL   6   0.719   4.116   8.159
   42   3HG2  VAL   6          2HG12     VAL   6   2.284   3.917   7.356
   43    H    ILE   7           HN       ILE   7   3.466  -0.085   5.195
   44    HA   ILE   7           HA       ILE   7   6.003   0.692   6.444
   45    HB   ILE   7           HB       ILE   7   5.331  -1.634   5.749
   46   1HG1  ILE   7          1HG11     ILE   7   7.344  -2.447   4.981
   47   2HG1  ILE   7          2HG12     ILE   7   7.881  -0.945   4.253
   48   1HG2  ILE   7          1HG21     ILE   7   4.247  -1.018   3.557
   49   2HG2  ILE   7          3HG23     ILE   7   5.851  -0.643   2.901
   50   3HG2  ILE   7          2HG22     ILE   7   5.457  -2.296   3.395
   51   1HD1  ILE   7          1HD11     ILE   7   7.421  -1.383   7.247
   52   2HD1  ILE   7          2HD12     ILE   7   8.993  -1.501   6.438
   53   3HD1  ILE   7          3HD13     ILE   7   8.162   0.057   6.502
   54    H    ASP   8           HN       ASP   8   7.790   0.876   4.489
   55    HA   ASP   8           HA       ASP   8   7.092   2.454   2.204
   56   1HB   ASP   8          2HB       ASP   8   6.923   4.319   3.760
   57   2HB   ASP   8          1HB       ASP   8   8.423   3.842   4.576
   58    H    SER   9           HN       SER   9   9.638   1.769   4.576
   59    HA   SER   9           HA       SER   9  11.930   1.942   3.417
   60   1HB   SER   9          2HB       SER   9  11.160  -0.613   4.870
   61   2HB   SER   9          1HB       SER   9  12.684   0.295   4.971
   62    HG   SER   9           HG       SER   9  11.302   0.763   6.751
   63    H    LYS  10           HN       LYS  10  12.690   1.496   1.458
   64    HA   LYS  10           HA       LYS  10  11.841  -0.094  -0.528
   65   1HB   LYS  10          1HB       LYS  10  13.842   1.573  -0.307
   66   2HB   LYS  10          2HB       LYS  10  14.834   0.148  -0.010
   67   1HG   LYS  10          2HG       LYS  10  13.068   0.647  -2.457
   68   2HG   LYS  10          1HG       LYS  10  14.796   1.004  -2.360
   69   1HD   LYS  10          1HD       LYS  10  15.259  -1.431  -1.956
   70   2HD   LYS  10          2HD       LYS  10  13.534  -1.764  -2.192
   71   1HE   LYS  10          1HE       LYS  10  13.619  -0.829  -4.466
   72   2HE   LYS  10          2HE       LYS  10  15.348  -0.472  -4.267
   73   1HZ   LYS  10          1HZ       LYS  10  14.134  -3.147  -4.149
   74   2HZ   LYS  10          2HZ       LYS  10  14.980  -2.524  -5.422
   75   3HZ   LYS  10          3HZ       LYS  10  15.732  -2.806  -3.982
   76    H    ALA  11           HN       ALA  11  14.268  -1.192   1.889
   77    HA   ALA  11           HA       ALA  11  14.594  -3.831   0.984
   78   1HB   ALA  11          2HB       ALA  11  16.002  -2.773   2.712
   79   2HB   ALA  11          1HB       ALA  11  14.638  -2.789   3.855
   80   3HB   ALA  11          3HB       ALA  11  15.345  -4.317   3.287
   81    H    ALA  12           HN       ALA  12  12.007  -2.486   3.063
   82    HA   ALA  12           HA       ALA  12  10.916  -5.119   3.735
   83   1HB   ALA  12          3HB       ALA  12  10.723  -3.193   5.282
   84   2HB   ALA  12          2HB       ALA  12   9.714  -2.357   4.076
   85   3HB   ALA  12          1HB       ALA  12   9.154  -3.875   4.814
   86    H    TRP  13           HN       TRP  13  10.419  -2.544   1.327
   87    HA   TRP  13           HA       TRP  13   8.015  -3.603   0.148
   88   1HB   TRP  13          2HB       TRP  13   8.310  -1.564  -0.727
   89   2HB   TRP  13          1HB       TRP  13  10.027  -1.551  -0.468
   90    HD1  TRP  13           HD1      TRP  13  11.509  -2.914  -2.438
   91    HE1  TRP  13           HE1      TRP  13  11.267  -2.761  -4.967
   92    HE3  TRP  13           HE3      TRP  13   6.762  -1.010  -2.676
   93    HZ2  TRP  13           HZ2      TRP  13   9.371  -1.784  -6.842
   94    HZ3  TRP  13           HZ3      TRP  13   5.827  -0.357  -4.864
   95    HH2  TRP  13           HH2      TRP  13   7.134  -0.689  -6.951
   96    H    ASP  14           HN       ASP  14  11.499  -4.154  -0.546
   97    HA   ASP  14           HA       ASP  14  11.119  -6.126  -2.559
   98   1HB   ASP  14          1HB       ASP  14  13.369  -5.938  -0.521
   99   2HB   ASP  14          2HB       ASP  14  13.394  -6.914  -1.984
  100    H    ALA  15           HN       ALA  15  11.533  -6.447   0.963
  101    HA   ALA  15           HA       ALA  15  11.333  -9.235   1.171
  102   1HB   ALA  15          2HB       ALA  15  11.849  -7.700   3.076
  103   2HB   ALA  15          1HB       ALA  15  10.132  -7.243   3.145
  104   3HB   ALA  15          3HB       ALA  15  10.614  -8.912   3.466
  105    H    GLN  16           HN       GLN  16   8.676  -6.866   1.294
  106    HA   GLN  16           HA       GLN  16   6.453  -8.594   1.428
  107   1HB   GLN  16          1HB       GLN  16   6.922  -5.782   0.735
  108   2HB   GLN  16          2HB       GLN  16   5.725  -6.489  -0.330
  109   1HG   GLN  16          2HG       GLN  16   4.706  -5.464   1.661
  110   2HG   GLN  16          1HG       GLN  16   4.330  -7.180   1.487
  111   1HE2  GLN  16          1HE21     GLN  16   7.092  -6.393   4.454
  112   2HE2  GLN  16          2HE22     GLN  16   7.406  -5.772   2.843
  113    H    LEU  17           HN       LEU  17   8.119  -7.322  -1.456
  114    HA   LEU  17           HA       LEU  17   6.655  -8.685  -3.427
  115   1HB   LEU  17          2HB       LEU  17   9.307  -7.280  -3.224
  116   2HB   LEU  17          1HB       LEU  17   9.194  -8.475  -4.511
  117    HG   LEU  17           HG       LEU  17   7.068  -7.491  -5.233
  118   1HD1  LEU  17          3HD13     LEU  17   6.469  -6.185  -3.176
  119   2HD1  LEU  17          1HD11     LEU  17   7.849  -5.108  -3.492
  120   3HD1  LEU  17          2HD12     LEU  17   6.493  -5.168  -4.624
  121   1HD2  LEU  17          3HD23     LEU  17   9.148  -7.020  -6.433
  122   2HD2  LEU  17          2HD22     LEU  17   8.088  -5.602  -6.463
  123   3HD2  LEU  17          1HD21     LEU  17   9.480  -5.639  -5.359
  124    H    ALA  18           HN       ALA  18   8.789 -10.112  -1.194
  125    HA   ALA  18           HA       ALA  18   8.994 -12.618  -2.841
  126   1HB   ALA  18          1HB       ALA  18  10.603 -11.717  -0.412
  127   2HB   ALA  18          2HB       ALA  18  10.796 -13.243  -1.301
  128   3HB   ALA  18          3HB       ALA  18  11.139 -11.696  -2.103
  129    H    LYS  19           HN       LYS  19   8.594 -11.686   0.630
  130    HA   LYS  19           HA       LYS  19   7.549 -14.217   1.417
  131   1HB   LYS  19          1HB       LYS  19   6.849 -13.067   3.489
  132   2HB   LYS  19          2HB       LYS  19   8.526 -12.762   3.048
  133   1HG   LYS  19          2HG       LYS  19   8.209 -10.576   3.088
  134   2HG   LYS  19          1HG       LYS  19   6.945 -10.679   1.859
  135   1HD   LYS  19          2HD       LYS  19   6.403 -11.112   4.827
  136   2HD   LYS  19          1HD       LYS  19   6.353  -9.533   4.037
  137   1HE   LYS  19          1HE       LYS  19   4.658 -10.463   2.390
  138   2HE   LYS  19          2HE       LYS  19   4.564 -11.916   3.406
  139   1HZ   LYS  19          2HZ       LYS  19   4.018  -9.157   4.263
  140   2HZ   LYS  19          3HZ       LYS  19   2.876 -10.300   3.914
  141   3HZ   LYS  19          1HZ       LYS  19   3.879 -10.502   5.211
  142    H    GLY  20           HN       GLY  20   5.909 -11.543  -0.223
  143   1HA   GLY  20          1HA       GLY  20   3.267 -12.140   0.630
  144   2HA   GLY  20          2HA       GLY  20   3.747 -11.379  -0.894
  145    H    LYS  21           HN       LYS  21   5.462 -13.929  -1.462
  146    HA   LYS  21           HA       LYS  21   5.298 -15.900  -2.545
  147   1HB   LYS  21          2HB       LYS  21   2.519 -16.225  -1.333
  148   2HB   LYS  21          1HB       LYS  21   3.453 -17.453  -2.154
  149   1HG   LYS  21          2HG       LYS  21   5.102 -17.587  -0.516
  150   2HG   LYS  21          1HG       LYS  21   4.663 -16.076   0.269
  151   1HD   LYS  21          1HD       LYS  21   2.624 -18.314   0.182
  152   2HD   LYS  21          2HD       LYS  21   3.974 -18.396   1.318
  153   1HE   LYS  21          2HE       LYS  21   2.065 -17.387   2.429
  154   2HE   LYS  21          1HE       LYS  21   3.387 -16.218   2.296
  155   1HZ   LYS  21          2HZ       LYS  21   1.034 -16.337   0.545
  156   2HZ   LYS  21          1HZ       LYS  21   1.273 -15.261   1.771
  157   3HZ   LYS  21          3HZ       LYS  21   2.246 -15.228   0.444
  158    H    GLU  22           HN       GLU  22   5.255 -14.053  -4.062
  159    HA   GLU  22           HA       GLU  22   3.045 -13.324  -5.681
  160   1HB   GLU  22          2HB       GLU  22   6.084 -13.146  -5.923
  161   2HB   GLU  22          1HB       GLU  22   5.006 -12.513  -7.156
  162   1HG   GLU  22          1HG       GLU  22   5.698 -10.744  -5.690
  163   2HG   GLU  22          2HG       GLU  22   3.945 -10.988  -5.622
  164    H    GLU  23           HN       GLU  23   2.614 -15.863  -5.679
  165    HA   GLU  23           HA       GLU  23   3.673 -17.259  -8.047
  166   1HB   GLU  23          1HB       GLU  23   1.391 -17.934  -6.125
  167   2HB   GLU  23          2HB       GLU  23   2.038 -18.997  -7.385
  168   1HG   GLU  23          2HG       GLU  23   4.239 -19.018  -6.274
  169   2HG   GLU  23          1HG       GLU  23   3.658 -17.899  -5.032
  170    H    HIS  24           HN       HIS  24   0.585 -15.887  -6.927
  171    HA   HIS  24           HA       HIS  24  -0.114 -14.790  -9.505
  172   1HB   HIS  24          2HB       HIS  24  -0.799 -17.088  -9.953
  173   2HB   HIS  24          1HB       HIS  24  -1.716 -17.143  -8.442
  174    HD2  HIS  24           HD2      HIS  24  -2.114 -13.921 -10.621
  175    HE1  HIS  24           HE1      HIS  24  -5.624 -16.245 -10.996
  176    HE2  HIS  24           HE2      HIS  24  -4.588 -13.993 -11.523
  177    H    LYS  25           HN       LYS  25   0.164 -13.023  -7.828
  178    HA   LYS  25           HA       LYS  25  -2.450 -12.522  -6.534
  179   1HB   LYS  25          1HB       LYS  25   0.056 -11.984  -4.942
  180   2HB   LYS  25          2HB       LYS  25  -1.605 -12.091  -4.400
  181   1HG   LYS  25          2HG       LYS  25  -1.618 -14.548  -4.769
  182   2HG   LYS  25          1HG       LYS  25   0.057 -14.464  -5.356
  183   1HD   LYS  25          2HD       LYS  25   0.071 -15.276  -3.139
  184   2HD   LYS  25          1HD       LYS  25   0.860 -13.691  -3.211
  185   1HE   LYS  25          1HE       LYS  25  -1.012 -12.617  -2.164
  186   2HE   LYS  25          2HE       LYS  25  -2.029 -14.066  -2.327
  187   1HZ   LYS  25          3HZ       LYS  25   0.434 -13.924  -0.745
  188   2HZ   LYS  25          1HZ       LYS  25  -1.090 -13.725  -0.132
  189   3HZ   LYS  25          2HZ       LYS  25  -0.641 -15.176  -0.792
  190    HA   PRO  26           HA       PRO  26  -1.378  -8.381  -7.896
  191   1HB   PRO  26          1HB       PRO  26  -3.373  -6.933  -6.781
  192   2HB   PRO  26          2HB       PRO  26  -3.693  -8.132  -8.072
  193   1HG   PRO  26          1HG       PRO  26  -3.805  -8.647  -5.081
  194   2HG   PRO  26          2HG       PRO  26  -5.174  -8.823  -6.213
  195   1HD   PRO  26          2HD       PRO  26  -3.545 -10.872  -5.465
  196   2HD   PRO  26          1HD       PRO  26  -3.949 -10.737  -7.208
  197    H    ILE  27           HN       ILE  27   0.275  -7.137  -7.160
  198    HA   ILE  27           HA       ILE  27   0.467  -6.551  -4.262
  199    HB   ILE  27           HB       ILE  27   2.386  -5.924  -6.507
  200   1HG1  ILE  27          2HG12     ILE  27   2.919  -7.862  -4.240
  201   2HG1  ILE  27          1HG11     ILE  27   2.132  -8.407  -5.727
  202   1HG2  ILE  27          1HG21     ILE  27   2.591  -5.548  -3.486
  203   2HG2  ILE  27          2HG22     ILE  27   3.918  -5.260  -4.624
  204   3HG2  ILE  27          3HG23     ILE  27   2.482  -4.252  -4.691
  205   1HD1  ILE  27          3HD13     ILE  27   4.819  -6.970  -5.663
  206   2HD1  ILE  27          1HD11     ILE  27   4.587  -8.713  -5.801
  207   3HD1  ILE  27          2HD12     ILE  27   4.000  -7.640  -7.087
  208    H    VAL  28           HN       VAL  28  -0.401  -4.608  -3.619
  209    HA   VAL  28           HA       VAL  28  -1.213  -2.652  -5.755
  210    HB   VAL  28           HB       VAL  28  -2.603  -3.204  -3.116
  211   1HG1  VAL  28          2HG12     VAL  28  -2.755  -0.866  -4.124
  212   2HG1  VAL  28          1HG11     VAL  28  -3.499  -1.589  -5.553
  213   3HG1  VAL  28          3HG13     VAL  28  -4.311  -1.703  -3.976
  214   1HG2  VAL  28          3HG23     VAL  28  -3.409  -3.991  -5.956
  215   2HG2  VAL  28          2HG22     VAL  28  -2.904  -5.114  -4.681
  216   3HG2  VAL  28          1HG21     VAL  28  -4.401  -4.189  -4.497
  217    H    VAL  29           HN       VAL  29  -0.007  -0.847  -5.636
  218    HA   VAL  29           HA       VAL  29   1.421  -0.284  -3.092
  219    HB   VAL  29           HB       VAL  29   2.078   0.942  -5.763
  220   1HG1  VAL  29          3HG23     VAL  29   3.022   1.859  -3.627
  221   2HG1  VAL  29          2HG22     VAL  29   3.694   0.251  -3.279
  222   3HG1  VAL  29          1HG21     VAL  29   4.260   1.176  -4.678
  223   1HG2  VAL  29          2HG12     VAL  29   3.033  -1.750  -4.738
  224   2HG2  VAL  29          1HG11     VAL  29   2.110  -1.436  -6.229
  225   3HG2  VAL  29          3HG13     VAL  29   3.760  -0.828  -6.078
  226    H    ASP  30           HN       ASP  30   0.638   1.355  -1.877
  227    HA   ASP  30           HA       ASP  30  -0.920   3.594  -3.089
  228   1HB   ASP  30          1HB       ASP  30  -1.875   2.802  -1.049
  229   2HB   ASP  30          2HB       ASP  30  -0.320   2.775  -0.222
  230    H    PHE  31           HN       PHE  31   0.759   4.499  -4.322
  231    HA   PHE  31           HA       PHE  31   3.250   5.426  -2.982
  232   1HB   PHE  31          1HB       PHE  31   2.172   5.559  -5.808
  233   2HB   PHE  31          2HB       PHE  31   3.567   6.471  -5.290
  234    HD1  PHE  31           HD1      PHE  31   5.561   5.156  -4.253
  235    HD2  PHE  31           HD2      PHE  31   2.475   3.356  -6.667
  236    HE1  PHE  31           HE1      PHE  31   7.236   3.647  -5.260
  237    HE2  PHE  31           HE2      PHE  31   4.172   1.843  -7.677
  238    HZ   PHE  31           HZ       PHE  31   6.550   2.026  -7.034
  239    H    THR  32           HN       THR  32   2.510   6.950  -1.487
  240    HA   THR  32           HA       THR  32   1.013   9.306  -2.575
  241    HB   THR  32           HB       THR  32  -0.469   8.028  -1.161
  242    HG1  THR  32           HG1      THR  32  -0.987   9.690   0.210
  243   1HG2  THR  32          2HG22     THR  32   1.635   8.337   1.031
  244   2HG2  THR  32          3HG23     THR  32  -0.023   7.721   1.229
  245   3HG2  THR  32          1HG21     THR  32   1.139   6.807   0.259
  246    H    ALA  33           HN       ALA  33   1.391  11.065  -0.644
  247    HA   ALA  33           HA       ALA  33   4.365  11.351  -0.323
  248   1HB   ALA  33          3HB       ALA  33   2.440  13.368  -1.525
  249   2HB   ALA  33          2HB       ALA  33   4.043  13.781  -0.878
  250   3HB   ALA  33          1HB       ALA  33   3.903  12.673  -2.247
  251    H    THR  34           HN       THR  34   4.682  11.420   1.833
  252    HA   THR  34           HA       THR  34   2.836  11.668   3.877
  253    HB   THR  34           HB       THR  34   5.003  12.646   5.100
  254    HG1  THR  34           HG1      THR  34   6.637  11.557   3.307
  255   1HG2  THR  34          3HG23     THR  34   4.806   9.899   3.808
  256   2HG2  THR  34          1HG21     THR  34   5.985  10.339   5.073
  257   3HG2  THR  34          2HG22     THR  34   4.246  10.386   5.416
  258    H    TRP  35           HN       TRP  35   4.892  14.325   2.682
  259    HA   TRP  35           HA       TRP  35   3.781  16.363   4.285
  260   1HB   TRP  35          1HB       TRP  35   4.711  17.896   2.487
  261   2HB   TRP  35          2HB       TRP  35   5.825  16.782   3.262
  262    HD1  TRP  35           HD1      TRP  35   7.096  15.065   1.818
  263    HE1  TRP  35           HE1      TRP  35   7.496  14.848  -0.699
  264    HE3  TRP  35           HE3      TRP  35   3.231  17.980   0.109
  265    HZ2  TRP  35           HZ2      TRP  35   6.164  15.603  -3.137
  266    HZ3  TRP  35           HZ3      TRP  35   2.789  18.149  -2.319
  267    HH2  TRP  35           HH2      TRP  35   4.236  16.959  -3.950
  268    H    CYS  36           HN       CYS  36   2.400  14.941   1.332
  269    HA   CYS  36           HA       CYS  36   0.582  17.244   0.920
  270   1HB   CYS  36          2HB       CYS  36   1.269  16.100  -1.078
  271   2HB   CYS  36          1HB       CYS  36   0.827  14.540  -0.390
  272    H    GLY  37           HN       GLY  37  -0.215  17.224   3.102
  273   1HA   GLY  37          1HA       GLY  37  -1.409  15.464   4.685
  274   2HA   GLY  37          2HA       GLY  37  -2.217  17.001   4.334
  275    HA   PRO  38           HA       PRO  38  -5.634  15.092   2.269
  276   1HB   PRO  38          2HB       PRO  38  -4.617  15.942  -0.455
  277   2HB   PRO  38          1HB       PRO  38  -6.273  16.078   0.203
  278   1HG   PRO  38          1HG       PRO  38  -4.670  18.258   0.186
  279   2HG   PRO  38          2HG       PRO  38  -5.598  17.873   1.668
  280   1HD   PRO  38          2HD       PRO  38  -2.690  17.271   1.080
  281   2HD   PRO  38          1HD       PRO  38  -3.417  17.959   2.561
  282    H    CYS  39           HN       CYS  39  -2.572  14.474   0.594
  283    HA   CYS  39           HA       CYS  39  -3.460  12.033  -0.727
  284   1HB   CYS  39          1HB       CYS  39  -0.588  12.822  -0.166
  285   2HB   CYS  39          2HB       CYS  39  -1.222  11.737  -1.389
  286    H    LYS  40           HN       LYS  40  -1.799  12.995   2.277
  287    HA   LYS  40           HA       LYS  40  -1.078  10.376   3.147
  288   1HB   LYS  40          2HB       LYS  40  -0.209  12.601   4.053
  289   2HB   LYS  40          1HB       LYS  40  -1.739  12.744   4.937
  290   1HG   LYS  40          2HG       LYS  40  -1.173  10.353   5.859
  291   2HG   LYS  40          1HG       LYS  40   0.464  10.694   5.290
  292   1HD   LYS  40          1HD       LYS  40  -1.180  12.345   7.277
  293   2HD   LYS  40          2HD       LYS  40   0.141  11.239   7.684
  294   1HE   LYS  40          1HE       LYS  40   1.718  12.661   6.366
  295   2HE   LYS  40          2HE       LYS  40   0.396  13.799   6.036
  296   1HZ   LYS  40          1HZ       LYS  40   0.192  14.155   8.378
  297   2HZ   LYS  40          3HZ       LYS  40   1.426  13.108   8.691
  298   3HZ   LYS  40          2HZ       LYS  40   1.717  14.503   7.863
  299    H    MET  41           HN       MET  41  -3.924  12.422   3.804
  300    HA   MET  41           HA       MET  41  -5.273  10.631   5.581
  301   1HB   MET  41          1HB       MET  41  -6.351  12.780   3.681
  302   2HB   MET  41          2HB       MET  41  -7.331  11.932   4.893
  303   1HG   MET  41          1HG       MET  41  -5.658  12.624   6.628
  304   2HG   MET  41          2HG       MET  41  -4.942  13.723   5.462
  305   1HE   MET  41          2HE       MET  41  -6.111  15.863   4.520
  306   2HE   MET  41          1HE       MET  41  -7.494  14.903   3.921
  307   3HE   MET  41          3HE       MET  41  -7.775  16.349   4.915
  308    H    ILE  42           HN       ILE  42  -4.948  10.346   2.150
  309    HA   ILE  42           HA       ILE  42  -7.188   8.452   1.937
  310    HB   ILE  42           HB       ILE  42  -4.957   9.322   0.076
  311   1HG1  ILE  42          2HG12     ILE  42  -8.001   9.600  -0.073
  312   2HG1  ILE  42          1HG11     ILE  42  -6.975  10.817   0.688
  313   1HG2  ILE  42          1HG21     ILE  42  -7.155   7.260  -0.399
  314   2HG2  ILE  42          2HG22     ILE  42  -6.144   7.975  -1.675
  315   3HG2  ILE  42          3HG23     ILE  42  -5.401   6.977  -0.428
  316   1HD1  ILE  42          1HD11     ILE  42  -5.775  11.191  -1.416
  317   2HD1  ILE  42          3HD13     ILE  42  -6.836  10.006  -2.224
  318   3HD1  ILE  42          2HD12     ILE  42  -7.515  11.499  -1.557
  319    H    ALA  43           HN       ALA  43  -3.807   8.257   2.911
  320    HA   ALA  43           HA       ALA  43  -3.323   5.549   2.334
  321   1HB   ALA  43          1HB       ALA  43  -1.601   7.165   3.079
  322   2HB   ALA  43          3HB       ALA  43  -2.262   7.123   4.726
  323   3HB   ALA  43          2HB       ALA  43  -1.579   5.657   4.014
  324    HA   PRO  44           HA       PRO  44  -5.122   4.271   6.628
  325   1HB   PRO  44          1HB       PRO  44  -7.152   5.810   7.717
  326   2HB   PRO  44          2HB       PRO  44  -5.433   5.876   8.195
  327   1HG   PRO  44          1HG       PRO  44  -6.878   7.649   6.232
  328   2HG   PRO  44          2HG       PRO  44  -5.779   8.149   7.549
  329   1HD   PRO  44          2HD       PRO  44  -4.856   7.976   5.054
  330   2HD   PRO  44          1HD       PRO  44  -3.864   7.326   6.376
  331    H    LEU  45           HN       LEU  45  -7.157   6.083   4.325
  332    HA   LEU  45           HA       LEU  45  -9.436   4.300   4.451
  333   1HB   LEU  45          2HB       LEU  45  -8.403   5.958   2.099
  334   2HB   LEU  45          1HB       LEU  45  -9.947   5.151   2.168
  335    HG   LEU  45           HG       LEU  45  -8.995   7.437   3.969
  336   1HD1  LEU  45          1HD11     LEU  45  -9.537   8.070   1.625
  337   2HD1  LEU  45          3HD13     LEU  45 -11.149   7.349   1.816
  338   3HD1  LEU  45          2HD12     LEU  45 -10.682   8.762   2.786
  339   1HD2  LEU  45          3HD23     LEU  45 -11.664   5.957   3.937
  340   2HD2  LEU  45          2HD22     LEU  45 -10.517   6.067   5.294
  341   3HD2  LEU  45          1HD21     LEU  45 -11.381   7.507   4.755
  342    H    PHE  46           HN       PHE  46  -6.595   4.444   2.305
  343    HA   PHE  46           HA       PHE  46  -7.087   2.040   0.851
  344   1HB   PHE  46          1HB       PHE  46  -5.486   3.737   0.203
  345   2HB   PHE  46          2HB       PHE  46  -4.515   3.487   1.639
  346    HD1  PHE  46           HD1      PHE  46  -3.185   1.434   2.026
  347    HD2  PHE  46           HD2      PHE  46  -5.128   2.228  -1.740
  348    HE1  PHE  46           HE1      PHE  46  -1.609  -0.094   0.888
  349    HE2  PHE  46           HE2      PHE  46  -3.577   0.706  -2.865
  350    HZ   PHE  46           HZ       PHE  46  -1.737  -0.412  -1.574
  351    H    GLU  47           HN       GLU  47  -5.273   2.527   3.960
  352    HA   GLU  47           HA       GLU  47  -4.596  -0.206   4.303
  353   1HB   GLU  47          1HB       GLU  47  -4.774   2.192   6.045
  354   2HB   GLU  47          2HB       GLU  47  -4.980   0.674   6.897
  355   1HG   GLU  47          1HG       GLU  47  -2.643   1.259   5.033
  356   2HG   GLU  47          2HG       GLU  47  -2.605   1.481   6.788
  357    H    THR  48           HN       THR  48  -7.571   1.582   5.258
  358    HA   THR  48           HA       THR  48  -8.825  -0.547   6.643
  359    HB   THR  48           HB       THR  48 -10.212   1.551   4.909
  360    HG1  THR  48           HG1      THR  48  -8.763   2.478   6.453
  361   1HG2  THR  48          2HG22     THR  48 -11.126  -0.006   7.365
  362   2HG2  THR  48          3HG23     THR  48 -12.034   1.281   6.549
  363   3HG2  THR  48          1HG21     THR  48 -11.718  -0.245   5.705
  364    H    LEU  49           HN       LEU  49  -8.908   0.310   3.135
  365    HA   LEU  49           HA       LEU  49 -10.460  -1.943   2.325
  366   1HB   LEU  49          1HB       LEU  49  -9.905   0.094   0.920
  367   2HB   LEU  49          2HB       LEU  49  -8.255  -0.522   0.759
  368    HG   LEU  49           HG       LEU  49  -9.247  -2.573  -0.355
  369   1HD1  LEU  49          1HD21     LEU  49 -11.741  -0.821  -0.108
  370   2HD1  LEU  49          3HD23     LEU  49 -11.604  -2.129  -1.294
  371   3HD1  LEU  49          2HD22     LEU  49 -11.544  -2.500   0.437
  372   1HD2  LEU  49          3HD13     LEU  49  -8.249  -0.683  -1.608
  373   2HD2  LEU  49          2HD12     LEU  49  -9.610  -1.403  -2.483
  374   3HD2  LEU  49          1HD11     LEU  49  -9.823   0.139  -1.625
  375    H    SER  50           HN       SER  50  -6.955  -1.471   2.710
  376    HA   SER  50           HA       SER  50  -6.051  -3.844   1.587
  377   1HB   SER  50          2HB       SER  50  -4.810  -2.411   3.955
  378   2HB   SER  50          1HB       SER  50  -4.020  -3.542   2.860
  379    HG   SER  50           HG       SER  50  -5.181  -1.135   1.928
  380    H    ASN  51           HN       ASN  51  -7.009  -3.233   4.954
  381    HA   ASN  51           HA       ASN  51  -6.325  -5.917   5.803
  382   1HB   ASN  51          1HB       ASN  51  -8.040  -3.764   7.087
  383   2HB   ASN  51          2HB       ASN  51  -7.693  -5.331   7.828
  384   1HD2  ASN  51          2HD22     ASN  51  -4.717  -2.463   7.645
  385   2HD2  ASN  51          1HD21     ASN  51  -6.232  -2.267   6.806
  386    H    ASP  52           HN       ASP  52  -8.970  -4.847   3.820
  387    HA   ASP  52           HA       ASP  52 -10.823  -6.926   4.733
  388   1HB   ASP  52          1HB       ASP  52 -11.689  -4.891   3.667
  389   2HB   ASP  52          2HB       ASP  52 -10.803  -5.255   2.177
  390    H    TYR  53           HN       TYR  53  -8.946  -6.451   1.640
  391    HA   TYR  53           HA       TYR  53  -9.182  -9.304   1.020
  392   1HB   TYR  53          1HB       TYR  53  -7.527  -7.171  -0.355
  393   2HB   TYR  53          2HB       TYR  53  -7.998  -8.739  -0.960
  394    HD1  TYR  53           HD1      TYR  53  -9.226  -5.341  -0.082
  395    HD2  TYR  53           HD2      TYR  53  -9.777  -8.906  -2.432
  396    HE1  TYR  53           HE1      TYR  53 -10.489  -4.061  -1.741
  397    HE2  TYR  53           HE2      TYR  53 -11.045  -7.600  -4.089
  398    HH   TYR  53           HH       TYR  53 -11.791  -4.131  -3.658
  399    H    ALA  54           HN       ALA  54  -7.818  -8.909   3.498
  400    HA   ALA  54           HA       ALA  54  -5.015  -8.519   3.223
  401   1HB   ALA  54          1HB       ALA  54  -6.206  -8.292   5.370
  402   2HB   ALA  54          2HB       ALA  54  -6.595 -10.026   5.366
  403   3HB   ALA  54          3HB       ALA  54  -4.906  -9.489   5.519
  404    H    GLY  55           HN       GLY  55  -3.291 -10.036   3.248
  405   1HA   GLY  55          1HA       GLY  55  -2.209 -12.059   2.986
  406   2HA   GLY  55          2HA       GLY  55  -3.757 -12.911   3.129
  407    H    LYS  56           HN       LYS  56  -5.304 -12.325   1.130
  408    HA   LYS  56           HA       LYS  56  -4.067 -13.532  -1.133
  409   1HB   LYS  56          1HB       LYS  56  -6.443 -13.763  -0.798
  410   2HB   LYS  56          2HB       LYS  56  -6.687 -12.012  -0.845
  411   1HG   LYS  56          1HG       LYS  56  -7.406 -13.114  -2.929
  412   2HG   LYS  56          2HG       LYS  56  -6.147 -11.916  -3.211
  413   1HD   LYS  56          1HD       LYS  56  -4.445 -13.790  -3.345
  414   2HD   LYS  56          2HD       LYS  56  -5.771 -14.945  -3.123
  415   1HE   LYS  56          2HE       LYS  56  -6.814 -14.081  -5.226
  416   2HE   LYS  56          1HE       LYS  56  -5.507 -12.891  -5.385
  417   1HZ   LYS  56          3HZ       LYS  56  -5.136 -15.799  -5.428
  418   2HZ   LYS  56          1HZ       LYS  56  -5.180 -14.816  -6.747
  419   3HZ   LYS  56          2HZ       LYS  56  -3.962 -14.664  -5.663
  420    H    VAL  57           HN       VAL  57  -4.949 -10.056  -0.497
  421    HA   VAL  57           HA       VAL  57  -3.435  -9.328  -2.975
  422    HB   VAL  57           HB       VAL  57  -5.303  -7.784  -1.191
  423   1HG1  VAL  57          2HG12     VAL  57  -3.904  -6.955  -3.771
  424   2HG1  VAL  57          3HG13     VAL  57  -5.173  -6.029  -2.972
  425   3HG1  VAL  57          1HG11     VAL  57  -3.613  -6.262  -2.174
  426   1HG2  VAL  57          3HG23     VAL  57  -6.509  -9.435  -2.520
  427   2HG2  VAL  57          1HG21     VAL  57  -6.851  -7.792  -3.085
  428   3HG2  VAL  57          2HG22     VAL  57  -5.752  -8.839  -3.992
  429    H    ILE  58           HN       ILE  58  -1.483  -8.284  -2.828
  430    HA   ILE  58           HA       ILE  58  -0.277  -8.118  -0.092
  431    HB   ILE  58           HB       ILE  58   0.982  -8.071  -2.863
  432   1HG1  ILE  58          1HG11     ILE  58   0.040 -10.248  -2.505
  433   2HG1  ILE  58          2HG12     ILE  58   1.790 -10.310  -2.376
  434   1HG2  ILE  58          2HG22     ILE  58   2.243  -8.177  -0.088
  435   2HG2  ILE  58          1HG21     ILE  58   3.105  -8.439  -1.614
  436   3HG2  ILE  58          3HG23     ILE  58   2.376  -6.867  -1.269
  437   1HD1  ILE  58          2HD12     ILE  58   1.603 -10.366   0.110
  438   2HD1  ILE  58          3HD13     ILE  58  -0.176 -10.372  -0.045
  439   3HD1  ILE  58          1HD11     ILE  58   0.780 -11.711  -0.680
  440    H    PHE  59           HN       PHE  59  -0.895  -6.147   0.801
  441    HA   PHE  59           HA       PHE  59  -0.927  -3.799  -1.039
  442   1HB   PHE  59          1HB       PHE  59  -1.913  -4.123   1.804
  443   2HB   PHE  59          2HB       PHE  59  -1.991  -2.633   0.880
  444    HD1  PHE  59           HD2      PHE  59  -3.311  -6.114   1.074
  445    HD2  PHE  59           HD1      PHE  59  -3.638  -2.276  -0.873
  446    HE1  PHE  59           HE2      PHE  59  -5.666  -6.542   0.597
  447    HE2  PHE  59           HE1      PHE  59  -5.881  -2.893  -1.698
  448    HZ   PHE  59           HZ       PHE  59  -6.926  -5.030  -0.959
  449    H    LEU  60           HN       LEU  60   0.281  -2.103  -0.902
  450    HA   LEU  60           HA       LEU  60   2.526  -2.165   1.048
  451   1HB   LEU  60          2HB       LEU  60   2.463  -3.080  -1.624
  452   2HB   LEU  60          1HB       LEU  60   3.192  -1.508  -1.782
  453    HG   LEU  60           HG       LEU  60   3.985  -3.665   0.225
  454   1HD1  LEU  60          1HD11     LEU  60   5.110  -3.024  -2.520
  455   2HD1  LEU  60          2HD12     LEU  60   5.886  -4.114  -1.338
  456   3HD1  LEU  60          3HD13     LEU  60   4.286  -4.509  -1.997
  457   1HD2  LEU  60          2HD22     LEU  60   4.706  -1.333   0.854
  458   2HD2  LEU  60          1HD21     LEU  60   6.092  -2.357   0.463
  459   3HD2  LEU  60          3HD23     LEU  60   5.499  -1.168  -0.718
  460    H    LYS  61           HN       LYS  61   2.450  -0.329   2.143
  461    HA   LYS  61           HA       LYS  61   1.441   2.174   0.956
  462   1HB   LYS  61          2HB       LYS  61   0.910   1.752   3.281
  463   2HB   LYS  61          1HB       LYS  61   2.599   1.364   3.630
  464   1HG   LYS  61          1HG       LYS  61   2.143   3.516   4.538
  465   2HG   LYS  61          2HG       LYS  61   3.261   3.711   3.206
  466   1HD   LYS  61          2HD       LYS  61   1.316   4.415   1.729
  467   2HD   LYS  61          1HD       LYS  61   0.258   4.245   3.134
  468   1HE   LYS  61          2HE       LYS  61   0.868   6.567   2.968
  469   2HE   LYS  61          1HE       LYS  61   1.741   5.919   4.356
  470   1HZ   LYS  61          3HZ       LYS  61   2.868   6.277   1.655
  471   2HZ   LYS  61          1HZ       LYS  61   3.120   7.281   2.938
  472   3HZ   LYS  61          2HZ       LYS  61   3.685   5.735   2.979
  473    H    VAL  62           HN       VAL  62   2.819   3.767   0.054
  474    HA   VAL  62           HA       VAL  62   5.702   3.592   0.681
  475    HB   VAL  62           HB       VAL  62   4.600   3.691  -2.172
  476   1HG1  VAL  62          2HG12     VAL  62   7.387   3.653  -0.971
  477   2HG1  VAL  62          3HG13     VAL  62   7.073   3.478  -2.710
  478   3HG1  VAL  62          1HG11     VAL  62   6.692   5.003  -1.899
  479   1HG2  VAL  62          2HG22     VAL  62   6.123   1.473  -0.735
  480   2HG2  VAL  62          1HG21     VAL  62   4.445   1.384  -1.323
  481   3HG2  VAL  62          3HG23     VAL  62   5.777   1.529  -2.472
  482    H    ASP  63           HN       ASP  63   6.653   5.537   0.869
  483    HA   ASP  63           HA       ASP  63   5.015   7.980   0.386
  484   1HB   ASP  63          2HB       ASP  63   5.766   7.737   2.700
  485   2HB   ASP  63          1HB       ASP  63   7.439   7.529   2.163
  486    H    VAL  64           HN       VAL  64   5.474   8.580  -1.696
  487    HA   VAL  64           HA       VAL  64   7.800   7.843  -3.154
  488    HB   VAL  64           HB       VAL  64   7.105   9.454  -4.810
  489   1HG1  VAL  64          1HG11     VAL  64   4.699   8.082  -3.524
  490   2HG1  VAL  64          2HG12     VAL  64   4.755   8.731  -5.159
  491   3HG1  VAL  64          3HG13     VAL  64   5.836   7.404  -4.705
  492   1HG2  VAL  64          3HG23     VAL  64   5.231  10.653  -2.742
  493   2HG2  VAL  64          1HG21     VAL  64   6.620  11.438  -3.518
  494   3HG2  VAL  64          2HG22     VAL  64   5.218  10.986  -4.485
  495    H    ASP  65           HN       ASP  65   7.213  10.499  -0.914
  496    HA   ASP  65           HA       ASP  65   9.356  12.205  -1.661
  497   1HB   ASP  65          1HB       ASP  65   7.443  12.676  -0.032
  498   2HB   ASP  65          2HB       ASP  65   8.341  11.733   1.167
  499    H    ALA  66           HN       ALA  66   9.209   9.211   0.252
  500    HA   ALA  66           HA       ALA  66  11.977   9.496   1.237
  501   1HB   ALA  66          3HB       ALA  66   9.886   7.308   1.596
  502   2HB   ALA  66          1HB       ALA  66  11.482   7.359   2.369
  503   3HB   ALA  66          2HB       ALA  66  10.270   8.601   2.745
  504    H    VAL  67           HN       VAL  67  10.183   6.867  -0.529
  505    HA   VAL  67           HA       VAL  67  12.802   5.994  -1.629
  506    HB   VAL  67           HB       VAL  67  11.627   4.085  -2.499
  507   1HG1  VAL  67          3HG13     VAL  67  12.641   4.038  -0.254
  508   2HG1  VAL  67          1HG11     VAL  67  11.103   4.568   0.459
  509   3HG1  VAL  67          2HG12     VAL  67  11.211   2.997  -0.355
  510   1HG2  VAL  67          2HG22     VAL  67   9.324   5.083  -2.803
  511   2HG2  VAL  67          1HG21     VAL  67   9.391   3.551  -1.925
  512   3HG2  VAL  67          3HG23     VAL  67   9.167   5.084  -1.036
  513    H    ALA  68           HN       ALA  68  12.625   8.334  -2.569
  514    HA   ALA  68           HA       ALA  68  11.207   9.009  -4.852
  515   1HB   ALA  68          1HB       ALA  68  12.797  10.499  -3.706
  516   2HB   ALA  68          2HB       ALA  68  14.163   9.515  -4.278
  517   3HB   ALA  68          3HB       ALA  68  13.160  10.408  -5.442
  518    H    ALA  69           HN       ALA  69  14.102   6.945  -4.641
  519    HA   ALA  69           HA       ALA  69  14.619   6.502  -7.366
  520   1HB   ALA  69          2HB       ALA  69  16.116   5.800  -5.550
  521   2HB   ALA  69          1HB       ALA  69  14.932   4.588  -5.011
  522   3HB   ALA  69          3HB       ALA  69  15.713   4.428  -6.599
  523    H    VAL  70           HN       VAL  70  12.357   4.744  -5.167
  524    HA   VAL  70           HA       VAL  70  11.627   2.777  -7.186
  525    HB   VAL  70           HB       VAL  70  10.156   3.566  -4.637
  526   1HG1  VAL  70          1HG11     VAL  70   8.782   2.275  -6.310
  527   2HG1  VAL  70          3HG13     VAL  70  10.029   1.023  -6.329
  528   3HG1  VAL  70          2HG12     VAL  70   9.115   1.348  -4.841
  529   1HG2  VAL  70          3HG23     VAL  70  12.468   2.728  -4.164
  530   2HG2  VAL  70          2HG22     VAL  70  11.212   1.576  -3.662
  531   3HG2  VAL  70          1HG21     VAL  70  12.126   1.298  -5.162
  532    H    ALA  71           HN       ALA  71  10.260   5.799  -5.864
  533    HA   ALA  71           HA       ALA  71   7.855   5.847  -7.326
  534   1HB   ALA  71          3HB       ALA  71   8.455   7.383  -5.472
  535   2HB   ALA  71          2HB       ALA  71   9.577   8.243  -6.543
  536   3HB   ALA  71          1HB       ALA  71   7.844   8.253  -6.890
  537    H    GLU  72           HN       GLU  72  11.007   7.374  -8.297
  538    HA   GLU  72           HA       GLU  72   9.960   8.189 -10.851
  539   1HB   GLU  72          1HB       GLU  72  12.187   8.842 -11.405
  540   2HB   GLU  72          2HB       GLU  72  11.851   9.292  -9.730
  541   1HG   GLU  72          2HG       GLU  72  13.110   7.188  -9.037
  542   2HG   GLU  72          1HG       GLU  72  13.609   7.004 -10.722
  543    H    ALA  73           HN       ALA  73  11.867   5.277  -9.827
  544    HA   ALA  73           HA       ALA  73  12.230   4.231 -12.439
  545   1HB   ALA  73          1HB       ALA  73  11.883   2.763  -9.785
  546   2HB   ALA  73          2HB       ALA  73  12.544   2.070 -11.280
  547   3HB   ALA  73          3HB       ALA  73  13.411   3.379 -10.457
  548    H    ALA  74           HN       ALA  74   9.577   3.736 -10.088
  549    HA   ALA  74           HA       ALA  74   8.048   1.929 -11.697
  550   1HB   ALA  74          2HB       ALA  74   7.260   3.771  -9.399
  551   2HB   ALA  74          1HB       ALA  74   6.262   2.458 -10.044
  552   3HB   ALA  74          3HB       ALA  74   7.807   2.088  -9.266
  553    H    GLY  75           HN       GLY  75   8.050   5.458 -11.311
  554   1HA   GLY  75          1HA       GLY  75   7.668   6.876 -13.210
  555   2HA   GLY  75          2HA       GLY  75   6.500   5.714 -13.858
  556    H    ILE  76           HN       ILE  76   6.918   7.308 -10.658
  557    HA   ILE  76           HA       ILE  76   4.046   7.875 -10.431
  558    HB   ILE  76           HB       ILE  76   6.548   8.325  -8.802
  559   1HG1  ILE  76          2HG12     ILE  76   5.328   7.149  -7.100
  560   2HG1  ILE  76          1HG11     ILE  76   3.792   7.346  -7.949
  561   1HG2  ILE  76          3HG23     ILE  76   3.923   9.760  -8.222
  562   2HG2  ILE  76          1HG21     ILE  76   5.308   9.624  -7.123
  563   3HG2  ILE  76          2HG22     ILE  76   5.484  10.527  -8.613
  564   1HD1  ILE  76          1HD11     ILE  76   6.113   5.653  -8.941
  565   2HD1  ILE  76          3HD13     ILE  76   4.700   5.046  -8.082
  566   3HD1  ILE  76          2HD12     ILE  76   4.503   5.748  -9.681
  567    H    THR  77           HN       THR  77   3.041   9.892 -10.560
  568    HA   THR  77           HA       THR  77   4.596  12.155 -11.741
  569    HB   THR  77           HB       THR  77   2.542  12.626 -13.091
  570    HG1  THR  77           HG1      THR  77   1.176  10.668 -13.353
  571   1HG2  THR  77          3HG23     THR  77   4.503  11.401 -14.064
  572   2HG2  THR  77          2HG22     THR  77   3.730   9.860 -13.638
  573   3HG2  THR  77          1HG21     THR  77   2.965  10.942 -14.818
  574    H    ALA  78           HN       ALA  78   1.221  11.713 -10.853
  575    HA   ALA  78           HA       ALA  78   1.381  13.907  -8.834
  576   1HB   ALA  78          1HB       ALA  78  -0.425  13.959 -10.540
  577   2HB   ALA  78          2HB       ALA  78  -1.012  12.384  -9.962
  578   3HB   ALA  78          3HB       ALA  78  -1.078  13.805  -8.900
  579    H    MET  79           HN       MET  79  -0.212  13.342  -6.853
  580    HA   MET  79           HA       MET  79   0.200  10.575  -5.917
  581   1HB   MET  79          2HB       MET  79   0.825  12.940  -4.128
  582   2HB   MET  79          1HB       MET  79   1.067  11.210  -3.826
  583   1HG   MET  79          2HG       MET  79   3.188  11.984  -4.271
  584   2HG   MET  79          1HG       MET  79   2.721  11.276  -5.813
  585   1HE   MET  79          1HE       MET  79   4.514  12.389  -7.190
  586   2HE   MET  79          3HE       MET  79   4.942  14.112  -7.157
  587   3HE   MET  79          2HE       MET  79   5.277  13.092  -5.738
  588    HA   PRO  80           HA       PRO  80  -0.899   9.326  -4.034
  589   1HB   PRO  80          1HB       PRO  80  -3.755   8.594  -4.750
  590   2HB   PRO  80          2HB       PRO  80  -2.713   7.864  -3.520
  591   1HG   PRO  80          1HG       PRO  80  -4.554   9.692  -2.781
  592   2HG   PRO  80          2HG       PRO  80  -2.888   9.909  -2.160
  593   1HD   PRO  80          1HD       PRO  80  -4.169  11.271  -4.568
  594   2HD   PRO  80          2HD       PRO  80  -3.230  12.003  -3.253
  595    H    THR  81           HN       THR  81  -0.304   7.504  -5.254
  596    HA   THR  81           HA       THR  81  -1.337   7.172  -8.010
  597    HB   THR  81           HB       THR  81   1.533   7.297  -7.052
  598    HG1  THR  81           HG1      THR  81   0.850   9.146  -8.064
  599   1HG2  THR  81          3HG23     THR  81   0.425   5.843  -9.495
  600   2HG2  THR  81          2HG22     THR  81   2.117   6.335  -9.326
  601   3HG2  THR  81          1HG21     THR  81   1.436   5.147  -8.204
  602    H    PHE  82           HN       PHE  82  -2.120   5.172  -8.294
  603    HA   PHE  82           HA       PHE  82  -1.571   3.096  -6.218
  604   1HB   PHE  82          1HB       PHE  82  -4.106   3.619  -7.798
  605   2HB   PHE  82          2HB       PHE  82  -3.811   2.227  -6.778
  606    HD1  PHE  82           HD2      PHE  82  -2.868   2.761  -4.332
  607    HD2  PHE  82           HD1      PHE  82  -5.245   5.482  -6.701
  608    HE1  PHE  82           HE2      PHE  82  -3.394   4.085  -2.307
  609    HE2  PHE  82           HE1      PHE  82  -5.829   6.732  -4.651
  610    HZ   PHE  82           HZ       PHE  82  -4.839   6.064  -2.450
  611    H    HIS  83           HN       HIS  83  -0.019   1.819  -7.107
  612    HA   HIS  83           HA       HIS  83  -0.280   1.068 -10.005
  613   1HB   HIS  83          1HB       HIS  83   2.006   0.897  -8.017
  614   2HB   HIS  83          2HB       HIS  83   1.955  -0.006  -9.533
  615    HD2  HIS  83           HD2      HIS  83   0.566   3.475 -10.071
  616    HE1  HIS  83           HE1      HIS  83   4.561   3.435 -11.442
  617    HE2  HIS  83           HE2      HIS  83   2.370   4.766 -11.459
  618    H    VAL  84           HN       VAL  84  -0.511  -1.074 -10.580
  619    HA   VAL  84           HA       VAL  84  -0.869  -3.015  -8.340
  620    HB   VAL  84           HB       VAL  84  -2.366  -3.187 -10.966
  621   1HG1  VAL  84          3HG23     VAL  84  -2.610  -4.492  -8.205
  622   2HG1  VAL  84          1HG21     VAL  84  -3.721  -4.747  -9.550
  623   3HG1  VAL  84          2HG22     VAL  84  -2.040  -5.279  -9.690
  624   1HG2  VAL  84          1HG11     VAL  84  -3.352  -2.003  -8.339
  625   2HG2  VAL  84          3HG13     VAL  84  -3.171  -1.134  -9.885
  626   3HG2  VAL  84          2HG12     VAL  84  -4.360  -2.425  -9.736
  627    H    TYR  85           HN       TYR  85   0.859  -4.328  -8.386
  628    HA   TYR  85           HA       TYR  85   2.080  -5.089 -11.012
  629   1HB   TYR  85          1HB       TYR  85   3.275  -5.080  -8.233
  630   2HB   TYR  85          2HB       TYR  85   4.032  -5.810  -9.633
  631    HD1  TYR  85           HD2      TYR  85   3.034  -2.649  -8.011
  632    HD2  TYR  85           HD1      TYR  85   5.119  -4.429 -11.333
  633    HE1  TYR  85           HE2      TYR  85   4.049  -0.452  -8.558
  634    HE2  TYR  85           HE1      TYR  85   6.090  -2.214 -11.900
  635    HH   TYR  85           HH       TYR  85   4.834   0.758 -10.444
  636    H    LYS  86           HN       LYS  86   1.053  -6.980 -11.653
  637    HA   LYS  86           HA       LYS  86  -0.059  -8.800  -9.590
  638   1HB   LYS  86          2HB       LYS  86  -1.332  -8.412 -11.631
  639   2HB   LYS  86          1HB       LYS  86  -0.013  -9.064 -12.620
  640   1HG   LYS  86          2HG       LYS  86  -0.241 -11.246 -11.667
  641   2HG   LYS  86          1HG       LYS  86  -1.270 -10.682 -10.350
  642   1HD   LYS  86          1HD       LYS  86  -2.099 -10.490 -13.277
  643   2HD   LYS  86          2HD       LYS  86  -2.393 -11.944 -12.323
  644   1HE   LYS  86          2HE       LYS  86  -3.465  -9.191 -11.542
  645   2HE   LYS  86          1HE       LYS  86  -4.361 -10.419 -12.446
  646   1HZ   LYS  86          1HZ       LYS  86  -3.270 -10.868  -9.766
  647   2HZ   LYS  86          3HZ       LYS  86  -4.828 -10.459 -10.108
  648   3HZ   LYS  86          2HZ       LYS  86  -4.235 -11.885 -10.645
  649    H    ASP  87           HN       ASP  87   1.460  -9.840  -8.511
  650    HA   ASP  87           HA       ASP  87   3.172 -11.120  -7.893
  651   1HB   ASP  87          1HB       ASP  87   3.461 -11.857 -10.854
  652   2HB   ASP  87          2HB       ASP  87   4.198 -12.694  -9.499
  653    H    GLY  88           HN       GLY  88   4.070  -9.626 -10.913
  654   1HA   GLY  88          1HA       GLY  88   6.019  -7.802  -9.739
  655   2HA   GLY  88          2HA       GLY  88   6.757  -9.101 -10.699
  656    H    VAL  89           HN       VAL  89   3.904  -8.821 -12.324
  657    HA   VAL  89           HA       VAL  89   5.141  -7.120 -14.369
  658    HB   VAL  89           HB       VAL  89   2.536  -8.708 -14.374
  659   1HG1  VAL  89          3HG23     VAL  89   4.267  -7.618 -16.639
  660   2HG1  VAL  89          1HG21     VAL  89   2.800  -8.599 -16.829
  661   3HG1  VAL  89          2HG22     VAL  89   2.687  -6.975 -16.137
  662   1HG2  VAL  89          1HG11     VAL  89   5.328  -9.567 -15.237
  663   2HG2  VAL  89          3HG13     VAL  89   4.343 -10.292 -13.949
  664   3HG2  VAL  89          2HG12     VAL  89   3.828 -10.437 -15.628
  665    H    LYS  90           HN       LYS  90   4.602  -4.957 -14.468
  666    HA   LYS  90           HA       LYS  90   2.688  -3.724 -12.739
  667   1HB   LYS  90          1HB       LYS  90   4.682  -2.613 -13.749
  668   2HB   LYS  90          2HB       LYS  90   3.879  -2.625 -15.322
  669   1HG   LYS  90          1HG       LYS  90   2.087  -1.206 -14.481
  670   2HG   LYS  90          2HG       LYS  90   2.679  -1.343 -12.813
  671   1HD   LYS  90          1HD       LYS  90   4.720  -0.118 -13.360
  672   2HD   LYS  90          2HD       LYS  90   4.289  -0.071 -15.076
  673   1HE   LYS  90          1HE       LYS  90   2.242   1.235 -14.526
  674   2HE   LYS  90          2HE       LYS  90   2.727   1.249 -12.822
  675   1HZ   LYS  90          3HZ       LYS  90   4.743   2.416 -13.516
  676   2HZ   LYS  90          1HZ       LYS  90   4.232   2.394 -15.078
  677   3HZ   LYS  90          2HZ       LYS  90   3.384   3.241 -13.952
  678    H    ALA  91           HN       ALA  91   0.678  -4.603 -12.899
  679    HA   ALA  91           HA       ALA  91  -0.571  -5.257 -15.452
  680   1HB   ALA  91          2HB       ALA  91  -0.847  -6.694 -13.464
  681   2HB   ALA  91          1HB       ALA  91  -1.615  -5.352 -12.584
  682   3HB   ALA  91          3HB       ALA  91  -2.410  -6.051 -14.011
  683    H    ASP  92           HN       ASP  92  -0.794  -2.695 -12.985
  684    HA   ASP  92           HA       ASP  92  -2.297  -1.076 -14.903
  685   1HB   ASP  92          2HB       ASP  92  -3.865  -2.723 -13.520
  686   2HB   ASP  92          1HB       ASP  92  -3.706  -1.505 -12.252
  687    H    ASP  93           HN       ASP  93  -3.018   1.031 -13.867
  688    HA   ASP  93           HA       ASP  93  -1.339   2.124 -11.756
  689   1HB   ASP  93          1HB       ASP  93   0.205   2.330 -13.581
  690   2HB   ASP  93          2HB       ASP  93  -1.069   2.923 -14.675
  691    H    LEU  94           HN       LEU  94  -1.931   4.411 -11.558
  692    HA   LEU  94           HA       LEU  94  -4.285   5.640 -12.521
  693   1HB   LEU  94          1HB       LEU  94  -5.626   3.935 -11.480
  694   2HB   LEU  94          2HB       LEU  94  -4.580   3.905 -10.055
  695    HG   LEU  94           HG       LEU  94  -5.433   6.177  -9.403
  696   1HD1  LEU  94          1HD11     LEU  94  -7.286   5.728 -11.788
  697   2HD1  LEU  94          3HD13     LEU  94  -7.496   6.999 -10.559
  698   3HD1  LEU  94          2HD12     LEU  94  -6.101   7.030 -11.642
  699   1HD2  LEU  94          1HD21     LEU  94  -6.431   4.140  -8.477
  700   2HD2  LEU  94          3HD23     LEU  94  -7.626   5.425  -8.669
  701   3HD2  LEU  94          2HD22     LEU  94  -7.579   4.077  -9.828
  702    H    VAL  95           HN       VAL  95  -4.210   7.809 -11.704
  703    HA   VAL  95           HA       VAL  95  -2.617   8.316  -9.295
  704    HB   VAL  95           HB       VAL  95  -1.302  10.005 -10.306
  705   1HG1  VAL  95          2HG22     VAL  95  -0.528   7.634 -10.688
  706   2HG1  VAL  95          3HG23     VAL  95  -1.205   7.722 -12.324
  707   3HG1  VAL  95          1HG21     VAL  95   0.107   8.809 -11.842
  708   1HG2  VAL  95          1HG11     VAL  95  -2.865   9.575 -12.887
  709   2HG2  VAL  95          3HG13     VAL  95  -2.866  11.036 -11.871
  710   3HG2  VAL  95          2HG12     VAL  95  -1.400  10.567 -12.735
  711    H    GLY  96           HN       GLY  96  -3.396  10.048  -8.107
  712   1HA   GLY  96          1HA       GLY  96  -4.609  12.080  -7.844
  713   2HA   GLY  96          2HA       GLY  96  -5.511  11.761  -9.329
  714    H    ALA  97           HN       ALA  97  -4.917  10.194  -6.210
  715    HA   ALA  97           HA       ALA  97  -6.291   9.172  -4.670
  716   1HB   ALA  97          1HB       ALA  97  -8.044  11.535  -5.507
  717   2HB   ALA  97          2HB       ALA  97  -8.253  10.575  -4.029
  718   3HB   ALA  97          3HB       ALA  97  -6.782  11.529  -4.271
  719    H    SER  98           HN       SER  98  -9.360  10.041  -5.946
  720    HA   SER  98           HA       SER  98 -11.103   8.822  -6.721
  721   1HB   SER  98          1HB       SER  98  -8.979   7.454  -8.434
  722   2HB   SER  98          2HB       SER  98 -10.717   7.582  -8.761
  723    HG   SER  98           HG       SER  98  -8.874   9.761  -8.559
  724    H    GLN  99           HN       GLN  99 -10.699   7.969  -4.365
  725    HA   GLN  99           HA       GLN  99  -9.842   5.419  -3.746
  726   1HB   GLN  99          2HB       GLN  99 -12.261   6.880  -2.586
  727   2HB   GLN  99          1HB       GLN  99 -11.469   5.458  -1.900
  728   1HG   GLN  99          1HG       GLN  99 -10.401   7.040  -0.679
  729   2HG   GLN  99          2HG       GLN  99  -9.273   6.938  -2.027
  730   1HE2  GLN  99          1HE21     GLN  99 -11.065  10.455  -1.176
  731   2HE2  GLN  99          2HE22     GLN  99 -11.161   9.064  -0.113
  732    H    ASP 100           HN       ASP 100 -12.882   6.307  -5.349
  733    HA   ASP 100           HA       ASP 100 -14.230   3.774  -5.137
  734   1HB   ASP 100          2HB       ASP 100 -15.604   4.647  -6.955
  735   2HB   ASP 100          1HB       ASP 100 -15.369   5.899  -5.730
  736    H    LYS 101           HN       LYS 101 -12.028   5.264  -7.527
  737    HA   LYS 101           HA       LYS 101 -12.110   3.009  -9.324
  738   1HB   LYS 101          1HB       LYS 101 -11.603   5.454  -9.834
  739   2HB   LYS 101          2HB       LYS 101  -9.968   5.164  -9.221
  740   1HG   LYS 101          1HG       LYS 101  -9.574   3.474 -10.921
  741   2HG   LYS 101          2HG       LYS 101 -11.265   3.474 -11.424
  742   1HD   LYS 101          2HD       LYS 101  -9.565   5.986 -11.600
  743   2HD   LYS 101          1HD       LYS 101  -9.591   4.771 -12.892
  744   1HE   LYS 101          2HE       LYS 101 -12.048   5.048 -13.117
  745   2HE   LYS 101          1HE       LYS 101 -12.036   6.284 -11.849
  746   1HZ   LYS 101          1HZ       LYS 101 -10.613   6.457 -14.402
  747   2HZ   LYS 101          2HZ       LYS 101 -12.003   7.247 -14.002
  748   3HZ   LYS 101          3HZ       LYS 101 -10.600   7.599 -13.214
  749    H    LEU 102           HN       LEU 102 -10.001   4.033  -6.615
  750    HA   LEU 102           HA       LEU 102  -8.039   1.978  -6.838
  751   1HB   LEU 102          1HB       LEU 102  -7.628   3.663  -5.221
  752   2HB   LEU 102          2HB       LEU 102  -9.210   3.463  -4.490
  753    HG   LEU 102           HG       LEU 102  -8.574   1.225  -3.611
  754   1HD1  LEU 102          2HD22     LEU 102  -6.701   0.734  -5.192
  755   2HD1  LEU 102          1HD21     LEU 102  -5.779   2.067  -4.477
  756   3HD1  LEU 102          3HD23     LEU 102  -6.199   0.646  -3.497
  757   1HD2  LEU 102          1HD11     LEU 102  -8.571   3.296  -2.283
  758   2HD2  LEU 102          3HD13     LEU 102  -7.359   2.130  -1.755
  759   3HD2  LEU 102          2HD12     LEU 102  -6.868   3.558  -2.711
  760    H    LYS 103           HN       LYS 103 -11.213   1.935  -5.032
  761    HA   LYS 103           HA       LYS 103 -11.080  -0.765  -4.237
  762   1HB   LYS 103          2HB       LYS 103 -13.445   1.012  -4.967
  763   2HB   LYS 103          1HB       LYS 103 -13.600  -0.599  -4.265
  764   1HG   LYS 103          1HG       LYS 103 -12.392   0.051  -2.273
  765   2HG   LYS 103          2HG       LYS 103 -11.999   1.631  -2.959
  766   1HD   LYS 103          2HD       LYS 103 -14.443   2.178  -3.058
  767   2HD   LYS 103          1HD       LYS 103 -14.808   0.597  -2.347
  768   1HE   LYS 103          2HE       LYS 103 -14.880   2.307  -0.610
  769   2HE   LYS 103          1HE       LYS 103 -13.512   1.226  -0.305
  770   1HZ   LYS 103          1HZ       LYS 103 -13.357   3.861  -1.601
  771   2HZ   LYS 103          3HZ       LYS 103 -12.943   3.534  -0.039
  772   3HZ   LYS 103          2HZ       LYS 103 -12.079   2.873  -1.277
  773    H    ALA 104           HN       ALA 104 -12.422   0.638  -7.271
  774    HA   ALA 104           HA       ALA 104 -13.192  -1.788  -8.477
  775   1HB   ALA 104          2HB       ALA 104 -13.733   0.488  -9.341
  776   2HB   ALA 104          1HB       ALA 104 -12.054   0.660  -9.898
  777   3HB   ALA 104          3HB       ALA 104 -13.090  -0.597 -10.589
  778    H    LEU 105           HN       LEU 105  -9.958  -0.160  -8.614
  779    HA   LEU 105           HA       LEU 105  -8.682  -2.015 -10.334
  780   1HB   LEU 105          2HB       LEU 105  -7.581  -0.373  -8.006
  781   2HB   LEU 105          1HB       LEU 105  -6.571  -1.377  -9.022
  782    HG   LEU 105           HG       LEU 105  -8.206   0.950 -10.094
  783   1HD1  LEU 105          3HD23     LEU 105  -5.253   0.721  -9.323
  784   2HD1  LEU 105          2HD22     LEU 105  -6.017   2.098 -10.130
  785   3HD1  LEU 105          1HD21     LEU 105  -6.471   1.687  -8.468
  786   1HD2  LEU 105          2HD12     LEU 105  -5.926  -0.702 -11.262
  787   2HD2  LEU 105          3HD13     LEU 105  -7.612  -0.704 -11.836
  788   3HD2  LEU 105          1HD11     LEU 105  -6.621   0.754 -12.000
  789    H    VAL 106           HN       VAL 106  -8.780  -1.953  -6.714
  790    HA   VAL 106           HA       VAL 106  -7.276  -4.355  -6.463
  791    HB   VAL 106           HB       VAL 106  -9.380  -3.321  -4.509
  792   1HG1  VAL 106          1HG21     VAL 106  -8.554  -5.671  -4.088
  793   2HG1  VAL 106          3HG23     VAL 106  -6.895  -5.073  -4.159
  794   3HG1  VAL 106          2HG22     VAL 106  -7.977  -4.528  -2.866
  795   1HG2  VAL 106          3HG13     VAL 106  -6.390  -2.740  -4.745
  796   2HG2  VAL 106          2HG12     VAL 106  -7.683  -1.561  -4.978
  797   3HG2  VAL 106          1HG11     VAL 106  -7.426  -2.256  -3.383
  798    H    ALA 107           HN       ALA 107 -10.800  -3.865  -6.553
  799    HA   ALA 107           HA       ALA 107 -11.590  -6.567  -6.288
  800   1HB   ALA 107          1HB       ALA 107 -13.178  -4.687  -6.266
  801   2HB   ALA 107          3HB       ALA 107 -12.890  -4.390  -7.992
  802   3HB   ALA 107          2HB       ALA 107 -13.656  -5.903  -7.466
  803    H    LYS 108           HN       LYS 108 -11.026  -4.761  -9.334
  804    HA   LYS 108           HA       LYS 108 -11.356  -6.792 -11.212
  805   1HB   LYS 108          1HB       LYS 108 -11.078  -4.480 -11.838
  806   2HB   LYS 108          2HB       LYS 108  -9.535  -4.351 -11.059
  807   1HG   LYS 108          1HG       LYS 108  -9.369  -4.343 -13.502
  808   2HG   LYS 108          2HG       LYS 108  -8.376  -5.558 -12.708
  809   1HD   LYS 108          1HD       LYS 108  -9.389  -6.383 -14.777
  810   2HD   LYS 108          2HD       LYS 108  -9.839  -7.347 -13.382
  811   1HE   LYS 108          2HE       LYS 108 -12.061  -6.130 -13.314
  812   2HE   LYS 108          1HE       LYS 108 -11.551  -5.176 -14.717
  813   1HZ   LYS 108          2HZ       LYS 108 -11.415  -7.216 -15.957
  814   2HZ   LYS 108          1HZ       LYS 108 -11.877  -8.094 -14.640
  815   3HZ   LYS 108          3HZ       LYS 108 -12.924  -7.022 -15.323
  816    H    HIS 109           HN       HIS 109  -8.276  -5.667  -9.890
  817    HA   HIS 109           HA       HIS 109  -6.800  -7.837 -11.079
  818   1HB   HIS 109          1HB       HIS 109  -5.998  -5.782  -8.991
  819   2HB   HIS 109          2HB       HIS 109  -4.889  -6.877  -9.844
  820    HD2  HIS 109           HD2      HIS 109  -6.388  -3.424 -10.393
  821    HE1  HIS 109           HE1      HIS 109  -5.500  -4.874 -14.243
  822    HE2  HIS 109           HE2      HIS 109  -6.201  -2.819 -12.938
  823    H    ALA 110           HN       ALA 110  -8.426  -7.650  -7.946
  824    HA   ALA 110           HA       ALA 110  -7.019  -9.955  -6.845
  825   1HB   ALA 110          1HB       ALA 110  -9.757  -8.774  -6.197
  826   2HB   ALA 110          2HB       ALA 110  -8.910 -10.024  -5.263
  827   3HB   ALA 110          3HB       ALA 110  -8.224  -8.393  -5.375
  828    H    ALA 111           HN       ALA 111 -10.050  -9.391  -8.702
  829    HA   ALA 111           HA       ALA 111 -10.545 -12.295  -8.957
  830   1HB   ALA 111          3HB       ALA 111 -12.405 -10.698  -8.613
  831   2HB   ALA 111          1HB       ALA 111 -11.969  -9.865 -10.121
  832   3HB   ALA 111          2HB       ALA 111 -12.545 -11.546 -10.165
  833    H    ALA 112           HN       ALA 112  -8.034 -12.018  -9.959
  834    HA   ALA 112           HA       ALA 112  -8.257 -12.683 -12.709
  835   1HB   ALA 112          1HB       ALA 112  -6.926 -10.023 -12.008
  836   2HB   ALA 112          2HB       ALA 112  -6.841 -10.839 -13.583
  837   3HB   ALA 112          3HB       ALA 112  -8.389 -10.202 -13.000
   
  No H/Q in entry =         837
  Start of MODEL   15
    1   1H    GLY   1          2HN       GLY   1  -1.831  -6.232   8.362
    2   2H    GLY   1          1HN       GLY   1  -1.534  -4.972   9.426
    3   3H    GLY   1          3HN       GLY   1  -0.931  -4.958   7.874
    4   1HA   GLY   1          1HA       GLY   1   0.875  -5.517   9.174
    5   2HA   GLY   1          2HA       GLY   1  -0.088  -6.771   9.989
    6    H    GLY   2           HN       GLY   2   2.292  -7.543   8.747
    7   1HA   GLY   2          1HA       GLY   2   3.147  -9.077   7.299
    8   2HA   GLY   2          2HA       GLY   2   1.496  -9.715   7.169
    9    H    SER   3           HN       SER   3   0.417  -9.463   5.195
   10    HA   SER   3           HA       SER   3   1.849  -8.401   2.932
   11   1HB   SER   3          1HB       SER   3  -0.549  -9.031   1.966
   12   2HB   SER   3          2HB       SER   3   0.616 -10.271   2.476
   13    HG   SER   3           HG       SER   3  -1.387 -10.714   3.408
   14    H    VAL   4           HN       VAL   4  -0.371  -7.076   5.266
   15    HA   VAL   4           HA       VAL   4  -1.029  -4.745   3.515
   16    HB   VAL   4           HB       VAL   4  -2.209  -5.868   6.093
   17   1HG1  VAL   4          1HG21     VAL   4  -2.656  -3.188   4.764
   18   2HG1  VAL   4          3HG23     VAL   4  -3.909  -3.961   5.767
   19   3HG1  VAL   4          2HG22     VAL   4  -2.345  -3.534   6.466
   20   1HG2  VAL   4          2HG12     VAL   4  -2.904  -6.998   4.008
   21   2HG2  VAL   4          3HG13     VAL   4  -4.236  -6.121   4.775
   22   3HG2  VAL   4          1HG11     VAL   4  -3.429  -5.435   3.352
   23    H    ILE   5           HN       ILE   5   0.724  -3.235   3.666
   24    HA   ILE   5           HA       ILE   5   1.445  -2.482   6.458
   25    HB   ILE   5           HB       ILE   5   3.837  -2.193   5.515
   26   1HG1  ILE   5          2HG12     ILE   5   2.892  -4.394   3.657
   27   2HG1  ILE   5          1HG11     ILE   5   3.065  -2.722   3.111
   28   1HG2  ILE   5          3HG23     ILE   5   3.132  -3.813   7.266
   29   2HG2  ILE   5          2HG22     ILE   5   2.745  -4.998   6.007
   30   3HG2  ILE   5          1HG21     ILE   5   4.417  -4.466   6.258
   31   1HD1  ILE   5          3HD13     ILE   5   5.421  -4.178   4.341
   32   2HD1  ILE   5          1HD11     ILE   5   5.009  -4.330   2.631
   33   3HD1  ILE   5          2HD12     ILE   5   5.400  -2.747   3.296
   34    H    VAL   6           HN       VAL   6   2.003  -0.484   6.790
   35    HA   VAL   6           HA       VAL   6   1.483   1.522   4.676
   36    HB   VAL   6           HB       VAL   6   1.074   1.965   7.655
   37   1HG1  VAL   6          3HG23     VAL   6  -0.037   3.363   5.168
   38   2HG1  VAL   6          2HG22     VAL   6  -0.466   3.756   6.842
   39   3HG1  VAL   6          1HG21     VAL   6   1.173   4.042   6.274
   40   1HG2  VAL   6          2HG12     VAL   6  -0.961   1.015   5.600
   41   2HG2  VAL   6          1HG11     VAL   6  -0.455   0.140   7.066
   42   3HG2  VAL   6          3HG13     VAL   6  -1.370   1.638   7.212
   43    H    ILE   7           HN       ILE   7   3.945   0.095   5.397
   44    HA   ILE   7           HA       ILE   7   5.699   2.033   6.757
   45    HB   ILE   7           HB       ILE   7   5.770  -0.510   7.031
   46   1HG1  ILE   7          2HG12     ILE   7   8.393   0.741   6.105
   47   2HG1  ILE   7          1HG11     ILE   7   7.645   0.986   7.695
   48   1HG2  ILE   7          2HG22     ILE   7   5.521  -0.871   4.481
   49   2HG2  ILE   7          3HG23     ILE   7   7.245  -0.494   4.365
   50   3HG2  ILE   7          1HG21     ILE   7   6.696  -1.887   5.321
   51   1HD1  ILE   7          2HD12     ILE   7   7.726  -1.496   8.073
   52   2HD1  ILE   7          3HD13     ILE   7   8.613  -1.667   6.543
   53   3HD1  ILE   7          1HD11     ILE   7   9.324  -0.752   7.877
   54    H    ASP   8           HN       ASP   8   7.753   2.648   5.456
   55    HA   ASP   8           HA       ASP   8   6.922   3.714   2.846
   56   1HB   ASP   8          1HB       ASP   8   8.148   5.158   4.474
   57   2HB   ASP   8          2HB       ASP   8   9.548   4.074   4.356
   58    H    SER   9           HN       SER   9   6.619   1.699   2.121
   59    HA   SER   9           HA       SER   9   8.253  -0.524   2.079
   60   1HB   SER   9          2HB       SER   9   6.293   0.195  -0.100
   61   2HB   SER   9          1HB       SER   9   6.777  -1.415   0.459
   62    HG   SER   9           HG       SER   9   5.350   0.554   1.986
   63    H    LYS  10           HN       LYS  10  10.327   0.657   1.576
   64    HA   LYS  10           HA       LYS  10  11.087   0.413  -1.298
   65   1HB   LYS  10          2HB       LYS  10  12.082   2.223  -0.108
   66   2HB   LYS  10          1HB       LYS  10  12.337   1.197   1.287
   67   1HG   LYS  10          2HG       LYS  10  14.445   1.824   0.020
   68   2HG   LYS  10          1HG       LYS  10  14.234   0.088   0.218
   69   1HD   LYS  10          2HD       LYS  10  13.318  -0.041  -2.144
   70   2HD   LYS  10          1HD       LYS  10  13.556   1.702  -2.288
   71   1HE   LYS  10          1HE       LYS  10  15.396   0.558  -3.353
   72   2HE   LYS  10          2HE       LYS  10  16.010   1.375  -1.907
   73   1HZ   LYS  10          3HZ       LYS  10  15.305  -1.476  -2.102
   74   2HZ   LYS  10          2HZ       LYS  10  16.833  -0.862  -2.139
   75   3HZ   LYS  10          1HZ       LYS  10  15.927  -0.728  -0.771
   76    H    ALA  11           HN       ALA  11  12.378  -0.800   1.742
   77    HA   ALA  11           HA       ALA  11  13.450  -3.243   0.559
   78   1HB   ALA  11          1HB       ALA  11  13.137  -2.414   3.484
   79   2HB   ALA  11          2HB       ALA  11  14.083  -3.793   2.882
   80   3HB   ALA  11          3HB       ALA  11  14.561  -2.137   2.456
   81    H    ALA  12           HN       ALA  12  10.829  -2.497   2.870
   82    HA   ALA  12           HA       ALA  12   9.766  -5.064   3.211
   83   1HB   ALA  12          3HB       ALA  12   9.128  -3.007   4.501
   84   2HB   ALA  12          2HB       ALA  12   8.181  -2.465   3.098
   85   3HB   ALA  12          1HB       ALA  12   7.745  -3.962   3.937
   86    H    TRP  13           HN       TRP  13   9.282  -2.716   0.593
   87    HA   TRP  13           HA       TRP  13   7.175  -3.892  -0.843
   88   1HB   TRP  13          2HB       TRP  13   7.755  -1.919  -1.728
   89   2HB   TRP  13          1HB       TRP  13   9.464  -2.069  -1.377
   90    HD1  TRP  13           HD1      TRP  13  10.781  -3.799  -3.301
   91    HE1  TRP  13           HE1      TRP  13  10.658  -3.553  -5.836
   92    HE3  TRP  13           HE3      TRP  13   6.648  -0.818  -3.619
   93    HZ2  TRP  13           HZ2      TRP  13   9.108  -2.134  -7.739
   94    HZ3  TRP  13           HZ3      TRP  13   6.067   0.202  -5.807
   95    HH2  TRP  13           HH2      TRP  13   7.196  -0.540  -7.884
   96    H    ASP  14           HN       ASP  14  10.678  -4.603  -1.036
   97    HA   ASP  14           HA       ASP  14  10.374  -6.691  -2.997
   98   1HB   ASP  14          2HB       ASP  14  12.491  -5.381  -2.424
   99   2HB   ASP  14          1HB       ASP  14  12.614  -6.351  -0.962
  100    H    ALA  15           HN       ALA  15  10.864  -6.681   0.500
  101    HA   ALA  15           HA       ALA  15  10.933  -9.464   0.963
  102   1HB   ALA  15          3HB       ALA  15  11.437  -7.798   2.703
  103   2HB   ALA  15          1HB       ALA  15   9.728  -7.331   2.776
  104   3HB   ALA  15          2HB       ALA  15  10.220  -8.961   3.268
  105    H    GLN  16           HN       GLN  16   8.038  -7.412   1.353
  106    HA   GLN  16           HA       GLN  16   6.122  -9.489   1.538
  107   1HB   GLN  16          1HB       GLN  16   6.016  -6.552   0.856
  108   2HB   GLN  16          2HB       GLN  16   4.635  -7.566   0.465
  109   1HG   GLN  16          2HG       GLN  16   4.170  -6.692   2.551
  110   2HG   GLN  16          1HG       GLN  16   4.525  -8.394   2.795
  111   1HE2  GLN  16          1HE21     GLN  16   6.169  -6.502   5.558
  112   2HE2  GLN  16          2HE22     GLN  16   4.526  -6.870   5.029
  113    H    LEU  17           HN       LEU  17   7.219  -7.670  -1.374
  114    HA   LEU  17           HA       LEU  17   5.632  -8.949  -3.266
  115   1HB   LEU  17          1HB       LEU  17   7.027  -7.099  -3.816
  116   2HB   LEU  17          2HB       LEU  17   8.521  -7.962  -3.447
  117    HG   LEU  17           HG       LEU  17   6.727  -9.011  -5.621
  118   1HD1  LEU  17          2HD22     LEU  17   8.620  -6.647  -5.918
  119   2HD1  LEU  17          1HD21     LEU  17   7.815  -7.502  -7.252
  120   3HD1  LEU  17          3HD23     LEU  17   6.850  -6.597  -6.077
  121   1HD2  LEU  17          3HD13     LEU  17   9.761  -8.860  -5.296
  122   2HD2  LEU  17          1HD11     LEU  17   8.772 -10.318  -5.096
  123   3HD2  LEU  17          2HD12     LEU  17   8.910  -9.569  -6.682
  124    H    ALA  18           HN       ALA  18   8.780 -10.117  -2.007
  125    HA   ALA  18           HA       ALA  18   8.816 -12.492  -3.579
  126   1HB   ALA  18          3HB       ALA  18  10.799 -11.525  -2.511
  127   2HB   ALA  18          1HB       ALA  18  10.145 -11.881  -0.901
  128   3HB   ALA  18          2HB       ALA  18  10.563 -13.211  -2.003
  129    H    LYS  19           HN       LYS  19   8.059 -12.203  -0.024
  130    HA   LYS  19           HA       LYS  19   7.215 -14.943   0.101
  131   1HB   LYS  19          2HB       LYS  19   6.344 -14.447   2.300
  132   2HB   LYS  19          1HB       LYS  19   7.946 -13.738   2.072
  133   1HG   LYS  19          2HG       LYS  19   6.881 -11.535   1.689
  134   2HG   LYS  19          1HG       LYS  19   5.283 -12.237   1.983
  135   1HD   LYS  19          1HD       LYS  19   5.944 -12.855   4.267
  136   2HD   LYS  19          2HD       LYS  19   7.605 -12.301   3.974
  137   1HE   LYS  19          1HE       LYS  19   6.833  -9.989   3.674
  138   2HE   LYS  19          2HE       LYS  19   5.141 -10.502   3.885
  139   1HZ   LYS  19          1HZ       LYS  19   7.272 -10.701   5.893
  140   2HZ   LYS  19          3HZ       LYS  19   6.064  -9.581   5.868
  141   3HZ   LYS  19          2HZ       LYS  19   5.706 -11.172   6.104
  142    H    GLY  20           HN       GLY  20   5.472 -12.068  -0.921
  143   1HA   GLY  20          1HA       GLY  20   2.810 -13.020  -0.629
  144   2HA   GLY  20          2HA       GLY  20   3.393 -11.765  -1.739
  145    H    LYS  21           HN       LYS  21   5.368 -13.799  -2.962
  146    HA   LYS  21           HA       LYS  21   5.402 -14.988  -4.905
  147   1HB   LYS  21          1HB       LYS  21   3.182 -16.471  -3.441
  148   2HB   LYS  21          2HB       LYS  21   4.059 -17.088  -4.848
  149   1HG   LYS  21          1HG       LYS  21   6.194 -16.949  -3.640
  150   2HG   LYS  21          2HG       LYS  21   5.393 -16.323  -2.205
  151   1HD   LYS  21          2HD       LYS  21   4.861 -19.047  -3.484
  152   2HD   LYS  21          1HD       LYS  21   5.908 -18.771  -2.088
  153   1HE   LYS  21          1HE       LYS  21   2.891 -18.271  -2.177
  154   2HE   LYS  21          2HE       LYS  21   3.717 -19.612  -1.384
  155   1HZ   LYS  21          2HZ       LYS  21   4.794 -18.049   0.055
  156   2HZ   LYS  21          3HZ       LYS  21   4.038 -16.777  -0.661
  157   3HZ   LYS  21          1HZ       LYS  21   3.157 -17.901   0.156
  158    H    GLU  22           HN       GLU  22   4.577 -12.934  -5.791
  159    HA   GLU  22           HA       GLU  22   1.850 -12.579  -6.610
  160   1HB   GLU  22          1HB       GLU  22   2.997 -10.720  -8.025
  161   2HB   GLU  22          2HB       GLU  22   2.974 -10.639  -6.286
  162   1HG   GLU  22          1HG       GLU  22   5.102  -9.917  -7.310
  163   2HG   GLU  22          2HG       GLU  22   5.306 -11.149  -6.080
  164    H    GLU  23           HN       GLU  23   2.396 -15.137  -7.525
  165    HA   GLU  23           HA       GLU  23   3.078 -15.100 -10.336
  166   1HB   GLU  23          2HB       GLU  23   2.176 -17.218 -10.533
  167   2HB   GLU  23          1HB       GLU  23   3.082 -17.201  -9.015
  168   1HG   GLU  23          1HG       GLU  23   0.049 -17.249  -9.428
  169   2HG   GLU  23          2HG       GLU  23   1.069 -18.589  -8.939
  170    H    HIS  24           HN       HIS  24   0.002 -15.065  -8.584
  171    HA   HIS  24           HA       HIS  24  -1.056 -13.199 -10.629
  172   1HB   HIS  24          2HB       HIS  24  -3.114 -14.401 -10.865
  173   2HB   HIS  24          1HB       HIS  24  -1.866 -15.639 -11.003
  174    HD2  HIS  24           HD2      HIS  24  -4.718 -14.462  -8.583
  175    HE1  HIS  24           HE1      HIS  24  -3.173 -18.102  -7.086
  176    HE2  HIS  24           HE2      HIS  24  -5.018 -16.323  -6.797
  177    H    LYS  25           HN       LYS  25  -0.177 -13.215  -7.674
  178    HA   LYS  25           HA       LYS  25  -2.635 -12.201  -6.387
  179   1HB   LYS  25          2HB       LYS  25   0.137 -12.037  -5.176
  180   2HB   LYS  25          1HB       LYS  25  -1.424 -11.945  -4.374
  181   1HG   LYS  25          2HG       LYS  25  -0.064 -14.362  -5.578
  182   2HG   LYS  25          1HG       LYS  25  -0.416 -14.067  -3.892
  183   1HD   LYS  25          1HD       LYS  25  -2.476 -14.652  -6.080
  184   2HD   LYS  25          2HD       LYS  25  -1.925 -15.743  -4.808
  185   1HE   LYS  25          2HE       LYS  25  -2.802 -14.019  -3.109
  186   2HE   LYS  25          1HE       LYS  25  -3.571 -13.198  -4.480
  187   1HZ   LYS  25          1HZ       LYS  25  -4.050 -15.992  -3.744
  188   2HZ   LYS  25          2HZ       LYS  25  -5.013 -14.721  -3.342
  189   3HZ   LYS  25          3HZ       LYS  25  -4.840 -15.142  -4.917
  190    HA   PRO  26           HA       PRO  26  -1.447  -8.099  -7.849
  191   1HB   PRO  26          2HB       PRO  26  -3.424  -6.571  -6.758
  192   2HB   PRO  26          1HB       PRO  26  -3.711  -7.685  -8.117
  193   1HG   PRO  26          1HG       PRO  26  -4.110  -8.226  -5.188
  194   2HG   PRO  26          2HG       PRO  26  -5.343  -8.441  -6.448
  195   1HD   PRO  26          2HD       PRO  26  -3.773 -10.463  -5.452
  196   2HD   PRO  26          1HD       PRO  26  -4.122 -10.428  -7.204
  197    H    ILE  27           HN       ILE  27   0.327  -7.071  -7.056
  198    HA   ILE  27           HA       ILE  27   0.396  -6.375  -4.167
  199    HB   ILE  27           HB       ILE  27   2.504  -6.040  -6.318
  200   1HG1  ILE  27          1HG11     ILE  27   2.384  -8.102  -4.078
  201   2HG1  ILE  27          2HG12     ILE  27   2.012  -8.444  -5.773
  202   1HG2  ILE  27          2HG22     ILE  27   2.555  -4.409  -4.369
  203   2HG2  ILE  27          3HG23     ILE  27   2.734  -5.804  -3.290
  204   3HG2  ILE  27          1HG21     ILE  27   3.981  -5.419  -4.498
  205   1HD1  ILE  27          1HD11     ILE  27   4.698  -7.434  -4.755
  206   2HD1  ILE  27          2HD12     ILE  27   4.296  -9.084  -5.215
  207   3HD1  ILE  27          3HD13     ILE  27   4.279  -7.795  -6.444
  208    H    VAL  28           HN       VAL  28  -0.912  -4.654  -3.855
  209    HA   VAL  28           HA       VAL  28  -1.206  -2.580  -5.955
  210    HB   VAL  28           HB       VAL  28  -2.684  -3.001  -3.333
  211   1HG1  VAL  28          3HG13     VAL  28  -3.249  -1.192  -5.735
  212   2HG1  VAL  28          2HG12     VAL  28  -4.299  -1.392  -4.319
  213   3HG1  VAL  28          1HG11     VAL  28  -2.702  -0.640  -4.143
  214   1HG2  VAL  28          2HG22     VAL  28  -3.073  -4.838  -5.011
  215   2HG2  VAL  28          1HG21     VAL  28  -4.500  -3.870  -4.663
  216   3HG2  VAL  28          3HG23     VAL  28  -3.601  -3.612  -6.176
  217    H    VAL  29           HN       VAL  29   0.341  -1.029  -5.827
  218    HA   VAL  29           HA       VAL  29   1.353  -0.302  -3.094
  219    HB   VAL  29           HB       VAL  29   3.094  -1.291  -4.418
  220   1HG1  VAL  29          1HG11     VAL  29   2.269  -0.675  -6.687
  221   2HG1  VAL  29          3HG13     VAL  29   2.788   0.998  -6.379
  222   3HG1  VAL  29          2HG12     VAL  29   3.976  -0.316  -6.414
  223   1HG2  VAL  29          1HG21     VAL  29   3.467   0.606  -2.774
  224   2HG2  VAL  29          2HG22     VAL  29   4.717   0.460  -4.011
  225   3HG2  VAL  29          3HG23     VAL  29   3.492   1.729  -4.146
  226    H    ASP  30           HN       ASP  30   0.868   1.552  -2.321
  227    HA   ASP  30           HA       ASP  30  -0.372   3.664  -3.997
  228   1HB   ASP  30          1HB       ASP  30  -1.517   3.017  -1.976
  229   2HB   ASP  30          2HB       ASP  30  -0.064   3.262  -0.996
  230    H    PHE  31           HN       PHE  31   1.286   4.719  -5.067
  231    HA   PHE  31           HA       PHE  31   3.682   5.656  -3.581
  232   1HB   PHE  31          1HB       PHE  31   2.767   6.040  -6.452
  233   2HB   PHE  31          2HB       PHE  31   4.191   6.754  -5.740
  234    HD1  PHE  31           HD2      PHE  31   6.146   5.392  -5.067
  235    HD2  PHE  31           HD1      PHE  31   2.764   3.674  -7.119
  236    HE1  PHE  31           HE2      PHE  31   7.623   3.674  -6.058
  237    HE2  PHE  31           HE1      PHE  31   4.271   2.016  -8.182
  238    HZ   PHE  31           HZ       PHE  31   6.697   2.031  -7.693
  239    H    THR  32           HN       THR  32   2.927   7.114  -2.101
  240    HA   THR  32           HA       THR  32   1.448   9.539  -3.068
  241    HB   THR  32           HB       THR  32  -0.166   8.112  -1.954
  242    HG1  THR  32           HG1      THR  32  -0.275  10.340  -1.591
  243   1HG2  THR  32          3HG23     THR  32   1.661   8.210   0.497
  244   2HG2  THR  32          1HG21     THR  32   0.007   7.573   0.422
  245   3HG2  THR  32          2HG22     THR  32   1.303   6.759  -0.472
  246    H    ALA  33           HN       ALA  33   1.707  10.585  -0.270
  247    HA   ALA  33           HA       ALA  33   4.384  10.351   0.582
  248   1HB   ALA  33          2HB       ALA  33   3.804  12.939  -0.951
  249   2HB   ALA  33          3HB       ALA  33   5.211  12.632   0.085
  250   3HB   ALA  33          1HB       ALA  33   5.005  11.711  -1.396
  251    H    THR  34           HN       THR  34   4.923  11.787   2.348
  252    HA   THR  34           HA       THR  34   2.768  12.168   4.187
  253    HB   THR  34           HB       THR  34   4.728  13.438   5.388
  254    HG1  THR  34           HG1      THR  34   6.338  12.129   3.478
  255   1HG2  THR  34          3HG23     THR  34   5.021  10.515   4.536
  256   2HG2  THR  34          1HG21     THR  34   5.923  11.294   5.855
  257   3HG2  THR  34          2HG22     THR  34   4.158  11.131   5.957
  258    H    TRP  35           HN       TRP  35   4.981  14.488   2.734
  259    HA   TRP  35           HA       TRP  35   3.953  16.853   3.623
  260   1HB   TRP  35          2HB       TRP  35   5.114  17.920   1.766
  261   2HB   TRP  35          1HB       TRP  35   6.073  16.622   2.464
  262    HD1  TRP  35           HD1      TRP  35   6.696  14.588   0.913
  263    HE1  TRP  35           HE1      TRP  35   6.511  14.156  -1.633
  264    HE3  TRP  35           HE3      TRP  35   3.592  18.459  -0.397
  265    HZ2  TRP  35           HZ2      TRP  35   5.159  15.266  -3.880
  266    HZ3  TRP  35           HZ3      TRP  35   2.882  18.739  -2.750
  267    HH2  TRP  35           HH2      TRP  35   3.634  17.136  -4.493
  268    H    CYS  36           HN       CYS  36   2.529  15.052   0.879
  269    HA   CYS  36           HA       CYS  36   0.986  17.384  -0.008
  270   1HB   CYS  36          1HB       CYS  36  -0.050  15.790  -1.601
  271   2HB   CYS  36          2HB       CYS  36   1.688  15.971  -1.699
  272    H    GLY  37           HN       GLY  37   0.378  17.393   2.452
  273   1HA   GLY  37          1HA       GLY  37  -1.126  16.830   4.182
  274   2HA   GLY  37          2HA       GLY  37  -2.000  17.907   3.093
  275    HA   PRO  38           HA       PRO  38  -5.437  15.116   2.778
  276   1HB   PRO  38          1HB       PRO  38  -4.857  15.166  -0.205
  277   2HB   PRO  38          2HB       PRO  38  -6.451  15.206   0.608
  278   1HG   PRO  38          1HG       PRO  38  -5.340  17.527  -0.221
  279   2HG   PRO  38          2HG       PRO  38  -6.036  17.436   1.425
  280   1HD   PRO  38          2HD       PRO  38  -3.133  17.299   0.613
  281   2HD   PRO  38          1HD       PRO  38  -3.896  18.133   1.997
  282    H    CYS  39           HN       CYS  39  -2.592  14.234   0.868
  283    HA   CYS  39           HA       CYS  39  -2.891  11.528   0.323
  284   1HB   CYS  39          2HB       CYS  39  -0.517  13.154   1.305
  285   2HB   CYS  39          1HB       CYS  39  -0.401  11.483   0.799
  286    H    LYS  40           HN       LYS  40  -1.934  13.059   3.413
  287    HA   LYS  40           HA       LYS  40  -1.346  10.614   4.785
  288   1HB   LYS  40          2HB       LYS  40  -0.510  12.949   5.304
  289   2HB   LYS  40          1HB       LYS  40  -2.120  13.340   5.930
  290   1HG   LYS  40          1HG       LYS  40  -1.875  11.587   7.664
  291   2HG   LYS  40          2HG       LYS  40  -0.303  11.121   6.981
  292   1HD   LYS  40          1HD       LYS  40   0.575  13.399   7.455
  293   2HD   LYS  40          2HD       LYS  40  -1.002  13.870   8.120
  294   1HE   LYS  40          1HE       LYS  40  -0.787  12.112   9.872
  295   2HE   LYS  40          2HE       LYS  40   0.789  11.641   9.207
  296   1HZ   LYS  40          1HZ       LYS  40   1.583  13.836   9.707
  297   2HZ   LYS  40          3HZ       LYS  40   0.118  14.273  10.325
  298   3HZ   LYS  40          2HZ       LYS  40   1.010  13.103  11.067
  299    H    MET  41           HN       MET  41  -4.354  12.205   4.000
  300    HA   MET  41           HA       MET  41  -5.915  10.819   6.102
  301   1HB   MET  41          2HB       MET  41  -6.856  12.674   3.873
  302   2HB   MET  41          1HB       MET  41  -7.771  12.125   5.278
  303   1HG   MET  41          2HG       MET  41  -6.223  13.337   6.774
  304   2HG   MET  41          1HG       MET  41  -5.282  13.888   5.377
  305   1HE   MET  41          3HE       MET  41  -6.283  15.849   7.582
  306   2HE   MET  41          1HE       MET  41  -5.366  16.350   6.138
  307   3HE   MET  41          2HE       MET  41  -6.869  17.196   6.577
  308    H    ILE  42           HN       ILE  42  -5.331  10.897   2.616
  309    HA   ILE  42           HA       ILE  42  -7.221   8.883   1.853
  310    HB   ILE  42           HB       ILE  42  -4.620   9.854   0.607
  311   1HG1  ILE  42          2HG12     ILE  42  -7.442  10.314  -0.410
  312   2HG1  ILE  42          1HG11     ILE  42  -6.822  11.336   0.886
  313   1HG2  ILE  42          1HG21     ILE  42  -6.731   7.966  -0.535
  314   2HG2  ILE  42          2HG22     ILE  42  -5.478   8.759  -1.505
  315   3HG2  ILE  42          3HG23     ILE  42  -5.014   7.602  -0.263
  316   1HD1  ILE  42          1HD11     ILE  42  -5.358  10.990  -1.747
  317   2HD1  ILE  42          3HD13     ILE  42  -6.486  12.315  -1.377
  318   3HD1  ILE  42          2HD12     ILE  42  -4.992  12.129  -0.450
  319    H    ALA  43           HN       ALA  43  -3.756   8.678   2.833
  320    HA   ALA  43           HA       ALA  43  -3.314   5.992   2.401
  321   1HB   ALA  43          2HB       ALA  43  -2.295   7.837   4.599
  322   2HB   ALA  43          3HB       ALA  43  -1.739   6.151   4.418
  323   3HB   ALA  43          1HB       ALA  43  -1.515   7.324   3.108
  324    HA   PRO  44           HA       PRO  44  -5.447   4.817   6.737
  325   1HB   PRO  44          2HB       PRO  44  -7.419   7.114   6.505
  326   2HB   PRO  44          1HB       PRO  44  -6.970   6.193   7.968
  327   1HG   PRO  44          1HG       PRO  44  -5.854   8.620   7.356
  328   2HG   PRO  44          2HG       PRO  44  -4.886   7.317   8.108
  329   1HD   PRO  44          2HD       PRO  44  -4.753   8.324   5.319
  330   2HD   PRO  44          1HD       PRO  44  -3.570   7.419   6.291
  331    H    LEU  45           HN       LEU  45  -7.314   6.414   4.133
  332    HA   LEU  45           HA       LEU  45  -9.528   4.552   4.152
  333   1HB   LEU  45          1HB       LEU  45  -8.443   6.204   1.815
  334   2HB   LEU  45          2HB       LEU  45  -9.983   5.398   1.887
  335    HG   LEU  45           HG       LEU  45  -9.019   7.783   3.540
  336   1HD1  LEU  45          3HD13     LEU  45  -9.768   8.226   1.228
  337   2HD1  LEU  45          2HD12     LEU  45 -11.333   7.464   1.607
  338   3HD1  LEU  45          1HD11     LEU  45 -10.845   8.962   2.430
  339   1HD2  LEU  45          1HD21     LEU  45 -11.625   6.217   3.840
  340   2HD2  LEU  45          3HD23     LEU  45 -10.372   6.448   5.084
  341   3HD2  LEU  45          2HD22     LEU  45 -11.328   7.825   4.533
  342    H    PHE  46           HN       PHE  46  -6.555   4.820   2.231
  343    HA   PHE  46           HA       PHE  46  -6.925   2.440   0.697
  344   1HB   PHE  46          1HB       PHE  46  -5.380   4.158   0.091
  345   2HB   PHE  46          2HB       PHE  46  -4.444   3.961   1.566
  346    HD1  PHE  46           HD2      PHE  46  -5.661   1.642  -1.163
  347    HD2  PHE  46           HD1      PHE  46  -2.427   2.817   1.425
  348    HE1  PHE  46           HE2      PHE  46  -4.129   0.133  -2.385
  349    HE2  PHE  46           HE1      PHE  46  -0.963   1.125   0.360
  350    HZ   PHE  46           HZ       PHE  46  -1.735  -0.078  -1.669
  351    H    GLU  47           HN       GLU  47  -5.357   2.943   3.906
  352    HA   GLU  47           HA       GLU  47  -4.531   0.248   4.232
  353   1HB   GLU  47          2HB       GLU  47  -3.618   1.977   5.637
  354   2HB   GLU  47          1HB       GLU  47  -5.220   2.437   6.223
  355   1HG   GLU  47          2HG       GLU  47  -3.992   1.238   7.935
  356   2HG   GLU  47          1HG       GLU  47  -5.447   0.363   7.479
  357    H    THR  48           HN       THR  48  -7.622   1.902   4.995
  358    HA   THR  48           HA       THR  48  -8.873  -0.309   6.287
  359    HB   THR  48           HB       THR  48 -10.242   1.775   4.521
  360    HG1  THR  48           HG1      THR  48  -8.876   2.736   6.132
  361   1HG2  THR  48          1HG21     THR  48 -11.198   0.176   6.934
  362   2HG2  THR  48          3HG23     THR  48 -12.119   1.428   6.078
  363   3HG2  THR  48          2HG22     THR  48 -11.707  -0.086   5.250
  364    H    LEU  49           HN       LEU  49  -8.826   0.677   2.812
  365    HA   LEU  49           HA       LEU  49 -10.212  -1.596   1.821
  366   1HB   LEU  49          1HB       LEU  49  -9.663   0.547   0.569
  367   2HB   LEU  49          2HB       LEU  49  -7.995  -0.031   0.433
  368    HG   LEU  49           HG       LEU  49  -8.891  -2.041  -0.817
  369   1HD1  LEU  49          1HD21     LEU  49 -11.458  -0.379  -0.652
  370   2HD1  LEU  49          2HD22     LEU  49 -11.199  -1.662  -1.836
  371   3HD1  LEU  49          3HD23     LEU  49 -11.235  -2.062  -0.119
  372   1HD2  LEU  49          3HD13     LEU  49  -7.886  -0.062  -1.923
  373   2HD2  LEU  49          2HD12     LEU  49  -9.154  -0.806  -2.902
  374   3HD2  LEU  49          1HD11     LEU  49  -9.492   0.695  -2.013
  375    H    SER  50           HN       SER  50  -6.784  -1.060   2.617
  376    HA   SER  50           HA       SER  50  -5.768  -3.387   1.469
  377   1HB   SER  50          1HB       SER  50  -4.695  -2.056   3.981
  378   2HB   SER  50          2HB       SER  50  -3.868  -3.179   2.914
  379    HG   SER  50           HG       SER  50  -4.908  -0.744   1.926
  380    H    ASN  51           HN       ASN  51  -7.085  -2.802   4.715
  381    HA   ASN  51           HA       ASN  51  -6.702  -5.512   5.649
  382   1HB   ASN  51          2HB       ASN  51  -8.518  -3.258   6.582
  383   2HB   ASN  51          1HB       ASN  51  -8.514  -4.867   7.312
  384   1HD2  ASN  51          2HD22     ASN  51  -5.234  -2.421   7.883
  385   2HD2  ASN  51          1HD21     ASN  51  -6.397  -2.052   6.621
  386    H    ASP  52           HN       ASP  52  -9.455  -3.801   4.077
  387    HA   ASP  52           HA       ASP  52 -11.393  -5.766   4.162
  388   1HB   ASP  52          1HB       ASP  52 -11.738  -3.533   3.170
  389   2HB   ASP  52          2HB       ASP  52 -10.757  -3.990   1.767
  390    H    TYR  53           HN       TYR  53  -8.828  -5.563   1.601
  391    HA   TYR  53           HA       TYR  53  -9.542  -8.381   0.806
  392   1HB   TYR  53          2HB       TYR  53  -7.680  -6.466  -0.573
  393   2HB   TYR  53          1HB       TYR  53  -8.282  -7.997  -1.167
  394    HD1  TYR  53           HD2      TYR  53 -10.483  -8.232  -2.146
  395    HD2  TYR  53           HD1      TYR  53  -8.994  -4.431  -0.789
  396    HE1  TYR  53           HE2      TYR  53 -11.733  -7.091  -3.941
  397    HE2  TYR  53           HE1      TYR  53 -10.045  -3.334  -2.724
  398    HH   TYR  53           HH       TYR  53 -11.458  -3.665  -4.701
  399    H    ALA  54           HN       ALA  54  -8.032  -7.826   3.355
  400    HA   ALA  54           HA       ALA  54  -5.274  -8.122   3.041
  401   1HB   ALA  54          2HB       ALA  54  -7.107  -9.278   5.195
  402   2HB   ALA  54          3HB       ALA  54  -5.338  -9.163   5.323
  403   3HB   ALA  54          1HB       ALA  54  -6.307  -7.690   5.214
  404    H    GLY  55           HN       GLY  55  -3.843  -9.911   3.104
  405   1HA   GLY  55          1HA       GLY  55  -3.121 -12.091   2.823
  406   2HA   GLY  55          2HA       GLY  55  -4.793 -12.663   2.942
  407    H    LYS  56           HN       LYS  56  -6.183 -11.750   0.972
  408    HA   LYS  56           HA       LYS  56  -5.316 -13.095  -1.386
  409   1HB   LYS  56          2HB       LYS  56  -7.388 -10.910  -0.883
  410   2HB   LYS  56          1HB       LYS  56  -7.160 -11.636  -2.467
  411   1HG   LYS  56          2HG       LYS  56  -7.949 -13.133   0.072
  412   2HG   LYS  56          1HG       LYS  56  -9.050 -12.610  -1.200
  413   1HD   LYS  56          1HD       LYS  56  -6.883 -14.741  -1.396
  414   2HD   LYS  56          2HD       LYS  56  -8.625 -14.949  -1.513
  415   1HE   LYS  56          2HE       LYS  56  -6.818 -13.585  -3.571
  416   2HE   LYS  56          1HE       LYS  56  -7.641 -15.134  -3.715
  417   1HZ   LYS  56          3HZ       LYS  56  -8.973 -12.531  -3.484
  418   2HZ   LYS  56          2HZ       LYS  56  -8.761 -13.394  -4.868
  419   3HZ   LYS  56          1HZ       LYS  56  -9.723 -13.991  -3.669
  420    H    VAL  57           HN       VAL  57  -5.403  -9.578  -0.623
  421    HA   VAL  57           HA       VAL  57  -3.681  -9.057  -3.019
  422    HB   VAL  57           HB       VAL  57  -5.561  -7.341  -1.393
  423   1HG1  VAL  57          1HG11     VAL  57  -3.948  -6.619  -3.875
  424   2HG1  VAL  57          3HG13     VAL  57  -5.236  -5.638  -3.182
  425   3HG1  VAL  57          2HG12     VAL  57  -3.752  -5.933  -2.273
  426   1HG2  VAL  57          3HG23     VAL  57  -5.930  -8.572  -4.119
  427   2HG2  VAL  57          1HG21     VAL  57  -6.846  -8.904  -2.661
  428   3HG2  VAL  57          2HG22     VAL  57  -6.972  -7.318  -3.418
  429    H    ILE  58           HN       ILE  58  -1.749  -7.930  -2.776
  430    HA   ILE  58           HA       ILE  58  -0.754  -7.720   0.051
  431    HB   ILE  58           HB       ILE  58   0.898  -7.517  -2.473
  432   1HG1  ILE  58          1HG11     ILE  58  -0.125  -9.696  -2.659
  433   2HG1  ILE  58          2HG12     ILE  58   1.571  -9.840  -2.232
  434   1HG2  ILE  58          2HG22     ILE  58   1.587  -8.156   0.419
  435   2HG2  ILE  58          3HG23     ILE  58   2.726  -8.140  -0.942
  436   3HG2  ILE  58          1HG21     ILE  58   1.922  -6.645  -0.441
  437   1HD1  ILE  58          3HD13     ILE  58  -0.742 -10.139  -0.263
  438   2HD1  ILE  58          2HD12     ILE  58   0.171 -11.453  -1.017
  439   3HD1  ILE  58          1HD11     ILE  58   0.992 -10.355   0.098
  440    H    PHE  59           HN       PHE  59  -0.388  -5.617   0.854
  441    HA   PHE  59           HA       PHE  59  -0.949  -3.368  -1.052
  442   1HB   PHE  59          1HB       PHE  59  -1.895  -3.714   1.779
  443   2HB   PHE  59          2HB       PHE  59  -1.970  -2.215   0.873
  444    HD1  PHE  59           HD2      PHE  59  -3.459  -1.920  -1.020
  445    HD2  PHE  59           HD1      PHE  59  -3.334  -5.676   1.083
  446    HE1  PHE  59           HE2      PHE  59  -5.691  -2.497  -1.934
  447    HE2  PHE  59           HE1      PHE  59  -5.648  -6.125   0.410
  448    HZ   PHE  59           HZ       PHE  59  -6.794  -4.593  -1.232
  449    H    LEU  60           HN       LEU  60   0.686  -2.132  -1.295
  450    HA   LEU  60           HA       LEU  60   2.769  -1.823   0.829
  451   1HB   LEU  60          1HB       LEU  60   2.858  -1.680  -2.200
  452   2HB   LEU  60          2HB       LEU  60   4.230  -1.273  -1.140
  453    HG   LEU  60           HG       LEU  60   2.893  -3.982  -1.584
  454   1HD1  LEU  60          3HD23     LEU  60   5.662  -2.869  -2.209
  455   2HD1  LEU  60          1HD21     LEU  60   5.152  -4.546  -2.492
  456   3HD1  LEU  60          2HD22     LEU  60   4.391  -3.209  -3.381
  457   1HD2  LEU  60          2HD12     LEU  60   5.099  -3.215   0.371
  458   2HD2  LEU  60          1HD11     LEU  60   3.525  -3.959   0.745
  459   3HD2  LEU  60          3HD13     LEU  60   4.741  -4.879  -0.142
  460    H    LYS  61           HN       LYS  61   3.547   0.196   1.226
  461    HA   LYS  61           HA       LYS  61   2.029   2.571   0.173
  462   1HB   LYS  61          1HB       LYS  61   1.317   2.112   2.415
  463   2HB   LYS  61          2HB       LYS  61   2.966   1.747   2.923
  464   1HG   LYS  61          2HG       LYS  61   2.411   3.783   3.896
  465   2HG   LYS  61          1HG       LYS  61   3.582   4.167   2.644
  466   1HD   LYS  61          2HD       LYS  61   1.676   4.864   1.140
  467   2HD   LYS  61          1HD       LYS  61   0.536   4.481   2.437
  468   1HE   LYS  61          1HE       LYS  61   2.733   6.608   2.509
  469   2HE   LYS  61          2HE       LYS  61   0.985   6.884   2.413
  470   1HZ   LYS  61          2HZ       LYS  61   0.757   5.876   4.560
  471   2HZ   LYS  61          3HZ       LYS  61   2.391   5.693   4.683
  472   3HZ   LYS  61          1HZ       LYS  61   1.737   7.200   4.605
  473    H    VAL  62           HN       VAL  62   3.394   4.160  -0.742
  474    HA   VAL  62           HA       VAL  62   6.272   4.110   0.071
  475    HB   VAL  62           HB       VAL  62   5.185   4.091  -2.784
  476   1HG1  VAL  62          3HG13     VAL  62   7.987   4.506  -1.677
  477   2HG1  VAL  62          1HG11     VAL  62   7.647   4.151  -3.382
  478   3HG1  VAL  62          2HG12     VAL  62   7.067   5.660  -2.667
  479   1HG2  VAL  62          1HG21     VAL  62   7.002   2.168  -1.291
  480   2HG2  VAL  62          3HG23     VAL  62   5.336   1.828  -1.806
  481   3HG2  VAL  62          2HG22     VAL  62   6.600   2.067  -3.017
  482    H    ASP  63           HN       ASP  63   7.043   6.084   0.537
  483    HA   ASP  63           HA       ASP  63   5.421   8.461  -0.186
  484   1HB   ASP  63          2HB       ASP  63   6.197   8.234   2.154
  485   2HB   ASP  63          1HB       ASP  63   7.875   8.263   1.594
  486    H    VAL  64           HN       VAL  64   5.896   9.129  -2.256
  487    HA   VAL  64           HA       VAL  64   8.215   8.357  -3.693
  488    HB   VAL  64           HB       VAL  64   7.588  10.019  -5.350
  489   1HG1  VAL  64          2HG12     VAL  64   6.362   7.887  -5.275
  490   2HG1  VAL  64          1HG11     VAL  64   5.126   8.616  -4.228
  491   3HG1  VAL  64          3HG13     VAL  64   5.355   9.215  -5.878
  492   1HG2  VAL  64          3HG23     VAL  64   6.906  11.922  -3.892
  493   2HG2  VAL  64          1HG21     VAL  64   5.706  11.519  -5.126
  494   3HG2  VAL  64          2HG22     VAL  64   5.437  11.023  -3.454
  495    H    ASP  65           HN       ASP  65   7.846  10.982  -1.364
  496    HA   ASP  65           HA       ASP  65  10.027  12.619  -2.323
  497   1HB   ASP  65          2HB       ASP  65   8.267  13.378  -0.718
  498   2HB   ASP  65          1HB       ASP  65   8.973  12.323   0.520
  499    H    ALA  66           HN       ALA  66   9.662   9.815  -0.166
  500    HA   ALA  66           HA       ALA  66  12.474   9.874   0.702
  501   1HB   ALA  66          1HB       ALA  66  10.714   9.249   2.296
  502   2HB   ALA  66          3HB       ALA  66  10.216   7.902   1.252
  503   3HB   ALA  66          2HB       ALA  66  11.822   7.892   2.007
  504    H    VAL  67           HN       VAL  67  10.343   7.444  -0.966
  505    HA   VAL  67           HA       VAL  67  12.801   6.073  -1.885
  506    HB   VAL  67           HB       VAL  67   9.983   5.209  -2.552
  507   1HG1  VAL  67          1HG21     VAL  67  12.032   4.147  -3.590
  508   2HG1  VAL  67          2HG22     VAL  67  12.579   3.717  -1.969
  509   3HG1  VAL  67          3HG23     VAL  67  11.075   3.012  -2.607
  510   1HG2  VAL  67          3HG13     VAL  67  11.510   4.669   0.040
  511   2HG2  VAL  67          2HG12     VAL  67   9.928   5.465  -0.134
  512   3HG2  VAL  67          1HG11     VAL  67  10.097   3.747  -0.509
  513    H    ALA  68           HN       ALA  68  13.055   8.355  -2.950
  514    HA   ALA  68           HA       ALA  68  11.754   9.131  -5.289
  515   1HB   ALA  68          1HB       ALA  68  13.448  10.483  -4.128
  516   2HB   ALA  68          2HB       ALA  68  14.725   9.345  -4.615
  517   3HB   ALA  68          3HB       ALA  68  13.864  10.296  -5.844
  518    H    ALA  69           HN       ALA  69  14.512   6.867  -4.979
  519    HA   ALA  69           HA       ALA  69  15.036   6.372  -7.671
  520   1HB   ALA  69          1HB       ALA  69  15.207   4.441  -5.314
  521   2HB   ALA  69          3HB       ALA  69  16.013   4.242  -6.885
  522   3HB   ALA  69          2HB       ALA  69  16.455   5.598  -5.831
  523    H    VAL  70           HN       VAL  70  12.829   4.439  -5.560
  524    HA   VAL  70           HA       VAL  70  12.021   2.698  -7.715
  525    HB   VAL  70           HB       VAL  70  10.589   3.272  -5.089
  526   1HG1  VAL  70          1HG21     VAL  70   9.174   2.046  -6.731
  527   2HG1  VAL  70          2HG22     VAL  70  10.459   0.841  -6.926
  528   3HG1  VAL  70          3HG23     VAL  70   9.638   1.025  -5.364
  529   1HG2  VAL  70          1HG11     VAL  70  12.975   2.485  -4.754
  530   2HG2  VAL  70          2HG12     VAL  70  11.789   1.263  -4.269
  531   3HG2  VAL  70          3HG13     VAL  70  12.636   1.122  -5.827
  532    H    ALA  71           HN       ALA  71  10.646   5.639  -6.218
  533    HA   ALA  71           HA       ALA  71   8.230   5.738  -7.692
  534   1HB   ALA  71          1HB       ALA  71   8.746   7.188  -5.768
  535   2HB   ALA  71          2HB       ALA  71   9.946   8.072  -6.732
  536   3HB   ALA  71          3HB       ALA  71   8.230   8.140  -7.176
  537    H    GLU  72           HN       GLU  72  11.393   7.304  -8.571
  538    HA   GLU  72           HA       GLU  72  10.344   8.248 -11.085
  539   1HB   GLU  72          2HB       GLU  72  12.538   8.993 -11.579
  540   2HB   GLU  72          1HB       GLU  72  12.227   9.304  -9.868
  541   1HG   GLU  72          2HG       GLU  72  13.540   7.176  -9.371
  542   2HG   GLU  72          1HG       GLU  72  14.000   7.133 -11.076
  543    H    ALA  73           HN       ALA  73  12.186   5.284 -10.144
  544    HA   ALA  73           HA       ALA  73  12.592   4.309 -12.779
  545   1HB   ALA  73          3HB       ALA  73  12.089   2.761 -10.194
  546   2HB   ALA  73          2HB       ALA  73  12.768   2.095 -11.694
  547   3HB   ALA  73          1HB       ALA  73  13.665   3.329 -10.789
  548    H    ALA  74           HN       ALA  74   9.843   3.847 -10.509
  549    HA   ALA  74           HA       ALA  74   8.237   2.276 -12.294
  550   1HB   ALA  74          3HB       ALA  74   7.915   2.310  -9.857
  551   2HB   ALA  74          2HB       ALA  74   7.464   4.028  -9.918
  552   3HB   ALA  74          1HB       ALA  74   6.432   2.805 -10.688
  553    H    GLY  75           HN       GLY  75   8.691   5.742 -11.800
  554   1HA   GLY  75          1HA       GLY  75   8.440   7.368 -13.478
  555   2HA   GLY  75          2HA       GLY  75   7.354   6.300 -14.383
  556    H    ILE  76           HN       ILE  76   7.277   7.319 -10.930
  557    HA   ILE  76           HA       ILE  76   4.433   7.992 -11.196
  558    HB   ILE  76           HB       ILE  76   6.316   8.390  -8.830
  559   1HG1  ILE  76          1HG11     ILE  76   6.264   6.043  -9.493
  560   2HG1  ILE  76          2HG12     ILE  76   5.463   6.300  -7.956
  561   1HG2  ILE  76          3HG23     ILE  76   3.291   8.488  -9.168
  562   2HG2  ILE  76          1HG21     ILE  76   4.061   8.253  -7.587
  563   3HG2  ILE  76          2HG22     ILE  76   4.361   9.733  -8.505
  564   1HD1  ILE  76          1HD11     ILE  76   4.059   5.896 -10.644
  565   2HD1  ILE  76          2HD12     ILE  76   4.301   4.674  -9.401
  566   3HD1  ILE  76          3HD13     ILE  76   3.266   6.063  -9.058
  567    H    THR  77           HN       THR  77   3.540   9.958 -11.226
  568    HA   THR  77           HA       THR  77   5.266  12.401 -11.194
  569    HB   THR  77           HB       THR  77   3.910  13.204 -13.145
  570    HG1  THR  77           HG1      THR  77   2.899  11.403 -14.345
  571   1HG2  THR  77          3HG23     THR  77   6.185  12.174 -13.448
  572   2HG2  THR  77          1HG21     THR  77   5.407  10.605 -13.743
  573   3HG2  THR  77          2HG22     THR  77   5.125  11.959 -14.851
  574    H    ALA  78           HN       ALA  78   1.851  11.900 -11.911
  575    HA   ALA  78           HA       ALA  78   1.031  13.962 -10.020
  576   1HB   ALA  78          2HB       ALA  78  -0.069  13.654 -12.197
  577   2HB   ALA  78          1HB       ALA  78  -0.589  12.021 -11.726
  578   3HB   ALA  78          3HB       ALA  78  -1.228  13.443 -10.870
  579    H    MET  79           HN       MET  79   2.158  12.657  -8.204
  580    HA   MET  79           HA       MET  79   0.873  10.369  -7.130
  581   1HB   MET  79          1HB       MET  79   2.150  10.665  -5.182
  582   2HB   MET  79          2HB       MET  79   3.159  11.134  -6.541
  583   1HG   MET  79          2HG       MET  79   1.758  12.999  -4.574
  584   2HG   MET  79          1HG       MET  79   3.455  12.584  -4.575
  585   1HE   MET  79          3HE       MET  79   4.686  12.841  -7.214
  586   2HE   MET  79          1HE       MET  79   4.975  14.574  -7.471
  587   3HE   MET  79          2HE       MET  79   5.313  13.846  -5.883
  588    HA   PRO  80           HA       PRO  80  -0.065   9.565  -4.791
  589   1HB   PRO  80          2HB       PRO  80  -3.052   9.184  -4.969
  590   2HB   PRO  80          1HB       PRO  80  -1.935   8.613  -3.698
  591   1HG   PRO  80          2HG       PRO  80  -3.467  10.790  -3.258
  592   2HG   PRO  80          1HG       PRO  80  -1.755  10.835  -2.808
  593   1HD   PRO  80          1HD       PRO  80  -3.016  11.941  -5.339
  594   2HD   PRO  80          2HD       PRO  80  -1.875  12.741  -4.221
  595    H    THR  81           HN       THR  81   0.113   7.571  -5.903
  596    HA   THR  81           HA       THR  81  -1.503   7.155  -8.338
  597    HB   THR  81           HB       THR  81   1.526   7.296  -8.276
  598    HG1  THR  81           HG1      THR  81  -0.319   9.151  -8.810
  599   1HG2  THR  81          3HG23     THR  81  -0.390   6.523 -10.530
  600   2HG2  THR  81          1HG21     THR  81   1.342   6.840 -10.746
  601   3HG2  THR  81          2HG22     THR  81   0.811   5.468  -9.759
  602    H    PHE  82           HN       PHE  82  -2.191   5.155  -8.327
  603    HA   PHE  82           HA       PHE  82  -1.005   3.205  -6.432
  604   1HB   PHE  82          1HB       PHE  82  -3.740   3.435  -7.696
  605   2HB   PHE  82          2HB       PHE  82  -3.213   2.124  -6.654
  606    HD1  PHE  82           HD2      PHE  82  -4.114   5.734  -6.789
  607    HD2  PHE  82           HD1      PHE  82  -2.927   2.463  -4.226
  608    HE1  PHE  82           HE2      PHE  82  -4.742   7.055  -4.801
  609    HE2  PHE  82           HE1      PHE  82  -3.656   3.772  -2.246
  610    HZ   PHE  82           HZ       PHE  82  -4.508   6.060  -2.508
  611    H    HIS  83           HN       HIS  83   0.198   1.598  -7.351
  612    HA   HIS  83           HA       HIS  83  -0.326   0.840 -10.231
  613   1HB   HIS  83          2HB       HIS  83   2.176   0.771  -8.549
  614   2HB   HIS  83          1HB       HIS  83   1.986  -0.197 -10.023
  615    HD2  HIS  83           HD2      HIS  83   0.502   3.203 -10.625
  616    HE1  HIS  83           HE1      HIS  83   4.493   3.355 -12.010
  617    HE2  HIS  83           HE2      HIS  83   2.224   4.544 -12.066
  618    H    VAL  84           HN       VAL  84  -0.442  -1.366 -10.711
  619    HA   VAL  84           HA       VAL  84  -0.744  -3.192  -8.347
  620    HB   VAL  84           HB       VAL  84  -2.130  -3.515 -11.028
  621   1HG1  VAL  84          3HG23     VAL  84  -2.496  -4.744  -8.252
  622   2HG1  VAL  84          1HG21     VAL  84  -3.484  -5.110  -9.680
  623   3HG1  VAL  84          2HG22     VAL  84  -1.768  -5.559  -9.651
  624   1HG2  VAL  84          3HG13     VAL  84  -3.222  -2.308  -8.447
  625   2HG2  VAL  84          2HG12     VAL  84  -3.043  -1.468 -10.002
  626   3HG2  VAL  84          1HG11     VAL  84  -4.196  -2.798  -9.849
  627    H    TYR  85           HN       TYR  85   1.139  -4.293  -8.216
  628    HA   TYR  85           HA       TYR  85   2.576  -5.053 -10.694
  629   1HB   TYR  85          1HB       TYR  85   3.437  -4.824  -7.824
  630   2HB   TYR  85          2HB       TYR  85   4.376  -5.693  -9.030
  631    HD1  TYR  85           HD2      TYR  85   3.150  -2.387  -7.962
  632    HD2  TYR  85           HD1      TYR  85   5.612  -4.523 -10.769
  633    HE1  TYR  85           HE2      TYR  85   4.138  -0.243  -8.759
  634    HE2  TYR  85           HE1      TYR  85   6.485  -2.367 -11.645
  635    HH   TYR  85           HH       TYR  85   4.970   0.717 -10.735
  636    H    LYS  86           HN       LYS  86   2.161  -6.981 -11.488
  637    HA   LYS  86           HA       LYS  86   1.579  -9.358  -9.757
  638   1HB   LYS  86          2HB       LYS  86   1.555  -8.990 -12.784
  639   2HB   LYS  86          1HB       LYS  86   1.099 -10.469 -11.933
  640   1HG   LYS  86          1HG       LYS  86  -0.384  -7.809 -11.661
  641   2HG   LYS  86          2HG       LYS  86  -0.794  -9.093 -12.804
  642   1HD   LYS  86          1HD       LYS  86  -1.080 -10.685 -10.887
  643   2HD   LYS  86          2HD       LYS  86  -0.812  -9.335  -9.767
  644   1HE   LYS  86          2HE       LYS  86  -2.774  -8.140 -10.791
  645   2HE   LYS  86          1HE       LYS  86  -3.021  -9.509 -11.887
  646   1HZ   LYS  86          2HZ       LYS  86  -3.359 -10.896  -9.934
  647   2HZ   LYS  86          3HZ       LYS  86  -3.227  -9.580  -8.968
  648   3HZ   LYS  86          1HZ       LYS  86  -4.474  -9.693 -10.038
  649    H    ASP  87           HN       ASP  87   2.962 -11.342 -11.085
  650    HA   ASP  87           HA       ASP  87   5.785 -10.658 -11.054
  651   1HB   ASP  87          2HB       ASP  87   6.089 -12.815 -12.212
  652   2HB   ASP  87          1HB       ASP  87   5.157 -12.786 -10.724
  653    H    GLY  88           HN       GLY  88   3.304 -11.001 -13.407
  654   1HA   GLY  88          1HA       GLY  88   4.741  -9.871 -15.693
  655   2HA   GLY  88          2HA       GLY  88   2.974  -9.949 -15.523
  656    H    VAL  89           HN       VAL  89   5.424  -8.446 -13.492
  657    HA   VAL  89           HA       VAL  89   5.172  -6.604 -12.078
  658    HB   VAL  89           HB       VAL  89   6.732  -5.172 -13.139
  659   1HG1  VAL  89          3HG13     VAL  89   7.136  -7.665 -12.359
  660   2HG1  VAL  89          2HG12     VAL  89   7.326  -8.011 -14.075
  661   3HG1  VAL  89          1HG11     VAL  89   8.410  -6.875 -13.283
  662   1HG2  VAL  89          2HG22     VAL  89   5.662  -4.999 -15.432
  663   2HG2  VAL  89          1HG21     VAL  89   7.371  -5.446 -15.513
  664   3HG2  VAL  89          3HG23     VAL  89   6.116  -6.674 -15.749
  665    H    LYS  90           HN       LYS  90   5.113  -4.003 -13.611
  666    HA   LYS  90           HA       LYS  90   2.743  -3.023 -12.500
  667   1HB   LYS  90          1HB       LYS  90   4.751  -1.695 -13.340
  668   2HB   LYS  90          2HB       LYS  90   4.111  -1.891 -14.974
  669   1HG   LYS  90          1HG       LYS  90   1.887  -0.890 -13.927
  670   2HG   LYS  90          2HG       LYS  90   2.940  -0.377 -12.606
  671   1HD   LYS  90          1HD       LYS  90   3.174   0.339 -15.568
  672   2HD   LYS  90          2HD       LYS  90   2.633   1.400 -14.258
  673   1HE   LYS  90          2HE       LYS  90   4.919   1.177 -13.205
  674   2HE   LYS  90          1HE       LYS  90   5.450   0.266 -14.625
  675   1HZ   LYS  90          2HZ       LYS  90   4.359   2.987 -14.712
  676   2HZ   LYS  90          1HZ       LYS  90   5.958   2.628 -14.709
  677   3HZ   LYS  90          3HZ       LYS  90   5.007   2.144 -15.973
  678    H    ALA  91           HN       ALA  91   1.126  -4.576 -13.006
  679    HA   ALA  91           HA       ALA  91   0.336  -5.084 -15.734
  680   1HB   ALA  91          2HB       ALA  91   0.076  -6.746 -13.931
  681   2HB   ALA  91          1HB       ALA  91  -1.060  -5.672 -13.079
  682   3HB   ALA  91          3HB       ALA  91  -1.500  -6.361 -14.656
  683    H    ASP  92           HN       ASP  92  -0.565  -2.821 -13.182
  684    HA   ASP  92           HA       ASP  92  -2.251  -1.347 -15.066
  685   1HB   ASP  92          1HB       ASP  92  -3.553  -3.189 -13.605
  686   2HB   ASP  92          2HB       ASP  92  -3.528  -1.913 -12.384
  687    H    ASP  93           HN       ASP  93  -3.010   0.705 -14.068
  688    HA   ASP  93           HA       ASP  93  -1.292   1.891 -12.000
  689   1HB   ASP  93          1HB       ASP  93   0.072   2.293 -13.929
  690   2HB   ASP  93          2HB       ASP  93  -1.346   2.756 -14.903
  691    H    LEU  94           HN       LEU  94  -2.065   4.097 -11.656
  692    HA   LEU  94           HA       LEU  94  -4.668   4.997 -12.421
  693   1HB   LEU  94          2HB       LEU  94  -5.512   3.058 -11.214
  694   2HB   LEU  94          1HB       LEU  94  -4.494   3.418  -9.823
  695    HG   LEU  94           HG       LEU  94  -5.825   5.459  -9.361
  696   1HD1  LEU  94          2HD12     LEU  94  -7.299   4.592 -11.895
  697   2HD1  LEU  94          1HD11     LEU  94  -7.972   5.749 -10.732
  698   3HD1  LEU  94          3HD13     LEU  94  -6.493   6.148 -11.599
  699   1HD2  LEU  94          1HD21     LEU  94  -6.449   3.301  -8.393
  700   2HD2  LEU  94          2HD22     LEU  94  -7.866   4.314  -8.680
  701   3HD2  LEU  94          3HD23     LEU  94  -7.507   2.964  -9.774
  702    H    VAL  95           HN       VAL  95  -3.935   7.097 -12.392
  703    HA   VAL  95           HA       VAL  95  -2.349   8.135 -10.164
  704    HB   VAL  95           HB       VAL  95  -2.430  10.242 -11.413
  705   1HG1  VAL  95          2HG22     VAL  95  -0.669   8.603 -11.887
  706   2HG1  VAL  95          1HG21     VAL  95  -1.677   7.845 -13.139
  707   3HG1  VAL  95          3HG23     VAL  95  -1.106   9.513 -13.341
  708   1HG2  VAL  95          2HG12     VAL  95  -4.684  10.037 -12.461
  709   2HG2  VAL  95          3HG13     VAL  95  -3.410  10.405 -13.632
  710   3HG2  VAL  95          1HG11     VAL  95  -4.059   8.762 -13.531
  711    H    GLY  96           HN       GLY  96  -2.988   9.983  -8.898
  712   1HA   GLY  96          1HA       GLY  96  -4.394  11.460  -7.857
  713   2HA   GLY  96          2HA       GLY  96  -5.746  10.931  -8.882
  714    H    ALA  97           HN       ALA  97  -6.307  11.409  -6.329
  715    HA   ALA  97           HA       ALA  97  -6.116   9.073  -4.589
  716   1HB   ALA  97          2HB       ALA  97  -6.152  11.449  -3.810
  717   2HB   ALA  97          1HB       ALA  97  -7.821  11.593  -4.386
  718   3HB   ALA  97          3HB       ALA  97  -7.436  10.453  -3.078
  719    H    SER  98           HN       SER  98  -7.191   8.254  -7.033
  720    HA   SER  98           HA       SER  98 -10.056   8.452  -7.167
  721   1HB   SER  98          1HB       SER  98  -8.224   6.565  -8.681
  722   2HB   SER  98          2HB       SER  98  -9.746   7.291  -9.219
  723    HG   SER  98           HG       SER  98  -7.281   8.294  -9.540
  724    H    GLN  99           HN       GLN  99  -9.943   7.555  -4.755
  725    HA   GLN  99           HA       GLN  99  -9.528   4.967  -4.005
  726   1HB   GLN  99          2HB       GLN  99 -11.316   5.334  -2.289
  727   2HB   GLN  99          1HB       GLN  99 -10.096   6.603  -2.415
  728   1HG   GLN  99          1HG       GLN  99 -11.692   8.041  -3.681
  729   2HG   GLN  99          2HG       GLN  99 -12.911   6.759  -3.582
  730   1HE2  GLN  99          1HE21     GLN  99 -11.960   8.714  -0.078
  731   2HE2  GLN  99          2HE22     GLN  99 -10.654   8.387  -1.201
  732    H    ASP 100           HN       ASP 100 -12.603   6.012  -5.602
  733    HA   ASP 100           HA       ASP 100 -13.853   3.436  -5.348
  734   1HB   ASP 100          1HB       ASP 100 -15.149   5.456  -5.822
  735   2HB   ASP 100          2HB       ASP 100 -14.306   5.680  -7.368
  736    H    LYS 101           HN       LYS 101 -11.972   4.961  -7.976
  737    HA   LYS 101           HA       LYS 101 -12.186   2.787  -9.807
  738   1HB   LYS 101          2HB       LYS 101 -11.549   5.138 -10.383
  739   2HB   LYS 101          1HB       LYS 101 -10.020   4.918  -9.531
  740   1HG   LYS 101          2HG       LYS 101  -9.752   4.735 -11.948
  741   2HG   LYS 101          1HG       LYS 101  -9.324   3.205 -11.153
  742   1HD   LYS 101          1HD       LYS 101 -11.404   2.192 -11.839
  743   2HD   LYS 101          2HD       LYS 101 -12.058   3.762 -12.358
  744   1HE   LYS 101          2HE       LYS 101 -11.349   2.396 -14.292
  745   2HE   LYS 101          1HE       LYS 101 -10.401   3.887 -14.178
  746   1HZ   LYS 101          2HZ       LYS 101  -9.536   1.238 -13.243
  747   2HZ   LYS 101          3HZ       LYS 101  -9.044   1.974 -14.633
  748   3HZ   LYS 101          1HZ       LYS 101  -8.643   2.622 -13.173
  749    H    LEU 102           HN       LEU 102  -9.900   3.608  -7.201
  750    HA   LEU 102           HA       LEU 102  -8.027   1.527  -7.629
  751   1HB   LEU 102          1HB       LEU 102  -7.685   3.458  -6.092
  752   2HB   LEU 102          2HB       LEU 102  -8.890   2.806  -4.981
  753    HG   LEU 102           HG       LEU 102  -7.523   0.779  -4.611
  754   1HD1  LEU 102          3HD23     LEU 102  -5.549   2.299  -6.349
  755   2HD1  LEU 102          2HD22     LEU 102  -5.082   0.969  -5.268
  756   3HD1  LEU 102          1HD21     LEU 102  -6.162   0.655  -6.634
  757   1HD2  LEU 102          1HD11     LEU 102  -6.327   3.534  -4.118
  758   2HD2  LEU 102          2HD12     LEU 102  -7.421   2.625  -3.052
  759   3HD2  LEU 102          3HD13     LEU 102  -5.764   2.048  -3.335
  760    H    LYS 103           HN       LYS 103 -10.868   1.636  -5.394
  761    HA   LYS 103           HA       LYS 103 -10.870  -0.967  -4.456
  762   1HB   LYS 103          2HB       LYS 103 -12.444   0.881  -3.859
  763   2HB   LYS 103          1HB       LYS 103 -13.326   0.620  -5.354
  764   1HG   LYS 103          2HG       LYS 103 -13.910  -1.660  -4.706
  765   2HG   LYS 103          1HG       LYS 103 -12.972  -1.507  -3.210
  766   1HD   LYS 103          1HD       LYS 103 -14.418   0.407  -2.512
  767   2HD   LYS 103          2HD       LYS 103 -15.396   0.193  -3.972
  768   1HE   LYS 103          1HE       LYS 103 -14.995  -1.893  -1.766
  769   2HE   LYS 103          2HE       LYS 103 -16.423  -0.865  -1.969
  770   1HZ   LYS 103          3HZ       LYS 103 -16.777  -1.884  -4.107
  771   2HZ   LYS 103          2HZ       LYS 103 -15.472  -2.871  -3.889
  772   3HZ   LYS 103          1HZ       LYS 103 -16.779  -3.007  -2.900
  773    H    ALA 104           HN       ALA 104 -12.483   0.211  -7.385
  774    HA   ALA 104           HA       ALA 104 -13.410  -2.247  -8.407
  775   1HB   ALA 104          3HB       ALA 104 -14.096  -0.029  -9.256
  776   2HB   ALA 104          1HB       ALA 104 -12.492   0.201  -9.982
  777   3HB   ALA 104          2HB       ALA 104 -13.554  -1.093 -10.569
  778    H    LEU 105           HN       LEU 105 -10.245  -0.612  -9.182
  779    HA   LEU 105           HA       LEU 105  -9.367  -2.708 -10.929
  780   1HB   LEU 105          2HB       LEU 105  -7.826  -0.679  -9.251
  781   2HB   LEU 105          1HB       LEU 105  -7.043  -1.857 -10.305
  782    HG   LEU 105           HG       LEU 105  -8.903   0.373 -11.199
  783   1HD1  LEU 105          3HD13     LEU 105  -6.549   0.956 -10.564
  784   2HD1  LEU 105          2HD12     LEU 105  -5.959  -0.217 -11.753
  785   3HD1  LEU 105          1HD11     LEU 105  -6.871   1.206 -12.292
  786   1HD2  LEU 105          2HD22     LEU 105  -7.710  -1.970 -12.727
  787   2HD2  LEU 105          3HD23     LEU 105  -9.394  -1.400 -12.725
  788   3HD2  LEU 105          1HD21     LEU 105  -8.140  -0.452 -13.531
  789    H    VAL 106           HN       VAL 106  -8.893  -2.260  -7.371
  790    HA   VAL 106           HA       VAL 106  -7.245  -4.573  -7.120
  791    HB   VAL 106           HB       VAL 106  -9.170  -3.406  -5.055
  792   1HG1  VAL 106          3HG23     VAL 106  -6.789  -5.316  -4.881
  793   2HG1  VAL 106          2HG22     VAL 106  -7.554  -4.555  -3.472
  794   3HG1  VAL 106          1HG21     VAL 106  -8.467  -5.702  -4.462
  795   1HG2  VAL 106          3HG13     VAL 106  -6.229  -2.908  -5.657
  796   2HG2  VAL 106          1HG11     VAL 106  -7.521  -1.722  -5.737
  797   3HG2  VAL 106          2HG12     VAL 106  -7.055  -2.370  -4.168
  798    H    ALA 107           HN       ALA 107 -10.774  -4.185  -6.897
  799    HA   ALA 107           HA       ALA 107 -11.460  -6.880  -6.396
  800   1HB   ALA 107          2HB       ALA 107 -13.133  -5.028  -6.429
  801   2HB   ALA 107          1HB       ALA 107 -13.005  -4.948  -8.194
  802   3HB   ALA 107          3HB       ALA 107 -13.630  -6.409  -7.417
  803    H    LYS 108           HN       LYS 108 -11.089  -5.282  -9.589
  804    HA   LYS 108           HA       LYS 108 -11.493  -7.498 -11.275
  805   1HB   LYS 108          1HB       LYS 108 -11.299  -5.168 -12.011
  806   2HB   LYS 108          2HB       LYS 108  -9.624  -5.080 -11.522
  807   1HG   LYS 108          2HG       LYS 108  -9.012  -6.820 -13.219
  808   2HG   LYS 108          1HG       LYS 108 -10.683  -6.765 -13.809
  809   1HD   LYS 108          2HD       LYS 108  -8.676  -4.453 -13.691
  810   2HD   LYS 108          1HD       LYS 108  -9.095  -5.389 -15.130
  811   1HE   LYS 108          1HE       LYS 108 -11.468  -4.585 -14.929
  812   2HE   LYS 108          2HE       LYS 108 -10.978  -3.561 -13.563
  813   1HZ   LYS 108          1HZ       LYS 108  -9.452  -2.449 -15.012
  814   2HZ   LYS 108          3HZ       LYS 108  -9.916  -3.385 -16.287
  815   3HZ   LYS 108          2HZ       LYS 108 -10.992  -2.350 -15.590
  816    H    HIS 109           HN       HIS 109  -8.370  -6.206 -10.191
  817    HA   HIS 109           HA       HIS 109  -6.860  -8.361 -11.323
  818   1HB   HIS 109          2HB       HIS 109  -6.213  -6.173  -9.314
  819   2HB   HIS 109          1HB       HIS 109  -5.042  -7.378  -9.857
  820    HD2  HIS 109           HD2      HIS 109  -6.989  -4.330 -11.432
  821    HE1  HIS 109           HE1      HIS 109  -4.188  -5.764 -14.226
  822    HE2  HIS 109           HE2      HIS 109  -5.829  -3.880 -13.718
  823    H    ALA 110           HN       ALA 110  -8.348  -8.025  -8.097
  824    HA   ALA 110           HA       ALA 110  -6.969 -10.393  -7.044
  825   1HB   ALA 110          3HB       ALA 110  -7.647  -8.409  -5.650
  826   2HB   ALA 110          1HB       ALA 110  -9.343  -8.839  -5.934
  827   3HB   ALA 110          2HB       ALA 110  -8.279  -9.957  -5.056
  828    H    ALA 111           HN       ALA 111  -8.290 -10.983  -9.487
  829    HA   ALA 111           HA       ALA 111 -10.880 -12.083  -9.193
  830   1HB   ALA 111          1HB       ALA 111  -9.783 -11.649 -11.365
  831   2HB   ALA 111          2HB       ALA 111  -8.595 -12.930 -11.030
  832   3HB   ALA 111          3HB       ALA 111 -10.311 -13.339 -11.247
  833    H    ALA 112           HN       ALA 112  -7.824 -13.283  -7.925
  834    HA   ALA 112           HA       ALA 112  -8.986 -15.489  -6.627
  835   1HB   ALA 112          1HB       ALA 112  -7.057 -16.077  -8.931
  836   2HB   ALA 112          2HB       ALA 112  -7.576 -17.244  -7.696
  837   3HB   ALA 112          3HB       ALA 112  -8.756 -16.593  -8.849
   
  No H/Q in entry =         837
  Start of MODEL   16
    1   1H    GLY   1          1HN       GLY   1  -1.345 -11.587   3.627
    2   2H    GLY   1          3HN       GLY   1  -2.928 -11.107   3.746
    3   3H    GLY   1          2HN       GLY   1  -1.756 -10.039   3.285
    4   1HA   GLY   1          1HA       GLY   1  -2.391  -9.662   5.589
    5   2HA   GLY   1          2HA       GLY   1  -2.117 -11.392   5.906
    6    H    GLY   2           HN       GLY   2  -0.813  -9.755   7.580
    7   1HA   GLY   2          1HA       GLY   2   1.271  -9.333   8.434
    8   2HA   GLY   2          2HA       GLY   2   2.014 -10.145   7.039
    9    H    SER   3           HN       SER   3   1.809  -8.960   4.939
   10    HA   SER   3           HA       SER   3   2.732  -6.224   5.108
   11   1HB   SER   3          1HB       SER   3   1.959  -7.934   2.710
   12   2HB   SER   3          2HB       SER   3   3.042  -6.527   2.734
   13    HG   SER   3           HG       SER   3   4.390  -7.826   4.190
   14    H    VAL   4           HN       VAL   4   0.436  -5.894   6.304
   15    HA   VAL   4           HA       VAL   4  -1.320  -4.473   4.398
   16    HB   VAL   4           HB       VAL   4  -3.146  -5.236   6.073
   17   1HG1  VAL   4          3HG13     VAL   4  -3.055  -6.116   3.742
   18   2HG1  VAL   4          2HG12     VAL   4  -1.986  -7.415   4.296
   19   3HG1  VAL   4          1HG11     VAL   4  -3.652  -7.304   4.903
   20   1HG2  VAL   4          2HG22     VAL   4  -1.612  -6.080   7.796
   21   2HG2  VAL   4          1HG21     VAL   4  -2.874  -7.229   7.314
   22   3HG2  VAL   4          3HG23     VAL   4  -1.216  -7.443   6.727
   23    H    ILE   5           HN       ILE   5   0.953  -3.621   5.906
   24    HA   ILE   5           HA       ILE   5  -0.236  -1.781   7.931
   25    HB   ILE   5           HB       ILE   5   1.738  -2.215   9.374
   26   1HG1  ILE   5          1HG11     ILE   5   2.435  -4.446   7.399
   27   2HG1  ILE   5          2HG12     ILE   5   3.318  -2.923   7.569
   28   1HG2  ILE   5          2HG22     ILE   5  -0.430  -3.504   9.596
   29   2HG2  ILE   5          3HG23     ILE   5   0.348  -4.843   8.726
   30   3HG2  ILE   5          1HG21     ILE   5   0.990  -4.295  10.284
   31   1HD1  ILE   5          2HD12     ILE   5   3.791  -3.494   9.956
   32   2HD1  ILE   5          1HD11     ILE   5   3.048  -5.090   9.680
   33   3HD1  ILE   5          3HD13     ILE   5   4.496  -4.618   8.778
   34    H    VAL   6           HN       VAL   6   1.861  -0.338   8.639
   35    HA   VAL   6           HA       VAL   6   2.457   1.257   6.285
   36    HB   VAL   6           HB       VAL   6   3.570   1.589   9.102
   37   1HG1  VAL   6          2HG22     VAL   6   4.568   2.989   7.323
   38   2HG1  VAL   6          3HG23     VAL   6   2.959   3.600   6.895
   39   3HG1  VAL   6          1HG21     VAL   6   3.655   3.958   8.487
   40   1HG2  VAL   6          2HG12     VAL   6   0.821   2.389   8.122
   41   2HG2  VAL   6          3HG13     VAL   6   1.250   1.439   9.550
   42   3HG2  VAL   6          1HG11     VAL   6   1.634   3.158   9.498
   43    H    ILE   7           HN       ILE   7   4.210   0.668   4.921
   44    HA   ILE   7           HA       ILE   7   6.730   0.165   6.219
   45    HB   ILE   7           HB       ILE   7   5.736  -2.117   6.349
   46   1HG1  ILE   7          1HG11     ILE   7   7.717  -3.207   5.069
   47   2HG1  ILE   7          2HG12     ILE   7   8.247  -1.548   4.708
   48   1HG2  ILE   7          3HG23     ILE   7   4.423  -1.967   4.162
   49   2HG2  ILE   7          1HG21     ILE   7   5.955  -2.343   3.334
   50   3HG2  ILE   7          2HG22     ILE   7   5.284  -3.474   4.506
   51   1HD1  ILE   7          2HD12     ILE   7   7.725  -2.691   7.494
   52   2HD1  ILE   7          3HD13     ILE   7   9.314  -2.457   6.752
   53   3HD1  ILE   7          1HD11     ILE   7   8.320  -1.053   7.145
   54    H    ASP   8           HN       ASP   8   7.648   1.773   5.247
   55    HA   ASP   8           HA       ASP   8   7.426   2.171   2.338
   56   1HB   ASP   8          1HB       ASP   8   8.510   4.305   2.826
   57   2HB   ASP   8          2HB       ASP   8   7.106   4.096   3.883
   58    H    SER   9           HN       SER   9   9.757   1.528   4.909
   59    HA   SER   9           HA       SER   9  12.133   1.695   4.023
   60   1HB   SER   9          1HB       SER   9  11.174  -0.909   5.232
   61   2HB   SER   9          2HB       SER   9  12.749  -0.115   5.468
   62    HG   SER   9           HG       SER   9  11.245   0.328   7.193
   63    H    LYS  10           HN       LYS  10  13.096   1.397   2.100
   64    HA   LYS  10           HA       LYS  10  12.466  -0.393   0.087
   65   1HB   LYS  10          1HB       LYS  10  13.958   1.598   0.044
   66   2HB   LYS  10          2HB       LYS  10  15.257   0.661   0.779
   67   1HG   LYS  10          1HG       LYS  10  13.918  -0.281  -1.790
   68   2HG   LYS  10          2HG       LYS  10  15.122   1.014  -1.819
   69   1HD   LYS  10          1HD       LYS  10  16.822  -0.445  -0.814
   70   2HD   LYS  10          2HD       LYS  10  15.659  -1.767  -0.670
   71   1HE   LYS  10          1HE       LYS  10  17.044  -2.153  -2.601
   72   2HE   LYS  10          2HE       LYS  10  15.379  -1.853  -3.117
   73   1HZ   LYS  10          3HZ       LYS  10  17.561   0.120  -3.142
   74   2HZ   LYS  10          1HZ       LYS  10  16.983  -0.693  -4.454
   75   3HZ   LYS  10          2HZ       LYS  10  16.019   0.382  -3.665
   76    H    ALA  11           HN       ALA  11  14.681  -0.867   2.841
   77    HA   ALA  11           HA       ALA  11  15.728  -3.407   2.126
   78   1HB   ALA  11          1HB       ALA  11  16.637  -1.980   3.932
   79   2HB   ALA  11          3HB       ALA  11  15.166  -2.251   4.897
   80   3HB   ALA  11          2HB       ALA  11  16.254  -3.606   4.528
   81    H    ALA  12           HN       ALA  12  12.536  -2.534   3.289
   82    HA   ALA  12           HA       ALA  12  11.867  -5.336   4.024
   83   1HB   ALA  12          1HB       ALA  12  11.276  -3.478   5.592
   84   2HB   ALA  12          2HB       ALA  12  10.234  -2.796   4.317
   85   3HB   ALA  12          3HB       ALA  12   9.876  -4.392   4.996
   86    H    TRP  13           HN       TRP  13  11.198  -2.753   1.671
   87    HA   TRP  13           HA       TRP  13   8.911  -3.534   0.391
   88   1HB   TRP  13          1HB       TRP  13  10.076  -1.547  -0.246
   89   2HB   TRP  13          2HB       TRP  13  11.522  -2.446  -0.674
   90    HD1  TRP  13           HD1      TRP  13  11.745  -3.578  -2.980
   91    HE1  TRP  13           HE1      TRP  13  10.545  -3.231  -5.230
   92    HE3  TRP  13           HE3      TRP  13   7.720  -0.853  -1.362
   93    HZ2  TRP  13           HZ2      TRP  13   8.248  -1.905  -6.200
   94    HZ3  TRP  13           HZ3      TRP  13   6.116   0.047  -3.016
   95    HH2  TRP  13           HH2      TRP  13   6.333  -0.497  -5.424
   96    H    ASP  14           HN       ASP  14  12.189  -4.801  -0.542
   97    HA   ASP  14           HA       ASP  14  11.048  -6.558  -2.521
   98   1HB   ASP  14          1HB       ASP  14  13.138  -7.501  -2.764
   99   2HB   ASP  14          2HB       ASP  14  13.392  -5.744  -2.537
  100    H    ALA  15           HN       ALA  15  12.342  -7.077   0.692
  101    HA   ALA  15           HA       ALA  15  11.794  -9.787   1.075
  102   1HB   ALA  15          3HB       ALA  15  12.871  -8.342   2.791
  103   2HB   ALA  15          2HB       ALA  15  11.289  -7.640   3.189
  104   3HB   ALA  15          1HB       ALA  15  11.588  -9.361   3.474
  105    H    GLN  16           HN       GLN  16   9.528  -7.100   1.359
  106    HA   GLN  16           HA       GLN  16   7.149  -8.503   2.055
  107   1HB   GLN  16          2HB       GLN  16   7.911  -5.778   1.313
  108   2HB   GLN  16          1HB       GLN  16   6.541  -6.255   0.352
  109   1HG   GLN  16          2HG       GLN  16   5.920  -5.127   2.459
  110   2HG   GLN  16          1HG       GLN  16   5.245  -6.751   2.275
  111   1HE2  GLN  16          2HE22     GLN  16   8.399  -6.680   4.924
  112   2HE2  GLN  16          1HE21     GLN  16   8.652  -6.119   3.279
  113    H    LEU  17           HN       LEU  17   8.309  -7.344  -1.137
  114    HA   LEU  17           HA       LEU  17   6.383  -8.577  -2.769
  115   1HB   LEU  17          1HB       LEU  17   9.339  -7.961  -3.164
  116   2HB   LEU  17          2HB       LEU  17   8.421  -8.629  -4.460
  117    HG   LEU  17           HG       LEU  17   7.934  -5.961  -3.047
  118   1HD1  LEU  17          2HD22     LEU  17   9.867  -6.018  -4.589
  119   2HD1  LEU  17          3HD23     LEU  17   8.821  -6.646  -5.882
  120   3HD1  LEU  17          1HD21     LEU  17   8.558  -5.013  -5.240
  121   1HD2  LEU  17          1HD11     LEU  17   6.344  -7.226  -5.313
  122   2HD2  LEU  17          3HD13     LEU  17   5.734  -6.744  -3.714
  123   3HD2  LEU  17          2HD12     LEU  17   6.262  -5.515  -4.857
  124    H    ALA  18           HN       ALA  18   9.398 -10.021  -1.514
  125    HA   ALA  18           HA       ALA  18   9.043 -12.538  -2.810
  126   1HB   ALA  18          2HB       ALA  18  11.192 -11.742  -1.940
  127   2HB   ALA  18          3HB       ALA  18  10.586 -11.826  -0.276
  128   3HB   ALA  18          1HB       ALA  18  10.764 -13.313  -1.231
  129    H    LYS  19           HN       LYS  19   8.499 -11.760   0.725
  130    HA   LYS  19           HA       LYS  19   7.399 -14.309   1.305
  131   1HB   LYS  19          2HB       LYS  19   6.686 -13.346   3.388
  132   2HB   LYS  19          1HB       LYS  19   8.287 -12.705   2.983
  133   1HG   LYS  19          2HG       LYS  19   7.089 -10.675   2.055
  134   2HG   LYS  19          1HG       LYS  19   5.593 -11.285   2.722
  135   1HD   LYS  19          1HD       LYS  19   8.114 -10.593   4.304
  136   2HD   LYS  19          2HD       LYS  19   6.654  -9.598   4.175
  137   1HE   LYS  19          1HE       LYS  19   5.322 -11.459   5.210
  138   2HE   LYS  19          2HE       LYS  19   6.836 -12.344   5.487
  139   1HZ   LYS  19          3HZ       LYS  19   6.186  -9.687   6.550
  140   2HZ   LYS  19          1HZ       LYS  19   6.166 -11.102   7.397
  141   3HZ   LYS  19          2HZ       LYS  19   7.590 -10.512   6.814
  142    H    GLY  20           HN       GLY  20   5.916 -11.364   0.010
  143   1HA   GLY  20          1HA       GLY  20   3.206 -11.957   0.395
  144   2HA   GLY  20          2HA       GLY  20   3.904 -10.969  -0.906
  145    H    LYS  21           HN       LYS  21   5.500 -13.536  -1.799
  146    HA   LYS  21           HA       LYS  21   5.233 -15.064  -3.474
  147   1HB   LYS  21          2HB       LYS  21   2.565 -15.567  -2.076
  148   2HB   LYS  21          1HB       LYS  21   3.220 -16.560  -3.362
  149   1HG   LYS  21          2HG       LYS  21   5.083 -17.255  -2.125
  150   2HG   LYS  21          1HG       LYS  21   4.890 -16.030  -0.873
  151   1HD   LYS  21          1HD       LYS  21   2.602 -17.951  -1.297
  152   2HD   LYS  21          2HD       LYS  21   4.074 -18.582  -0.555
  153   1HE   LYS  21          1HE       LYS  21   2.389 -17.788   1.115
  154   2HE   LYS  21          2HE       LYS  21   3.982 -17.031   1.272
  155   1HZ   LYS  21          2HZ       LYS  21   1.714 -15.779  -0.102
  156   2HZ   LYS  21          1HZ       LYS  21   2.157 -15.484   1.461
  157   3HZ   LYS  21          3HZ       LYS  21   3.186 -15.107   0.239
  158    H    GLU  22           HN       GLU  22   5.322 -13.085  -4.615
  159    HA   GLU  22           HA       GLU  22   3.111 -11.626  -5.585
  160   1HB   GLU  22          1HB       GLU  22   5.540 -10.863  -5.160
  161   2HB   GLU  22          2HB       GLU  22   5.987 -11.738  -6.630
  162   1HG   GLU  22          2HG       GLU  22   4.336 -10.178  -7.864
  163   2HG   GLU  22          1HG       GLU  22   4.231  -9.265  -6.350
  164    H    GLU  23           HN       GLU  23   2.154 -13.753  -6.228
  165    HA   GLU  23           HA       GLU  23   2.433 -14.071  -9.204
  166   1HB   GLU  23          1HB       GLU  23   1.507 -16.104  -7.102
  167   2HB   GLU  23          2HB       GLU  23   1.366 -16.293  -8.858
  168   1HG   GLU  23          1HG       GLU  23   3.320 -17.453  -8.329
  169   2HG   GLU  23          2HG       GLU  23   3.916 -15.915  -8.962
  170    H    HIS  24           HN       HIS  24  -0.242 -15.131  -7.170
  171    HA   HIS  24           HA       HIS  24  -2.040 -13.221  -8.621
  172   1HB   HIS  24          2HB       HIS  24  -2.227 -15.610  -9.308
  173   2HB   HIS  24          1HB       HIS  24  -2.745 -16.017  -7.672
  174    HD2  HIS  24           HD2      HIS  24  -5.042 -13.671  -7.185
  175    HE1  HIS  24           HE1      HIS  24  -6.624 -15.044 -10.851
  176    HE2  HIS  24           HE2      HIS  24  -7.153 -13.782  -8.710
  177    H    LYS  25           HN       LYS  25  -1.376 -11.817  -6.810
  178    HA   LYS  25           HA       LYS  25  -3.368 -12.049  -4.655
  179   1HB   LYS  25          1HB       LYS  25  -0.649 -10.921  -4.033
  180   2HB   LYS  25          2HB       LYS  25  -1.912 -11.386  -2.922
  181   1HG   LYS  25          2HG       LYS  25  -0.259 -13.359  -4.568
  182   2HG   LYS  25          1HG       LYS  25   0.195 -12.785  -2.971
  183   1HD   LYS  25          1HD       LYS  25  -1.938 -13.608  -2.013
  184   2HD   LYS  25          2HD       LYS  25  -2.367 -14.312  -3.572
  185   1HE   LYS  25          2HE       LYS  25  -0.020 -15.046  -1.774
  186   2HE   LYS  25          1HE       LYS  25  -1.432 -16.034  -2.216
  187   1HZ   LYS  25          3HZ       LYS  25  -0.610 -15.990  -4.491
  188   2HZ   LYS  25          2HZ       LYS  25   0.737 -15.161  -4.003
  189   3HZ   LYS  25          1HZ       LYS  25   0.470 -16.690  -3.458
  190    HA   PRO  26           HA       PRO  26  -3.289  -7.699  -6.170
  191   1HB   PRO  26          2HB       PRO  26  -4.682  -6.390  -4.212
  192   2HB   PRO  26          1HB       PRO  26  -5.482  -7.430  -5.422
  193   1HG   PRO  26          1HG       PRO  26  -4.621  -8.193  -2.640
  194   2HG   PRO  26          2HG       PRO  26  -6.228  -8.439  -3.379
  195   1HD   PRO  26          1HD       PRO  26  -4.378 -10.452  -3.351
  196   2HD   PRO  26          2HD       PRO  26  -5.328 -10.190  -4.819
  197    H    ILE  27           HN       ILE  27  -0.975  -7.819  -5.916
  198    HA   ILE  27           HA       ILE  27   0.182  -6.932  -3.350
  199    HB   ILE  27           HB       ILE  27   1.519  -7.297  -6.065
  200   1HG1  ILE  27          2HG12     ILE  27   2.458  -9.298  -4.338
  201   2HG1  ILE  27          1HG11     ILE  27   0.747  -9.214  -3.941
  202   1HG2  ILE  27          3HG23     ILE  27   2.696  -5.756  -4.484
  203   2HG2  ILE  27          1HG21     ILE  27   2.703  -7.049  -3.270
  204   3HG2  ILE  27          2HG22     ILE  27   3.592  -7.249  -4.794
  205   1HD1  ILE  27          3HD13     ILE  27   0.472  -9.284  -6.607
  206   2HD1  ILE  27          2HD12     ILE  27   2.096  -9.931  -6.548
  207   3HD1  ILE  27          1HD11     ILE  27   0.811 -10.791  -5.717
  208    H    VAL  28           HN       VAL  28  -1.033  -5.020  -3.133
  209    HA   VAL  28           HA       VAL  28  -1.017  -3.077  -5.392
  210    HB   VAL  28           HB       VAL  28  -3.267  -3.732  -4.567
  211   1HG1  VAL  28          3HG23     VAL  28  -2.811  -4.192  -2.221
  212   2HG1  VAL  28          2HG22     VAL  28  -2.547  -2.461  -1.938
  213   3HG1  VAL  28          1HG21     VAL  28  -4.132  -3.043  -2.453
  214   1HG2  VAL  28          3HG13     VAL  28  -2.448  -0.850  -4.153
  215   2HG2  VAL  28          1HG11     VAL  28  -2.962  -1.618  -5.652
  216   3HG2  VAL  28          2HG12     VAL  28  -4.119  -1.439  -4.327
  217    H    VAL  29           HN       VAL  29  -0.009  -1.119  -5.078
  218    HA   VAL  29           HA       VAL  29   1.232  -0.679  -2.382
  219    HB   VAL  29           HB       VAL  29   2.920  -1.158  -4.070
  220   1HG1  VAL  29          1HG11     VAL  29   1.746  -0.467  -6.076
  221   2HG1  VAL  29          2HG12     VAL  29   1.833   1.249  -5.592
  222   3HG1  VAL  29          3HG13     VAL  29   3.306   0.336  -5.964
  223   1HG2  VAL  29          2HG22     VAL  29   2.914   1.792  -3.279
  224   2HG2  VAL  29          3HG23     VAL  29   3.551   0.431  -2.325
  225   3HG2  VAL  29          1HG21     VAL  29   4.290   0.868  -3.868
  226    H    ASP  30           HN       ASP  30   1.169   1.330  -1.512
  227    HA   ASP  30           HA       ASP  30  -0.604   3.373  -2.807
  228   1HB   ASP  30          1HB       ASP  30  -1.830   2.687  -0.868
  229   2HB   ASP  30          2HB       ASP  30  -0.364   2.485   0.074
  230    H    PHE  31           HN       PHE  31   0.775   4.897  -3.561
  231    HA   PHE  31           HA       PHE  31   3.140   5.606  -1.862
  232   1HB   PHE  31          2HB       PHE  31   2.707   5.959  -4.864
  233   2HB   PHE  31          1HB       PHE  31   4.053   6.555  -3.922
  234    HD1  PHE  31           HD2      PHE  31   5.656   4.944  -2.802
  235    HD2  PHE  31           HD1      PHE  31   2.833   3.776  -5.843
  236    HE1  PHE  31           HE2      PHE  31   7.256   3.244  -3.639
  237    HE2  PHE  31           HE1      PHE  31   4.494   2.172  -6.757
  238    HZ   PHE  31           HZ       PHE  31   6.721   1.935  -5.689
  239    H    THR  32           HN       THR  32   2.518   7.431  -0.709
  240    HA   THR  32           HA       THR  32   1.376   9.702  -2.206
  241    HB   THR  32           HB       THR  32  -0.600   8.490  -1.301
  242    HG1  THR  32           HG1      THR  32  -1.419  10.383  -0.242
  243   1HG2  THR  32          3HG23     THR  32   0.413   7.474   0.731
  244   2HG2  THR  32          1HG21     THR  32   0.606   9.092   1.447
  245   3HG2  THR  32          2HG22     THR  32  -1.014   8.446   1.121
  246    H    ALA  33           HN       ALA  33   1.147  11.505  -0.338
  247    HA   ALA  33           HA       ALA  33   3.873  11.724   0.908
  248   1HB   ALA  33          3HB       ALA  33   3.808  13.011  -1.199
  249   2HB   ALA  33          1HB       ALA  33   2.347  13.861  -0.642
  250   3HB   ALA  33          2HB       ALA  33   3.885  14.089   0.205
  251    H    THR  34           HN       THR  34   3.919  13.570   2.477
  252    HA   THR  34           HA       THR  34   1.629  13.377   4.353
  253    HB   THR  34           HB       THR  34   3.297  14.321   5.946
  254    HG1  THR  34           HG1      THR  34   5.203  13.931   3.863
  255   1HG2  THR  34          1HG21     THR  34   3.073  11.850   5.655
  256   2HG2  THR  34          3HG23     THR  34   4.336  11.904   4.406
  257   3HG2  THR  34          2HG22     THR  34   4.729  12.330   6.081
  258    H    TRP  35           HN       TRP  35   3.946  15.898   3.551
  259    HA   TRP  35           HA       TRP  35   2.779  18.189   4.357
  260   1HB   TRP  35          1HB       TRP  35   4.041  19.327   2.517
  261   2HB   TRP  35          2HB       TRP  35   4.979  18.155   3.435
  262    HD1  TRP  35           HD1      TRP  35   6.018  16.118   2.158
  263    HE1  TRP  35           HE1      TRP  35   6.098  15.338  -0.256
  264    HE3  TRP  35           HE3      TRP  35   2.704  19.470   0.106
  265    HZ2  TRP  35           HZ2      TRP  35   4.923  16.075  -2.782
  266    HZ3  TRP  35           HZ3      TRP  35   2.193  19.372  -2.311
  267    HH2  TRP  35           HH2      TRP  35   3.292  17.686  -3.765
  268    H    CYS  36           HN       CYS  36   1.787  16.454   1.465
  269    HA   CYS  36           HA       CYS  36   0.225  18.413   0.166
  270   1HB   CYS  36          2HB       CYS  36  -0.837  16.532  -0.926
  271   2HB   CYS  36          1HB       CYS  36   0.883  16.156  -0.731
  272    H    GLY  37           HN       GLY  37  -0.435  16.716   3.177
  273   1HA   GLY  37          1HA       GLY  37  -2.136  17.056   4.678
  274   2HA   GLY  37          2HA       GLY  37  -2.848  18.250   3.584
  275    HA   PRO  38           HA       PRO  38  -6.191  15.261   3.214
  276   1HB   PRO  38          1HB       PRO  38  -6.254  16.460   0.424
  277   2HB   PRO  38          2HB       PRO  38  -7.642  15.962   1.439
  278   1HG   PRO  38          2HG       PRO  38  -6.899  18.558   1.429
  279   2HG   PRO  38          1HG       PRO  38  -7.213  17.756   2.996
  280   1HD   PRO  38          2HD       PRO  38  -4.565  18.366   1.703
  281   2HD   PRO  38          1HD       PRO  38  -5.047  18.484   3.422
  282    H    CYS  39           HN       CYS  39  -3.871  15.401   0.511
  283    HA   CYS  39           HA       CYS  39  -4.564  12.912  -0.650
  284   1HB   CYS  39          1HB       CYS  39  -2.963  13.343  -2.109
  285   2HB   CYS  39          2HB       CYS  39  -2.836  14.913  -1.340
  286    H    LYS  40           HN       LYS  40  -2.768  13.537   2.325
  287    HA   LYS  40           HA       LYS  40  -1.445  10.977   2.398
  288   1HB   LYS  40          1HB       LYS  40  -0.721  12.974   3.735
  289   2HB   LYS  40          2HB       LYS  40  -2.218  12.875   4.657
  290   1HG   LYS  40          1HG       LYS  40  -0.347  11.934   5.900
  291   2HG   LYS  40          2HG       LYS  40  -1.585  10.712   5.603
  292   1HD   LYS  40          2HD       LYS  40  -0.212   9.757   3.757
  293   2HD   LYS  40          1HD       LYS  40   1.006  11.019   4.015
  294   1HE   LYS  40          2HE       LYS  40   1.359  10.154   6.336
  295   2HE   LYS  40          1HE       LYS  40   0.193   8.860   5.998
  296   1HZ   LYS  40          1HZ       LYS  40   1.633   8.150   4.207
  297   2HZ   LYS  40          3HZ       LYS  40   2.734   9.320   4.573
  298   3HZ   LYS  40          2HZ       LYS  40   2.416   8.124   5.655
  299    H    MET  41           HN       MET  41  -4.687  12.131   3.154
  300    HA   MET  41           HA       MET  41  -5.384  10.216   5.170
  301   1HB   MET  41          1HB       MET  41  -7.199  11.749   3.259
  302   2HB   MET  41          2HB       MET  41  -7.683  10.951   4.759
  303   1HG   MET  41          1HG       MET  41  -5.759  13.304   4.563
  304   2HG   MET  41          2HG       MET  41  -7.442  13.367   5.081
  305   1HE   MET  41          3HE       MET  41  -6.378  14.835   7.077
  306   2HE   MET  41          1HE       MET  41  -5.200  14.181   8.240
  307   3HE   MET  41          2HE       MET  41  -4.712  14.472   6.553
  308    H    ILE  42           HN       ILE  42  -5.020   9.856   1.749
  309    HA   ILE  42           HA       ILE  42  -6.877   7.712   1.341
  310    HB   ILE  42           HB       ILE  42  -4.184   8.227   0.017
  311   1HG1  ILE  42          1HG11     ILE  42  -6.888   9.109  -1.069
  312   2HG1  ILE  42          2HG12     ILE  42  -5.889  10.183  -0.082
  313   1HG2  ILE  42          2HG22     ILE  42  -6.636   6.540  -0.663
  314   2HG2  ILE  42          3HG23     ILE  42  -5.475   6.984  -1.904
  315   3HG2  ILE  42          1HG21     ILE  42  -4.953   6.002  -0.526
  316   1HD1  ILE  42          3HD13     ILE  42  -3.972   9.856  -1.636
  317   2HD1  ILE  42          2HD12     ILE  42  -5.040   8.968  -2.729
  318   3HD1  ILE  42          1HD11     ILE  42  -5.378  10.668  -2.335
  319    H    ALA  43           HN       ALA  43  -3.634   7.959   2.761
  320    HA   ALA  43           HA       ALA  43  -2.874   5.259   2.617
  321   1HB   ALA  43          1HB       ALA  43  -1.302   7.041   3.109
  322   2HB   ALA  43          3HB       ALA  43  -2.075   7.392   4.660
  323   3HB   ALA  43          2HB       ALA  43  -1.263   5.846   4.405
  324    HA   PRO  44           HA       PRO  44  -4.653   4.358   6.978
  325   1HB   PRO  44          1HB       PRO  44  -6.713   5.978   7.939
  326   2HB   PRO  44          2HB       PRO  44  -4.995   6.087   8.409
  327   1HG   PRO  44          1HG       PRO  44  -6.451   7.695   6.314
  328   2HG   PRO  44          2HG       PRO  44  -5.332   8.294   7.570
  329   1HD   PRO  44          2HD       PRO  44  -4.418   7.913   5.078
  330   2HD   PRO  44          1HD       PRO  44  -3.442   7.361   6.460
  331    H    LEU  45           HN       LEU  45  -6.788   5.887   4.578
  332    HA   LEU  45           HA       LEU  45  -9.013   4.109   4.881
  333   1HB   LEU  45          2HB       LEU  45  -7.939   5.907   2.714
  334   2HB   LEU  45          1HB       LEU  45  -9.104   4.692   2.227
  335    HG   LEU  45           HG       LEU  45  -9.589   6.589   4.570
  336   1HD1  LEU  45          2HD12     LEU  45  -9.131   7.955   2.564
  337   2HD1  LEU  45          1HD11     LEU  45 -10.367   7.048   1.662
  338   3HD1  LEU  45          3HD13     LEU  45 -10.832   8.057   3.045
  339   1HD2  LEU  45          2HD22     LEU  45 -11.497   5.053   2.735
  340   2HD2  LEU  45          1HD21     LEU  45 -11.125   4.621   4.415
  341   3HD2  LEU  45          3HD23     LEU  45 -11.980   6.127   4.061
  342    H    PHE  46           HN       PHE  46  -6.265   4.002   2.600
  343    HA   PHE  46           HA       PHE  46  -6.790   1.449   1.458
  344   1HB   PHE  46          2HB       PHE  46  -5.290   3.040   0.471
  345   2HB   PHE  46          1HB       PHE  46  -4.291   3.085   1.900
  346    HD1  PHE  46           HD1      PHE  46  -2.728   1.166   2.408
  347    HD2  PHE  46           HD2      PHE  46  -5.148   1.093  -1.167
  348    HE1  PHE  46           HE1      PHE  46  -0.957  -0.089   1.230
  349    HE2  PHE  46           HE2      PHE  46  -3.375  -0.104  -2.331
  350    HZ   PHE  46           HZ       PHE  46  -1.230  -0.651  -1.179
  351    H    GLU  47           HN       GLU  47  -4.949   2.396   4.395
  352    HA   GLU  47           HA       GLU  47  -4.046  -0.210   5.070
  353   1HB   GLU  47          2HB       GLU  47  -3.261   2.008   5.981
  354   2HB   GLU  47          1HB       GLU  47  -4.689   2.023   7.028
  355   1HG   GLU  47          1HG       GLU  47  -3.951  -0.002   8.157
  356   2HG   GLU  47          2HG       GLU  47  -2.713  -0.309   6.932
  357    H    THR  48           HN       THR  48  -7.082   1.541   5.850
  358    HA   THR  48           HA       THR  48  -8.166  -0.453   7.587
  359    HB   THR  48           HB       THR  48  -9.710   1.432   5.745
  360    HG1  THR  48           HG1      THR  48  -8.198   2.499   7.155
  361   1HG2  THR  48          1HG21     THR  48 -10.451   0.054   8.362
  362   2HG2  THR  48          3HG23     THR  48 -11.441   1.247   7.499
  363   3HG2  THR  48          2HG22     THR  48 -11.115  -0.329   6.760
  364    H    LEU  49           HN       LEU  49  -8.463   0.062   4.003
  365    HA   LEU  49           HA       LEU  49  -9.951  -2.313   3.505
  366   1HB   LEU  49          1HB       LEU  49  -8.004  -0.724   1.817
  367   2HB   LEU  49          2HB       LEU  49  -8.825  -2.157   1.187
  368    HG   LEU  49           HG       LEU  49 -10.478  -0.017   2.510
  369   1HD1  LEU  49          2HD22     LEU  49  -9.051   1.225   0.926
  370   2HD1  LEU  49          3HD23     LEU  49  -9.500   0.101  -0.377
  371   3HD1  LEU  49          1HD21     LEU  49 -10.720   1.162   0.365
  372   1HD2  LEU  49          3HD13     LEU  49 -11.526  -2.168   1.836
  373   2HD2  LEU  49          1HD11     LEU  49 -12.172  -0.804   0.913
  374   3HD2  LEU  49          2HD12     LEU  49 -10.992  -1.896   0.163
  375    H    SER  50           HN       SER  50  -6.432  -1.831   3.868
  376    HA   SER  50           HA       SER  50  -5.553  -4.439   3.177
  377   1HB   SER  50          1HB       SER  50  -4.333  -2.846   5.471
  378   2HB   SER  50          2HB       SER  50  -3.595  -3.972   4.356
  379    HG   SER  50           HG       SER  50  -4.738  -1.682   3.247
  380    H    ASN  51           HN       ASN  51  -6.480  -3.146   6.371
  381    HA   ASN  51           HA       ASN  51  -6.381  -5.565   7.861
  382   1HB   ASN  51          2HB       ASN  51  -6.547  -3.560   9.081
  383   2HB   ASN  51          1HB       ASN  51  -7.889  -2.939   8.132
  384   1HD2  ASN  51          2HD22     ASN  51 -10.415  -4.594  10.016
  385   2HD2  ASN  51          1HD21     ASN  51 -10.129  -3.798   8.485
  386    H    ASP  52           HN       ASP  52  -9.068  -4.065   6.047
  387    HA   ASP  52           HA       ASP  52 -11.070  -5.905   6.824
  388   1HB   ASP  52          2HB       ASP  52 -10.861  -4.261   4.266
  389   2HB   ASP  52          1HB       ASP  52 -12.330  -5.004   4.906
  390    H    TYR  53           HN       TYR  53  -8.867  -5.959   3.968
  391    HA   TYR  53           HA       TYR  53 -10.215  -8.367   2.925
  392   1HB   TYR  53          2HB       TYR  53  -7.894  -6.642   2.048
  393   2HB   TYR  53          1HB       TYR  53  -8.153  -8.255   1.381
  394    HD1  TYR  53           HD2      TYR  53 -10.159  -5.080   1.996
  395    HD2  TYR  53           HD1      TYR  53  -9.499  -8.553  -0.483
  396    HE1  TYR  53           HE2      TYR  53 -11.970  -4.359   0.490
  397    HE2  TYR  53           HE1      TYR  53 -11.332  -7.836  -1.967
  398    HH   TYR  53           HH       TYR  53 -12.977  -6.265  -2.354
  399    H    ALA  54           HN       ALA  54  -7.120  -7.584   4.541
  400    HA   ALA  54           HA       ALA  54  -5.667  -8.752   5.736
  401   1HB   ALA  54          2HB       ALA  54  -7.658  -9.096   7.129
  402   2HB   ALA  54          1HB       ALA  54  -8.056 -10.583   6.257
  403   3HB   ALA  54          3HB       ALA  54  -6.574 -10.488   7.223
  404    H    GLY  55           HN       GLY  55  -7.489 -11.397   4.210
  405   1HA   GLY  55          1HA       GLY  55  -5.642 -13.447   4.486
  406   2HA   GLY  55          2HA       GLY  55  -6.916 -13.361   3.261
  407    H    LYS  56           HN       LYS  56  -6.206 -13.681   1.235
  408    HA   LYS  56           HA       LYS  56  -3.346 -13.781   0.651
  409   1HB   LYS  56          1HB       LYS  56  -4.187 -14.626  -1.560
  410   2HB   LYS  56          2HB       LYS  56  -4.694 -15.559  -0.160
  411   1HG   LYS  56          1HG       LYS  56  -6.914 -14.877  -0.366
  412   2HG   LYS  56          2HG       LYS  56  -6.519 -13.413  -1.283
  413   1HD   LYS  56          2HD       LYS  56  -5.607 -15.928  -2.627
  414   2HD   LYS  56          1HD       LYS  56  -7.320 -15.861  -2.318
  415   1HE   LYS  56          1HE       LYS  56  -6.895 -14.920  -4.518
  416   2HE   LYS  56          2HE       LYS  56  -7.473 -13.641  -3.439
  417   1HZ   LYS  56          2HZ       LYS  56  -5.141 -13.021  -3.130
  418   2HZ   LYS  56          3HZ       LYS  56  -4.694 -14.133  -4.268
  419   3HZ   LYS  56          1HZ       LYS  56  -5.662 -12.872  -4.688
  420    H    VAL  57           HN       VAL  57  -3.608 -11.265   1.283
  421    HA   VAL  57           HA       VAL  57  -3.434  -9.755  -1.282
  422    HB   VAL  57           HB       VAL  57  -4.681  -7.918  -0.322
  423   1HG1  VAL  57          2HG22     VAL  57  -5.930  -9.885  -1.435
  424   2HG1  VAL  57          3HG23     VAL  57  -6.411 -10.365   0.199
  425   3HG1  VAL  57          1HG21     VAL  57  -6.886  -8.781  -0.444
  426   1HG2  VAL  57          2HG12     VAL  57  -5.035  -9.662   2.154
  427   2HG2  VAL  57          1HG11     VAL  57  -4.155  -8.121   2.072
  428   3HG2  VAL  57          3HG13     VAL  57  -5.901  -8.153   1.863
  429    H    ILE  58           HN       ILE  58  -2.016  -7.968  -1.275
  430    HA   ILE  58           HA       ILE  58  -0.326  -7.607   1.156
  431    HB   ILE  58           HB       ILE  58   0.592  -8.311  -1.663
  432   1HG1  ILE  58          2HG12     ILE  58   2.140  -9.717   0.101
  433   2HG1  ILE  58          1HG11     ILE  58   0.658  -9.629   1.033
  434   1HG2  ILE  58          3HG23     ILE  58   2.202  -7.056   0.589
  435   2HG2  ILE  58          1HG21     ILE  58   2.905  -7.830  -0.847
  436   3HG2  ILE  58          2HG22     ILE  58   1.908  -6.393  -1.027
  437   1HD1  ILE  58          1HD11     ILE  58  -0.559 -10.589  -1.000
  438   2HD1  ILE  58          3HD13     ILE  58   1.021 -10.725  -1.790
  439   3HD1  ILE  58          2HD12     ILE  58   0.677 -11.653  -0.315
  440    H    PHE  59           HN       PHE  59  -0.768  -5.606   1.716
  441    HA   PHE  59           HA       PHE  59  -1.278  -3.506  -0.363
  442   1HB   PHE  59          1HB       PHE  59  -2.254  -3.877   2.455
  443   2HB   PHE  59          2HB       PHE  59  -2.228  -2.314   1.682
  444    HD1  PHE  59           HD2      PHE  59  -3.512  -5.814   0.956
  445    HD2  PHE  59           HD1      PHE  59  -4.186  -1.564   0.701
  446    HE1  PHE  59           HE2      PHE  59  -5.941  -6.196   0.564
  447    HE2  PHE  59           HE1      PHE  59  -6.575  -1.958   0.298
  448    HZ   PHE  59           HZ       PHE  59  -7.497  -4.279   0.490
  449    H    LEU  60           HN       LEU  60   0.812  -2.939  -0.753
  450    HA   LEU  60           HA       LEU  60   2.780  -2.466   1.371
  451   1HB   LEU  60          1HB       LEU  60   2.775  -1.979  -1.641
  452   2HB   LEU  60          2HB       LEU  60   4.198  -1.817  -0.585
  453    HG   LEU  60           HG       LEU  60   2.596  -4.310  -1.286
  454   1HD1  LEU  60          2HD22     LEU  60   4.058  -3.470  -3.077
  455   2HD1  LEU  60          3HD23     LEU  60   5.446  -3.484  -1.969
  456   3HD1  LEU  60          1HD21     LEU  60   4.655  -5.006  -2.428
  457   1HD2  LEU  60          1HD11     LEU  60   5.036  -4.033   0.524
  458   2HD2  LEU  60          3HD13     LEU  60   3.414  -4.580   1.022
  459   3HD2  LEU  60          2HD12     LEU  60   4.373  -5.574  -0.075
  460    H    LYS  61           HN       LYS  61   1.903  -0.788   2.667
  461    HA   LYS  61           HA       LYS  61   1.179   1.740   1.360
  462   1HB   LYS  61          1HB       LYS  61   0.181   0.572   3.537
  463   2HB   LYS  61          2HB       LYS  61   1.480   1.468   4.331
  464   1HG   LYS  61          1HG       LYS  61   0.599   3.553   3.067
  465   2HG   LYS  61          2HG       LYS  61  -0.731   2.527   2.530
  466   1HD   LYS  61          1HD       LYS  61  -1.648   3.568   4.363
  467   2HD   LYS  61          2HD       LYS  61  -1.142   2.014   5.040
  468   1HE   LYS  61          2HE       LYS  61   0.863   3.037   5.986
  469   2HE   LYS  61          1HE       LYS  61   0.547   4.570   5.171
  470   1HZ   LYS  61          1HZ       LYS  61  -1.165   3.388   7.249
  471   2HZ   LYS  61          2HZ       LYS  61  -0.121   4.645   7.446
  472   3HZ   LYS  61          3HZ       LYS  61  -1.435   4.811   6.467
  473    H    VAL  62           HN       VAL  62   2.805   2.988   0.553
  474    HA   VAL  62           HA       VAL  62   5.368   3.172   2.046
  475    HB   VAL  62           HB       VAL  62   4.775   3.376  -0.942
  476   1HG1  VAL  62          1HG11     VAL  62   7.373   3.595   0.620
  477   2HG1  VAL  62          2HG12     VAL  62   7.316   3.355  -1.129
  478   3HG1  VAL  62          3HG13     VAL  62   6.672   4.836  -0.430
  479   1HG2  VAL  62          2HG22     VAL  62   6.223   1.205   0.635
  480   2HG2  VAL  62          3HG23     VAL  62   4.662   1.037  -0.188
  481   3HG2  VAL  62          1HG21     VAL  62   6.130   1.319  -1.127
  482    H    ASP  63           HN       ASP  63   6.360   5.205   2.103
  483    HA   ASP  63           HA       ASP  63   4.556   7.549   1.665
  484   1HB   ASP  63          2HB       ASP  63   5.098   7.076   4.024
  485   2HB   ASP  63          1HB       ASP  63   6.826   7.199   3.655
  486    H    VAL  64           HN       VAL  64   5.130   8.667  -0.071
  487    HA   VAL  64           HA       VAL  64   7.448   8.230  -1.643
  488    HB   VAL  64           HB       VAL  64   5.385  10.477  -1.516
  489   1HG1  VAL  64          1HG11     VAL  64   7.600  10.087  -3.559
  490   2HG1  VAL  64          2HG12     VAL  64   6.161  11.089  -3.823
  491   3HG1  VAL  64          3HG13     VAL  64   7.306  11.514  -2.548
  492   1HG2  VAL  64          2HG22     VAL  64   4.618   8.184  -2.203
  493   2HG2  VAL  64          3HG23     VAL  64   4.480   9.370  -3.511
  494   3HG2  VAL  64          1HG21     VAL  64   5.824   8.205  -3.503
  495    H    ASP  65           HN       ASP  65   6.692  10.756   0.769
  496    HA   ASP  65           HA       ASP  65   8.949  12.423   0.281
  497   1HB   ASP  65          1HB       ASP  65   7.524  12.018   2.932
  498   2HB   ASP  65          2HB       ASP  65   8.532  13.377   2.443
  499    H    ALA  66           HN       ALA  66   8.446   9.598   2.427
  500    HA   ALA  66           HA       ALA  66  11.087   9.712   3.593
  501   1HB   ALA  66          1HB       ALA  66   9.162   8.629   4.704
  502   2HB   ALA  66          3HB       ALA  66   9.122   7.383   3.439
  503   3HB   ALA  66          2HB       ALA  66  10.531   7.519   4.506
  504    H    VAL  67           HN       VAL  67   9.715   7.193   1.335
  505    HA   VAL  67           HA       VAL  67  12.561   6.561   0.628
  506    HB   VAL  67           HB       VAL  67  11.724   4.606  -0.486
  507   1HG1  VAL  67          1HG11     VAL  67  12.604   4.616   1.828
  508   2HG1  VAL  67          3HG13     VAL  67  10.950   4.805   2.442
  509   3HG1  VAL  67          2HG12     VAL  67  11.419   3.346   1.542
  510   1HG2  VAL  67          3HG23     VAL  67   9.349   5.292  -0.921
  511   2HG2  VAL  67          1HG21     VAL  67   9.527   3.745  -0.075
  512   3HG2  VAL  67          2HG22     VAL  67   9.054   5.207   0.824
  513    H    ALA  68           HN       ALA  68  12.370   8.856  -0.234
  514    HA   ALA  68           HA       ALA  68  11.226   9.534  -2.671
  515   1HB   ALA  68          3HB       ALA  68  12.572  11.067  -1.292
  516   2HB   ALA  68          2HB       ALA  68  14.052  10.171  -1.705
  517   3HB   ALA  68          1HB       ALA  68  13.159  11.047  -2.967
  518    H    ALA  69           HN       ALA  69  14.176   7.605  -2.126
  519    HA   ALA  69           HA       ALA  69  15.051   7.285  -4.784
  520   1HB   ALA  69          3HB       ALA  69  15.247   5.351  -2.434
  521   2HB   ALA  69          1HB       ALA  69  16.211   5.285  -3.925
  522   3HB   ALA  69          2HB       ALA  69  16.382   6.664  -2.821
  523    H    VAL  70           HN       VAL  70  12.782   5.226  -2.877
  524    HA   VAL  70           HA       VAL  70  12.401   3.293  -5.001
  525    HB   VAL  70           HB       VAL  70  10.649   3.930  -2.587
  526   1HG1  VAL  70          2HG22     VAL  70  10.753   1.460  -4.380
  527   2HG1  VAL  70          1HG21     VAL  70   9.769   1.641  -2.914
  528   3HG1  VAL  70          3HG23     VAL  70   9.432   2.640  -4.333
  529   1HG2  VAL  70          2HG12     VAL  70  12.961   3.227  -1.939
  530   2HG2  VAL  70          3HG13     VAL  70  11.762   1.981  -1.554
  531   3HG2  VAL  70          1HG11     VAL  70  12.800   1.804  -2.986
  532    H    ALA  71           HN       ALA  71  10.651   6.157  -3.799
  533    HA   ALA  71           HA       ALA  71   8.441   6.071  -5.544
  534   1HB   ALA  71          1HB       ALA  71   8.639   7.594  -3.612
  535   2HB   ALA  71          3HB       ALA  71   9.888   8.531  -4.454
  536   3HB   ALA  71          2HB       ALA  71   8.243   8.487  -5.094
  537    H    GLU  72           HN       GLU  72  11.554   7.900  -6.112
  538    HA   GLU  72           HA       GLU  72  10.727   8.654  -8.753
  539   1HB   GLU  72          1HB       GLU  72  12.975   9.394  -9.113
  540   2HB   GLU  72          2HB       GLU  72  12.447   9.863  -7.494
  541   1HG   GLU  72          1HG       GLU  72  13.729   7.898  -6.586
  542   2HG   GLU  72          2HG       GLU  72  14.363   7.595  -8.206
  543    H    ALA  73           HN       ALA  73  12.653   5.826  -7.551
  544    HA   ALA  73           HA       ALA  73  13.298   4.759 -10.085
  545   1HB   ALA  73          2HB       ALA  73  14.215   3.906  -7.961
  546   2HB   ALA  73          3HB       ALA  73  12.616   3.273  -7.508
  547   3HB   ALA  73          1HB       ALA  73  13.473   2.601  -8.908
  548    H    ALA  74           HN       ALA  74  10.318   4.397  -8.132
  549    HA   ALA  74           HA       ALA  74   8.985   2.712 -10.125
  550   1HB   ALA  74          1HB       ALA  74   8.096   3.987  -7.521
  551   2HB   ALA  74          2HB       ALA  74   7.086   2.915  -8.521
  552   3HB   ALA  74          3HB       ALA  74   8.589   2.315  -7.798
  553    H    GLY  75           HN       GLY  75   9.788   5.904 -10.386
  554   1HA   GLY  75          1HA       GLY  75   9.040   7.584 -11.711
  555   2HA   GLY  75          2HA       GLY  75   7.926   6.418 -12.451
  556    H    ILE  76           HN       ILE  76   7.819   7.135  -8.994
  557    HA   ILE  76           HA       ILE  76   5.026   7.925  -9.201
  558    HB   ILE  76           HB       ILE  76   6.881   7.928  -6.795
  559   1HG1  ILE  76          1HG11     ILE  76   6.809   5.720  -7.742
  560   2HG1  ILE  76          2HG12     ILE  76   5.892   5.761  -6.242
  561   1HG2  ILE  76          1HG21     ILE  76   3.862   8.150  -7.132
  562   2HG2  ILE  76          3HG23     ILE  76   4.647   7.715  -5.603
  563   3HG2  ILE  76          2HG22     ILE  76   4.968   9.279  -6.330
  564   1HD1  ILE  76          1HD11     ILE  76   4.718   5.765  -9.075
  565   2HD1  ILE  76          2HD12     ILE  76   4.831   4.388  -7.993
  566   3HD1  ILE  76          3HD13     ILE  76   3.794   5.748  -7.549
  567    H    THR  77           HN       THR  77   5.331   9.595 -10.598
  568    HA   THR  77           HA       THR  77   6.487  12.165  -9.732
  569    HB   THR  77           HB       THR  77   5.509  12.718 -12.099
  570    HG1  THR  77           HG1      THR  77   5.565   9.886 -12.367
  571   1HG2  THR  77          1HG21     THR  77   7.679  10.583 -11.790
  572   2HG2  THR  77          2HG22     THR  77   7.403  11.583 -13.232
  573   3HG2  THR  77          3HG23     THR  77   7.913  12.341 -11.713
  574    H    ALA  78           HN       ALA  78   3.402  11.305 -11.261
  575    HA   ALA  78           HA       ALA  78   1.963  13.465  -9.935
  576   1HB   ALA  78          1HB       ALA  78   1.494  12.761 -12.254
  577   2HB   ALA  78          2HB       ALA  78   0.971  11.165 -11.673
  578   3HB   ALA  78          3HB       ALA  78   0.052  12.620 -11.231
  579    H    MET  79           HN       MET  79   2.814  12.325  -7.753
  580    HA   MET  79           HA       MET  79   1.218  10.140  -6.805
  581   1HB   MET  79          1HB       MET  79   2.274  10.401  -4.730
  582   2HB   MET  79          2HB       MET  79   3.461  10.881  -5.942
  583   1HG   MET  79          2HG       MET  79   3.717  12.495  -4.304
  584   2HG   MET  79          1HG       MET  79   2.682  13.300  -5.481
  585   1HE   MET  79          2HE       MET  79   1.046  14.870  -4.584
  586   2HE   MET  79          3HE       MET  79   0.712  15.006  -2.847
  587   3HE   MET  79          1HE       MET  79   2.391  15.081  -3.432
  588    HA   PRO  80           HA       PRO  80  -0.053   9.733  -4.338
  589   1HB   PRO  80          2HB       PRO  80  -2.999   9.519  -4.983
  590   2HB   PRO  80          1HB       PRO  80  -2.156   9.050  -3.472
  591   1HG   PRO  80          1HG       PRO  80  -3.554  11.378  -3.623
  592   2HG   PRO  80          2HG       PRO  80  -1.949  11.329  -2.832
  593   1HD   PRO  80          2HD       PRO  80  -2.656  12.267  -5.631
  594   2HD   PRO  80          1HD       PRO  80  -1.568  13.022  -4.439
  595    H    THR  81           HN       THR  81   0.129   7.538  -5.102
  596    HA   THR  81           HA       THR  81  -1.037   6.873  -7.727
  597    HB   THR  81           HB       THR  81   1.938   6.901  -7.172
  598    HG1  THR  81           HG1      THR  81   0.268   8.707  -8.310
  599   1HG2  THR  81          1HG21     THR  81   0.386   5.873  -9.580
  600   2HG2  THR  81          3HG23     THR  81   2.134   6.198  -9.573
  601   3HG2  THR  81          2HG22     THR  81   1.463   4.953  -8.501
  602    H    PHE  82           HN       PHE  82  -1.401   4.765  -8.003
  603    HA   PHE  82           HA       PHE  82  -0.561   2.862  -5.904
  604   1HB   PHE  82          1HB       PHE  82  -3.297   3.287  -7.152
  605   2HB   PHE  82          2HB       PHE  82  -2.948   2.012  -6.017
  606    HD1  PHE  82           HD2      PHE  82  -3.292   5.712  -6.449
  607    HD2  PHE  82           HD1      PHE  82  -2.889   2.490  -3.607
  608    HE1  PHE  82           HE2      PHE  82  -3.568   7.310  -4.599
  609    HE2  PHE  82           HE1      PHE  82  -3.292   4.104  -1.761
  610    HZ   PHE  82           HZ       PHE  82  -3.277   6.535  -2.238
  611    H    HIS  83           HN       HIS  83   0.087   0.909  -6.772
  612    HA   HIS  83           HA       HIS  83  -0.396   0.342  -9.662
  613   1HB   HIS  83          2HB       HIS  83   2.178  -0.211  -8.185
  614   2HB   HIS  83          1HB       HIS  83   1.810  -0.617  -9.840
  615    HD2  HIS  83           HD2      HIS  83   0.802   2.887 -10.021
  616    HE1  HIS  83           HE1      HIS  83   5.013   3.009 -10.265
  617    HE2  HIS  83           HE2      HIS  83   2.880   4.320 -10.689
  618    H    VAL  84           HN       VAL  84  -0.440  -1.973 -10.089
  619    HA   VAL  84           HA       VAL  84  -0.637  -3.708  -7.656
  620    HB   VAL  84           HB       VAL  84  -2.199  -4.223 -10.202
  621   1HG1  VAL  84          1HG21     VAL  84  -1.773  -6.040  -8.487
  622   2HG1  VAL  84          3HG23     VAL  84  -2.590  -5.038  -7.276
  623   3HG1  VAL  84          2HG22     VAL  84  -3.483  -5.644  -8.680
  624   1HG2  VAL  84          3HG13     VAL  84  -3.113  -2.621  -7.767
  625   2HG2  VAL  84          2HG12     VAL  84  -3.017  -2.030  -9.441
  626   3HG2  VAL  84          1HG11     VAL  84  -4.190  -3.278  -9.012
  627    H    TYR  85           HN       TYR  85   0.887  -5.310  -7.646
  628    HA   TYR  85           HA       TYR  85   2.402  -5.800 -10.199
  629   1HB   TYR  85          1HB       TYR  85   3.356  -6.159  -7.361
  630   2HB   TYR  85          2HB       TYR  85   4.298  -6.239  -8.851
  631    HD1  TYR  85           HD1      TYR  85   4.079  -3.978 -10.361
  632    HD2  TYR  85           HD2      TYR  85   3.662  -4.241  -6.080
  633    HE1  TYR  85           HE1      TYR  85   4.702  -1.586 -10.150
  634    HE2  TYR  85           HE2      TYR  85   4.413  -1.899  -5.869
  635    HH   TYR  85           HH       TYR  85   4.720   0.261  -8.620
  636    H    LYS  86           HN       LYS  86   0.825  -7.523 -10.838
  637    HA   LYS  86           HA       LYS  86   0.761  -9.952  -9.063
  638   1HB   LYS  86          2HB       LYS  86  -0.792  -9.394 -11.628
  639   2HB   LYS  86          1HB       LYS  86  -1.011 -10.741 -10.495
  640   1HG   LYS  86          2HG       LYS  86  -1.496  -8.984  -8.696
  641   2HG   LYS  86          1HG       LYS  86  -1.547  -7.793 -10.001
  642   1HD   LYS  86          1HD       LYS  86  -3.780  -8.462  -9.424
  643   2HD   LYS  86          2HD       LYS  86  -3.438  -9.003 -11.066
  644   1HE   LYS  86          1HE       LYS  86  -3.219 -11.300 -10.341
  645   2HE   LYS  86          2HE       LYS  86  -3.154 -10.824  -8.630
  646   1HZ   LYS  86          1HZ       LYS  86  -5.511 -10.420 -10.355
  647   2HZ   LYS  86          2HZ       LYS  86  -5.283 -11.703  -9.346
  648   3HZ   LYS  86          3HZ       LYS  86  -5.407 -10.187  -8.727
  649    H    ASP  87           HN       ASP  87   0.657 -12.044 -10.794
  650    HA   ASP  87           HA       ASP  87   3.180 -12.572 -11.822
  651   1HB   ASP  87          1HB       ASP  87   0.814 -13.318 -13.547
  652   2HB   ASP  87          2HB       ASP  87   2.307 -14.161 -13.303
  653    H    GLY  88           HN       GLY  88   0.410 -11.118 -13.346
  654   1HA   GLY  88          1HA       GLY  88   1.415 -10.395 -15.900
  655   2HA   GLY  88          2HA       GLY  88   0.007  -9.694 -15.078
  656    H    VAL  89           HN       VAL  89   2.968  -9.421 -13.236
  657    HA   VAL  89           HA       VAL  89   4.477  -7.850 -12.860
  658    HB   VAL  89           HB       VAL  89   3.873  -7.137 -15.785
  659   1HG1  VAL  89          2HG22     VAL  89   6.163  -6.425 -14.000
  660   2HG1  VAL  89          1HG21     VAL  89   6.424  -6.735 -15.737
  661   3HG1  VAL  89          3HG23     VAL  89   5.318  -5.470 -15.256
  662   1HG2  VAL  89          1HG11     VAL  89   5.434  -9.391 -14.467
  663   2HG2  VAL  89          2HG12     VAL  89   4.197  -9.503 -15.714
  664   3HG2  VAL  89          3HG13     VAL  89   5.767  -8.879 -16.135
  665    H    LYS  90           HN       LYS  90   4.401  -5.042 -13.727
  666    HA   LYS  90           HA       LYS  90   2.417  -3.926 -11.975
  667   1HB   LYS  90          1HB       LYS  90   4.566  -2.806 -12.610
  668   2HB   LYS  90          2HB       LYS  90   3.950  -2.626 -14.262
  669   1HG   LYS  90          1HG       LYS  90   2.006  -1.285 -13.326
  670   2HG   LYS  90          2HG       LYS  90   2.675  -1.513 -11.719
  671   1HD   LYS  90          2HD       LYS  90   3.249   0.697 -12.561
  672   2HD   LYS  90          1HD       LYS  90   4.708  -0.257 -12.304
  673   1HE   LYS  90          1HE       LYS  90   4.684   1.107 -14.418
  674   2HE   LYS  90          2HE       LYS  90   4.989  -0.613 -14.690
  675   1HZ   LYS  90          3HZ       LYS  90   2.356   0.669 -14.977
  676   2HZ   LYS  90          2HZ       LYS  90   3.385   0.335 -16.228
  677   3HZ   LYS  90          1HZ       LYS  90   2.735  -0.889 -15.337
  678    H    ALA  91           HN       ALA  91   0.671  -5.204 -12.700
  679    HA   ALA  91           HA       ALA  91  -0.101  -5.330 -15.417
  680   1HB   ALA  91          1HB       ALA  91  -0.482  -7.136 -13.735
  681   2HB   ALA  91          2HB       ALA  91  -1.631  -6.097 -12.872
  682   3HB   ALA  91          3HB       ALA  91  -2.011  -6.667 -14.511
  683    H    ASP  92           HN       ASP  92  -1.108  -3.325 -12.696
  684    HA   ASP  92           HA       ASP  92  -2.894  -1.759 -14.400
  685   1HB   ASP  92          1HB       ASP  92  -4.186  -3.700 -13.309
  686   2HB   ASP  92          2HB       ASP  92  -3.885  -2.905 -11.753
  687    H    ASP  93           HN       ASP  93  -3.379   0.312 -13.373
  688    HA   ASP  93           HA       ASP  93  -1.731   1.125 -11.096
  689   1HB   ASP  93          1HB       ASP  93  -1.387   2.437 -13.822
  690   2HB   ASP  93          2HB       ASP  93  -0.670   2.995 -12.310
  691    H    LEU  94           HN       LEU  94  -2.216   3.367 -10.499
  692    HA   LEU  94           HA       LEU  94  -4.586   4.683 -11.596
  693   1HB   LEU  94          2HB       LEU  94  -5.573   2.919 -10.361
  694   2HB   LEU  94          1HB       LEU  94  -4.498   3.100  -8.983
  695    HG   LEU  94           HG       LEU  94  -6.890   3.699  -8.736
  696   1HD1  LEU  94          1HD21     LEU  94  -5.253   4.434  -7.113
  697   2HD1  LEU  94          2HD22     LEU  94  -5.047   5.979  -7.982
  698   3HD1  LEU  94          3HD23     LEU  94  -6.599   5.544  -7.247
  699   1HD2  LEU  94          2HD12     LEU  94  -6.778   4.985 -11.055
  700   2HD2  LEU  94          1HD11     LEU  94  -7.852   5.559  -9.780
  701   3HD2  LEU  94          3HD13     LEU  94  -6.311   6.363 -10.045
  702    H    VAL  95           HN       VAL  95  -4.622   6.895 -10.937
  703    HA   VAL  95           HA       VAL  95  -2.503   7.784  -9.076
  704    HB   VAL  95           HB       VAL  95  -2.123   9.714 -10.585
  705   1HG1  VAL  95          1HG11     VAL  95  -0.599   7.791 -10.624
  706   2HG1  VAL  95          3HG13     VAL  95  -1.567   7.025 -11.904
  707   3HG1  VAL  95          2HG12     VAL  95  -0.727   8.558 -12.214
  708   1HG2  VAL  95          1HG21     VAL  95  -4.267   9.655 -11.855
  709   2HG2  VAL  95          3HG23     VAL  95  -2.851   9.659 -12.914
  710   3HG2  VAL  95          2HG22     VAL  95  -3.746   8.154 -12.650
  711    H    GLY  96           HN       GLY  96  -2.861   9.893  -8.181
  712   1HA   GLY  96          1HA       GLY  96  -4.131  11.639  -7.350
  713   2HA   GLY  96          2HA       GLY  96  -5.441  11.218  -8.467
  714    H    ALA  97           HN       ALA  97  -6.422  11.928  -6.178
  715    HA   ALA  97           HA       ALA  97  -6.550   9.804  -4.179
  716   1HB   ALA  97          1HB       ALA  97  -6.621  12.246  -3.614
  717   2HB   ALA  97          3HB       ALA  97  -8.171  12.375  -4.470
  718   3HB   ALA  97          2HB       ALA  97  -8.038  11.365  -3.014
  719    H    SER  98           HN       SER  98  -7.280   8.699  -6.582
  720    HA   SER  98           HA       SER  98 -10.172   8.749  -7.023
  721   1HB   SER  98          1HB       SER  98  -8.006   6.957  -8.122
  722   2HB   SER  98          2HB       SER  98  -9.608   7.248  -8.833
  723    HG   SER  98           HG       SER  98  -7.313   8.674  -9.123
  724    H    GLN  99           HN       GLN  99 -10.145   8.181  -4.506
  725    HA   GLN  99           HA       GLN  99  -9.569   5.698  -3.454
  726   1HB   GLN  99          2HB       GLN  99 -10.375   7.671  -2.187
  727   2HB   GLN  99          1HB       GLN  99 -11.991   7.462  -2.868
  728   1HG   GLN  99          1HG       GLN  99 -11.864   6.577  -0.578
  729   2HG   GLN  99          2HG       GLN  99 -12.251   5.307  -1.738
  730   1HE2  GLN  99          2HE22     GLN  99  -8.431   5.286  -0.123
  731   2HE2  GLN  99          1HE21     GLN  99  -9.164   6.826  -0.543
  732    H    ASP 100           HN       ASP 100 -12.652   6.584  -5.116
  733    HA   ASP 100           HA       ASP 100 -14.000   4.165  -4.837
  734   1HB   ASP 100          1HB       ASP 100 -13.992   5.976  -7.299
  735   2HB   ASP 100          2HB       ASP 100 -15.264   4.847  -6.814
  736    H    LYS 101           HN       LYS 101 -11.627   5.124  -7.356
  737    HA   LYS 101           HA       LYS 101 -11.881   2.609  -8.779
  738   1HB   LYS 101          1HB       LYS 101 -11.196   4.727  -9.880
  739   2HB   LYS 101          2HB       LYS 101  -9.693   4.708  -8.947
  740   1HG   LYS 101          2HG       LYS 101  -8.894   2.746 -10.026
  741   2HG   LYS 101          1HG       LYS 101 -10.500   2.289 -10.607
  742   1HD   LYS 101          2HD       LYS 101 -10.548   4.130 -12.194
  743   2HD   LYS 101          1HD       LYS 101  -8.972   4.708 -11.660
  744   1HE   LYS 101          1HE       LYS 101  -9.551   1.984 -12.934
  745   2HE   LYS 101          2HE       LYS 101  -8.829   3.376 -13.754
  746   1HZ   LYS 101          3HZ       LYS 101  -6.968   3.225 -12.259
  747   2HZ   LYS 101          2HZ       LYS 101  -7.636   1.925 -11.496
  748   3HZ   LYS 101          1HZ       LYS 101  -7.180   1.815 -13.070
  749    H    LEU 102           HN       LEU 102  -9.746   3.930  -6.213
  750    HA   LEU 102           HA       LEU 102  -7.871   1.809  -6.213
  751   1HB   LEU 102          1HB       LEU 102  -7.641   3.948  -4.972
  752   2HB   LEU 102          2HB       LEU 102  -8.888   3.429  -3.830
  753    HG   LEU 102           HG       LEU 102  -7.529   1.642  -2.978
  754   1HD1  LEU 102          1HD21     LEU 102  -5.503   2.499  -5.088
  755   2HD1  LEU 102          2HD22     LEU 102  -5.123   1.455  -3.700
  756   3HD1  LEU 102          3HD23     LEU 102  -6.266   0.901  -4.921
  757   1HD2  LEU 102          2HD12     LEU 102  -6.074   4.315  -3.229
  758   2HD2  LEU 102          3HD13     LEU 102  -7.321   3.902  -2.035
  759   3HD2  LEU 102          1HD11     LEU 102  -5.746   3.096  -1.989
  760    H    LYS 103           HN       LYS 103 -10.992   2.157  -4.401
  761    HA   LYS 103           HA       LYS 103 -10.969  -0.410  -3.186
  762   1HB   LYS 103          1HB       LYS 103 -13.216   1.440  -4.111
  763   2HB   LYS 103          2HB       LYS 103 -13.502  -0.113  -3.322
  764   1HG   LYS 103          1HG       LYS 103 -12.174   0.585  -1.379
  765   2HG   LYS 103          2HG       LYS 103 -11.894   2.177  -2.118
  766   1HD   LYS 103          1HD       LYS 103 -14.295   2.674  -2.059
  767   2HD   LYS 103          2HD       LYS 103 -14.670   1.011  -1.583
  768   1HE   LYS 103          1HE       LYS 103 -14.847   2.422   0.373
  769   2HE   LYS 103          2HE       LYS 103 -13.472   1.327   0.569
  770   1HZ   LYS 103          2HZ       LYS 103 -12.044   3.157  -0.118
  771   2HZ   LYS 103          1HZ       LYS 103 -13.355   4.149  -0.229
  772   3HZ   LYS 103          3HZ       LYS 103 -12.915   3.525   1.231
  773    H    ALA 104           HN       ALA 104 -12.296   0.662  -6.375
  774    HA   ALA 104           HA       ALA 104 -13.236  -1.845  -7.222
  775   1HB   ALA 104          3HB       ALA 104 -13.624   0.334  -8.395
  776   2HB   ALA 104          2HB       ALA 104 -11.956   0.264  -9.012
  777   3HB   ALA 104          1HB       ALA 104 -13.121  -0.982  -9.474
  778    H    LEU 105           HN       LEU 105  -9.893  -0.503  -7.530
  779    HA   LEU 105           HA       LEU 105  -8.796  -2.673  -8.996
  780   1HB   LEU 105          2HB       LEU 105  -7.509  -0.820  -6.929
  781   2HB   LEU 105          1HB       LEU 105  -6.625  -2.044  -7.819
  782    HG   LEU 105           HG       LEU 105  -7.999   0.365  -9.068
  783   1HD1  LEU 105          3HD13     LEU 105  -5.102  -0.390  -8.447
  784   2HD1  LEU 105          1HD11     LEU 105  -5.562   0.929  -9.518
  785   3HD1  LEU 105          2HD12     LEU 105  -6.015   0.991  -7.802
  786   1HD2  LEU 105          1HD21     LEU 105  -6.271  -1.822 -10.288
  787   2HD2  LEU 105          2HD22     LEU 105  -7.984  -1.510 -10.674
  788   3HD2  LEU 105          3HD23     LEU 105  -6.756  -0.321 -11.104
  789    H    VAL 106           HN       VAL 106  -8.838  -2.085  -5.436
  790    HA   VAL 106           HA       VAL 106  -7.595  -4.503  -4.685
  791    HB   VAL 106           HB       VAL 106  -9.768  -2.896  -3.269
  792   1HG1  VAL 106          3HG23     VAL 106  -9.664  -5.204  -2.354
  793   2HG1  VAL 106          1HG21     VAL 106  -7.914  -5.036  -2.125
  794   3HG1  VAL 106          2HG22     VAL 106  -9.049  -4.012  -1.210
  795   1HG2  VAL 106          2HG12     VAL 106  -7.597  -1.689  -3.706
  796   2HG2  VAL 106          1HG11     VAL 106  -7.917  -1.960  -1.987
  797   3HG2  VAL 106          3HG13     VAL 106  -6.749  -2.986  -2.852
  798    H    ALA 107           HN       ALA 107 -11.062  -3.825  -5.052
  799    HA   ALA 107           HA       ALA 107 -12.021  -6.422  -4.540
  800   1HB   ALA 107          1HB       ALA 107 -13.471  -4.417  -4.720
  801   2HB   ALA 107          2HB       ALA 107 -13.170  -4.345  -6.469
  802   3HB   ALA 107          3HB       ALA 107 -14.052  -5.721  -5.775
  803    H    LYS 108           HN       LYS 108 -11.183  -5.036  -7.759
  804    HA   LYS 108           HA       LYS 108 -11.715  -7.357  -9.302
  805   1HB   LYS 108          1HB       LYS 108 -11.345  -5.368 -10.468
  806   2HB   LYS 108          2HB       LYS 108  -9.882  -4.952  -9.603
  807   1HG   LYS 108          1HG       LYS 108  -8.506  -6.221 -10.883
  808   2HG   LYS 108          2HG       LYS 108  -9.681  -7.479 -11.177
  809   1HD   LYS 108          2HD       LYS 108 -10.021  -4.764 -12.467
  810   2HD   LYS 108          1HD       LYS 108  -8.905  -5.961 -13.139
  811   1HE   LYS 108          1HE       LYS 108 -11.815  -6.636 -12.539
  812   2HE   LYS 108          2HE       LYS 108 -11.251  -6.057 -14.116
  813   1HZ   LYS 108          1HZ       LYS 108 -10.241  -8.493 -12.780
  814   2HZ   LYS 108          3HZ       LYS 108 -11.342  -8.444 -14.004
  815   3HZ   LYS 108          2HZ       LYS 108  -9.801  -7.925 -14.254
  816    H    HIS 109           HN       HIS 109  -8.595  -6.144  -8.260
  817    HA   HIS 109           HA       HIS 109  -7.145  -8.442  -9.141
  818   1HB   HIS 109          1HB       HIS 109  -6.357  -6.153  -7.302
  819   2HB   HIS 109          2HB       HIS 109  -5.235  -7.379  -7.911
  820    HD2  HIS 109           HD2      HIS 109  -6.864  -4.094  -9.109
  821    HE1  HIS 109           HE1      HIS 109  -5.123  -5.871 -12.507
  822    HE2  HIS 109           HE2      HIS 109  -6.293  -3.790 -11.646
  823    H    ALA 110           HN       ALA 110  -8.762  -7.871  -6.042
  824    HA   ALA 110           HA       ALA 110  -7.491  -9.959  -4.561
  825   1HB   ALA 110          3HB       ALA 110 -10.354  -8.938  -4.477
  826   2HB   ALA 110          1HB       ALA 110  -9.607 -10.020  -3.286
  827   3HB   ALA 110          2HB       ALA 110  -8.987  -8.375  -3.483
  828    H    ALA 111           HN       ALA 111 -10.073  -9.976  -7.035
  829    HA   ALA 111           HA       ALA 111 -10.512 -12.885  -6.734
  830   1HB   ALA 111          2HB       ALA 111 -11.765 -10.813  -8.592
  831   2HB   ALA 111          1HB       ALA 111 -12.225 -12.523  -8.462
  832   3HB   ALA 111          3HB       ALA 111 -12.458 -11.434  -7.080
  833    H    ALA 112           HN       ALA 112  -9.696 -10.626  -9.385
  834    HA   ALA 112           HA       ALA 112  -7.451 -12.112 -10.349
  835   1HB   ALA 112          3HB       ALA 112 -10.053 -12.335 -11.935
  836   2HB   ALA 112          2HB       ALA 112  -8.441 -12.779 -12.533
  837   3HB   ALA 112          1HB       ALA 112  -9.165 -13.684 -11.191
   
  No H/Q in entry =         837
  Start of MODEL   17
    1   1H    GLY   1          2HN       GLY   1   1.180 -13.724   1.098
    2   2H    GLY   1          1HN       GLY   1   2.233 -13.531   2.315
    3   3H    GLY   1          3HN       GLY   1   1.552 -15.005   2.078
    4   1HA   GLY   1          1HA       GLY   1  -0.587 -14.295   2.734
    5   2HA   GLY   1          2HA       GLY   1   0.575 -13.762   3.974
    6    H    GLY   2           HN       GLY   2  -1.433 -12.249   4.300
    7   1HA   GLY   2          1HA       GLY   2  -1.968 -10.184   2.385
    8   2HA   GLY   2          2HA       GLY   2  -2.463 -10.244   4.078
    9    H    SER   3           HN       SER   3   0.397  -9.526   1.997
   10    HA   SER   3           HA       SER   3   1.763  -8.009   4.034
   11   1HB   SER   3          2HB       SER   3   2.022  -7.701   1.023
   12   2HB   SER   3          1HB       SER   3   3.197  -7.292   2.277
   13    HG   SER   3           HG       SER   3   3.690  -9.277   1.293
   14    H    VAL   4           HN       VAL   4  -0.202  -6.826   4.798
   15    HA   VAL   4           HA       VAL   4  -0.925  -4.416   3.204
   16    HB   VAL   4           HB       VAL   4  -2.942  -4.505   4.560
   17   1HG1  VAL   4          3HG13     VAL   4  -2.765  -5.943   2.463
   18   2HG1  VAL   4          2HG12     VAL   4  -2.503  -7.323   3.539
   19   3HG1  VAL   4          1HG11     VAL   4  -4.009  -6.398   3.631
   20   1HG2  VAL   4          1HG21     VAL   4  -2.078  -5.348   6.686
   21   2HG2  VAL   4          3HG23     VAL   4  -3.441  -6.312   6.115
   22   3HG2  VAL   4          2HG22     VAL   4  -1.791  -6.930   5.970
   23    H    ILE   5           HN       ILE   5   1.536  -4.357   4.737
   24    HA   ILE   5           HA       ILE   5   0.755  -2.721   7.138
   25    HB   ILE   5           HB       ILE   5   2.857  -3.321   8.133
   26   1HG1  ILE   5          1HG11     ILE   5   3.362  -5.127   5.718
   27   2HG1  ILE   5          2HG12     ILE   5   4.215  -3.611   6.058
   28   1HG2  ILE   5          2HG22     ILE   5   0.781  -4.746   8.382
   29   2HG2  ILE   5          1HG21     ILE   5   1.438  -5.843   7.149
   30   3HG2  ILE   5          3HG23     ILE   5   2.288  -5.607   8.689
   31   1HD1  ILE   5          2HD12     ILE   5   4.932  -4.556   8.281
   32   2HD1  ILE   5          3HD13     ILE   5   4.306  -6.132   7.740
   33   3HD1  ILE   5          1HD11     ILE   5   5.624  -5.348   6.860
   34    H    VAL   6           HN       VAL   6   1.956  -0.933   7.702
   35    HA   VAL   6           HA       VAL   6   2.998   0.634   5.453
   36    HB   VAL   6           HB       VAL   6   1.361   1.586   7.066
   37   1HG1  VAL   6          1HG11     VAL   6   2.165   0.481   9.167
   38   2HG1  VAL   6          3HG13     VAL   6   3.607   1.521   9.128
   39   3HG1  VAL   6          2HG12     VAL   6   1.998   2.234   9.310
   40   1HG2  VAL   6          1HG21     VAL   6   2.799   3.075   5.800
   41   2HG2  VAL   6          2HG22     VAL   6   2.514   3.727   7.419
   42   3HG2  VAL   6          3HG23     VAL   6   4.071   2.964   7.041
   43    H    ILE   7           HN       ILE   7   5.187   1.191   5.318
   44    HA   ILE   7           HA       ILE   7   7.069   0.629   7.300
   45    HB   ILE   7           HB       ILE   7   6.616  -1.755   6.708
   46   1HG1  ILE   7          1HG11     ILE   7   8.889  -2.512   6.315
   47   2HG1  ILE   7          2HG12     ILE   7   9.401  -0.892   5.796
   48   1HG2  ILE   7          2HG22     ILE   7   5.988  -1.373   4.315
   49   2HG2  ILE   7          3HG23     ILE   7   7.707  -1.119   3.934
   50   3HG2  ILE   7          1HG21     ILE   7   7.150  -2.680   4.552
   51   1HD1  ILE   7          1HD11     ILE   7   8.304  -1.576   8.564
   52   2HD1  ILE   7          3HD13     ILE   7  10.029  -1.517   8.149
   53   3HD1  ILE   7          2HD12     ILE   7   9.062  -0.041   8.069
   54    H    ASP   8           HN       ASP   8   6.445   0.949   4.120
   55    HA   ASP   8           HA       ASP   8   7.361   2.152   2.291
   56   1HB   ASP   8          2HB       ASP   8   7.317   4.094   4.649
   57   2HB   ASP   8          1HB       ASP   8   7.295   4.543   2.946
   58    H    SER   9           HN       SER   9   9.439   0.635   3.054
   59    HA   SER   9           HA       SER   9  11.800   2.457   2.915
   60   1HB   SER   9          1HB       SER   9  11.535  -0.094   4.567
   61   2HB   SER   9          2HB       SER   9  13.004   0.877   4.365
   62    HG   SER   9           HG       SER   9  10.556   1.805   5.513
   63    H    LYS  10           HN       LYS  10  13.161   1.875   1.234
   64    HA   LYS  10           HA       LYS  10  12.425   0.220  -0.838
   65   1HB   LYS  10          2HB       LYS  10  14.327   1.929  -0.697
   66   2HB   LYS  10          1HB       LYS  10  15.301   0.656   0.035
   67   1HG   LYS  10          1HG       LYS  10  15.080  -0.744  -1.980
   68   2HG   LYS  10          2HG       LYS  10  13.923   0.394  -2.672
   69   1HD   LYS  10          1HD       LYS  10  16.064   0.707  -3.732
   70   2HD   LYS  10          2HD       LYS  10  15.672   2.149  -2.781
   71   1HE   LYS  10          1HE       LYS  10  17.207   1.414  -0.988
   72   2HE   LYS  10          2HE       LYS  10  17.512  -0.110  -1.845
   73   1HZ   LYS  10          1HZ       LYS  10  18.180   2.575  -2.824
   74   2HZ   LYS  10          3HZ       LYS  10  19.238   1.483  -2.194
   75   3HZ   LYS  10          2HZ       LYS  10  18.475   1.161  -3.617
   76    H    ALA  11           HN       ALA  11  14.524  -0.546   1.859
   77    HA   ALA  11           HA       ALA  11  15.197  -3.242   1.182
   78   1HB   ALA  11          1HB       ALA  11  16.479  -1.833   2.769
   79   2HB   ALA  11          2HB       ALA  11  15.120  -1.888   3.917
   80   3HB   ALA  11          3HB       ALA  11  16.003  -3.374   3.508
   81    H    ALA  12           HN       ALA  12  12.180  -2.038   2.248
   82    HA   ALA  12           HA       ALA  12  11.319  -4.706   3.289
   83   1HB   ALA  12          3HB       ALA  12  11.039  -2.827   4.865
   84   2HB   ALA  12          1HB       ALA  12  10.060  -1.964   3.652
   85   3HB   ALA  12          2HB       ALA  12   9.490  -3.506   4.322
   86    H    TRP  13           HN       TRP  13  10.742  -2.096   0.953
   87    HA   TRP  13           HA       TRP  13   8.320  -2.765  -0.187
   88   1HB   TRP  13          2HB       TRP  13   9.096  -0.912  -1.211
   89   2HB   TRP  13          1HB       TRP  13  10.776  -1.336  -0.969
   90    HD1  TRP  13           HD1      TRP  13  12.031  -2.727  -2.839
   91    HE1  TRP  13           HE1      TRP  13  11.651  -2.928  -5.379
   92    HE3  TRP  13           HE3      TRP  13   7.249  -0.904  -3.120
   93    HZ2  TRP  13           HZ2      TRP  13   9.615  -2.354  -7.251
   94    HZ3  TRP  13           HZ3      TRP  13   6.183  -0.594  -5.338
   95    HH2  TRP  13           HH2      TRP  13   7.315  -1.379  -7.401
   96    H    ASP  14           HN       ASP  14  11.493  -4.280  -0.877
   97    HA   ASP  14           HA       ASP  14  10.429  -6.085  -2.879
   98   1HB   ASP  14          1HB       ASP  14  12.622  -7.094  -2.823
   99   2HB   ASP  14          2HB       ASP  14  12.781  -5.330  -2.769
  100    H    ALA  15           HN       ALA  15  11.534  -6.472   0.441
  101    HA   ALA  15           HA       ALA  15  10.989  -9.132   0.939
  102   1HB   ALA  15          2HB       ALA  15  12.040  -7.549   2.562
  103   2HB   ALA  15          1HB       ALA  15  10.432  -6.880   2.922
  104   3HB   ALA  15          3HB       ALA  15  10.793  -8.571   3.304
  105    H    GLN  16           HN       GLN  16   8.659  -6.483   1.155
  106    HA   GLN  16           HA       GLN  16   6.352  -7.779   2.098
  107   1HB   GLN  16          2HB       GLN  16   7.059  -5.340   0.596
  108   2HB   GLN  16          1HB       GLN  16   5.492  -5.966   0.115
  109   1HG   GLN  16          2HG       GLN  16   5.549  -4.263   1.980
  110   2HG   GLN  16          1HG       GLN  16   4.550  -5.688   2.203
  111   1HE2  GLN  16          1HE21     GLN  16   8.016  -5.558   4.466
  112   2HE2  GLN  16          2HE22     GLN  16   8.087  -5.053   2.783
  113    H    LEU  17           HN       LEU  17   7.597  -7.625  -1.238
  114    HA   LEU  17           HA       LEU  17   5.406  -9.029  -2.455
  115   1HB   LEU  17          2HB       LEU  17   8.305  -8.944  -3.397
  116   2HB   LEU  17          1HB       LEU  17   6.859  -9.196  -4.357
  117    HG   LEU  17           HG       LEU  17   7.611  -6.589  -3.000
  118   1HD1  LEU  17          1HD21     LEU  17   9.044  -7.180  -4.942
  119   2HD1  LEU  17          3HD23     LEU  17   7.588  -7.348  -5.945
  120   3HD1  LEU  17          2HD22     LEU  17   8.016  -5.770  -5.261
  121   1HD2  LEU  17          2HD12     LEU  17   5.339  -7.277  -4.887
  122   2HD2  LEU  17          1HD11     LEU  17   5.149  -6.851  -3.171
  123   3HD2  LEU  17          3HD13     LEU  17   5.742  -5.643  -4.327
  124    H    ALA  18           HN       ALA  18   8.404 -10.051  -0.874
  125    HA   ALA  18           HA       ALA  18   8.327 -12.778  -1.887
  126   1HB   ALA  18          2HB       ALA  18  10.425 -11.643  -1.235
  127   2HB   ALA  18          1HB       ALA  18   9.884 -11.593   0.456
  128   3HB   ALA  18          3HB       ALA  18  10.164 -13.154  -0.338
  129    H    LYS  19           HN       LYS  19   7.684 -11.265   1.334
  130    HA   LYS  19           HA       LYS  19   6.553 -13.682   2.450
  131   1HB   LYS  19          2HB       LYS  19   5.720 -12.267   4.238
  132   2HB   LYS  19          1HB       LYS  19   7.400 -11.850   3.865
  133   1HG   LYS  19          1HG       LYS  19   6.643  -9.887   2.598
  134   2HG   LYS  19          2HG       LYS  19   4.968 -10.338   2.828
  135   1HD   LYS  19          1HD       LYS  19   5.272  -8.653   4.360
  136   2HD   LYS  19          2HD       LYS  19   5.350 -10.114   5.348
  137   1HE   LYS  19          2HE       LYS  19   7.798  -9.959   5.450
  138   2HE   LYS  19          1HE       LYS  19   7.807  -8.654   4.247
  139   1HZ   LYS  19          3HZ       LYS  19   6.609  -7.288   5.764
  140   2HZ   LYS  19          1HZ       LYS  19   6.605  -8.474   6.912
  141   3HZ   LYS  19          2HZ       LYS  19   8.031  -7.794   6.440
  142    H    GLY  20           HN       GLY  20   5.258 -11.050   0.442
  143   1HA   GLY  20          1HA       GLY  20   2.529 -11.433   0.741
  144   2HA   GLY  20          2HA       GLY  20   3.388 -10.787  -0.663
  145    H    LYS  21           HN       LYS  21   4.729 -12.686  -1.705
  146    HA   LYS  21           HA       LYS  21   4.972 -14.768  -2.632
  147   1HB   LYS  21          1HB       LYS  21   2.042 -15.291  -1.946
  148   2HB   LYS  21          2HB       LYS  21   2.858 -16.117  -3.227
  149   1HG   LYS  21          1HG       LYS  21   2.993 -17.408  -1.218
  150   2HG   LYS  21          2HG       LYS  21   4.588 -16.983  -1.843
  151   1HD   LYS  21          2HD       LYS  21   4.740 -15.161  -0.122
  152   2HD   LYS  21          1HD       LYS  21   3.196 -15.703   0.548
  153   1HE   LYS  21          2HE       LYS  21   5.795 -17.303   0.331
  154   2HE   LYS  21          1HE       LYS  21   5.149 -16.570   1.805
  155   1HZ   LYS  21          3HZ       LYS  21   3.251 -18.027   1.620
  156   2HZ   LYS  21          2HZ       LYS  21   3.876 -18.719   0.259
  157   3HZ   LYS  21          1HZ       LYS  21   4.656 -18.885   1.699
  158    H    GLU  22           HN       GLU  22   5.610 -13.237  -4.066
  159    HA   GLU  22           HA       GLU  22   3.935 -12.012  -6.063
  160   1HB   GLU  22          1HB       GLU  22   6.113 -11.154  -5.147
  161   2HB   GLU  22          2HB       GLU  22   6.958 -12.449  -6.013
  162   1HG   GLU  22          1HG       GLU  22   6.165 -11.526  -8.173
  163   2HG   GLU  22          2HG       GLU  22   5.207 -10.313  -7.318
  164    H    GLU  23           HN       GLU  23   2.999 -14.324  -6.262
  165    HA   GLU  23           HA       GLU  23   4.161 -15.613  -8.728
  166   1HB   GLU  23          1HB       GLU  23   2.570 -16.943  -6.473
  167   2HB   GLU  23          2HB       GLU  23   2.953 -17.656  -8.044
  168   1HG   GLU  23          2HG       GLU  23   4.667 -18.528  -6.809
  169   2HG   GLU  23          1HG       GLU  23   5.462 -17.080  -7.429
  170    H    HIS  24           HN       HIS  24   1.053 -15.225  -6.932
  171    HA   HIS  24           HA       HIS  24  -0.185 -14.013  -9.285
  172   1HB   HIS  24          2HB       HIS  24  -0.451 -16.432  -9.738
  173   2HB   HIS  24          1HB       HIS  24  -1.304 -16.625  -8.203
  174    HD2  HIS  24           HD2      HIS  24  -3.681 -14.583  -8.186
  175    HE1  HIS  24           HE1      HIS  24  -4.238 -15.317 -12.303
  176    HE2  HIS  24           HE2      HIS  24  -5.304 -14.346 -10.172
  177    H    LYS  25           HN       LYS  25  -0.422 -12.195  -7.928
  178    HA   LYS  25           HA       LYS  25  -2.713 -12.289  -6.164
  179   1HB   LYS  25          2HB       LYS  25   0.037 -11.464  -5.095
  180   2HB   LYS  25          1HB       LYS  25  -1.514 -11.171  -4.296
  181   1HG   LYS  25          1HG       LYS  25  -1.840 -13.712  -4.258
  182   2HG   LYS  25          2HG       LYS  25  -0.163 -13.850  -4.813
  183   1HD   LYS  25          1HD       LYS  25  -0.276 -14.157  -2.430
  184   2HD   LYS  25          2HD       LYS  25   0.652 -12.704  -2.811
  185   1HE   LYS  25          1HE       LYS  25  -1.148 -11.257  -2.114
  186   2HE   LYS  25          2HE       LYS  25  -2.319 -12.591  -2.173
  187   1HZ   LYS  25          1HZ       LYS  25  -1.168 -13.569  -0.322
  188   2HZ   LYS  25          2HZ       LYS  25  -0.149 -12.270  -0.230
  189   3HZ   LYS  25          3HZ       LYS  25  -1.764 -12.079   0.044
  190    HA   PRO  26           HA       PRO  26  -2.597  -7.990  -7.729
  191   1HB   PRO  26          2HB       PRO  26  -4.500  -6.816  -6.201
  192   2HB   PRO  26          1HB       PRO  26  -4.916  -8.059  -7.417
  193   1HG   PRO  26          2HG       PRO  26  -4.516  -8.443  -4.462
  194   2HG   PRO  26          1HG       PRO  26  -5.889  -9.010  -5.422
  195   1HD   PRO  26          1HD       PRO  26  -3.845 -10.732  -4.910
  196   2HD   PRO  26          2HD       PRO  26  -4.608 -10.683  -6.515
  197    H    ILE  27           HN       ILE  27  -0.689  -7.203  -7.331
  198    HA   ILE  27           HA       ILE  27   0.142  -6.472  -4.593
  199    HB   ILE  27           HB       ILE  27   1.647  -6.331  -7.216
  200   1HG1  ILE  27          1HG11     ILE  27   1.287  -8.628  -5.283
  201   2HG1  ILE  27          2HG12     ILE  27   1.052  -8.593  -7.033
  202   1HG2  ILE  27          2HG22     ILE  27   2.504  -4.992  -5.200
  203   2HG2  ILE  27          1HG21     ILE  27   2.759  -6.557  -4.403
  204   3HG2  ILE  27          3HG23     ILE  27   3.625  -6.153  -5.901
  205   1HD1  ILE  27          2HD12     ILE  27   3.537  -8.260  -7.305
  206   2HD1  ILE  27          3HD13     ILE  27   3.685  -8.630  -5.566
  207   3HD1  ILE  27          1HD11     ILE  27   2.996  -9.828  -6.669
  208    H    VAL  28           HN       VAL  28  -1.342  -4.781  -4.245
  209    HA   VAL  28           HA       VAL  28  -1.380  -2.526  -6.171
  210    HB   VAL  28           HB       VAL  28  -2.848  -2.783  -3.518
  211   1HG1  VAL  28          2HG12     VAL  28  -3.282  -1.078  -6.022
  212   2HG1  VAL  28          3HG13     VAL  28  -4.346  -1.106  -4.608
  213   3HG1  VAL  28          1HG11     VAL  28  -2.686  -0.493  -4.458
  214   1HG2  VAL  28          1HG21     VAL  28  -3.813  -3.580  -6.298
  215   2HG2  VAL  28          3HG23     VAL  28  -3.534  -4.686  -4.933
  216   3HG2  VAL  28          2HG22     VAL  28  -4.812  -3.480  -4.834
  217    H    VAL  29           HN       VAL  29   0.180  -0.935  -5.917
  218    HA   VAL  29           HA       VAL  29   1.230  -0.511  -3.145
  219    HB   VAL  29           HB       VAL  29   2.980  -1.565  -4.303
  220   1HG1  VAL  29          1HG11     VAL  29   2.309  -1.143  -6.639
  221   2HG1  VAL  29          2HG12     VAL  29   2.826   0.549  -6.444
  222   3HG1  VAL  29          3HG13     VAL  29   4.013  -0.765  -6.313
  223   1HG2  VAL  29          3HG23     VAL  29   3.289   0.586  -2.864
  224   2HG2  VAL  29          2HG22     VAL  29   4.652   0.039  -3.852
  225   3HG2  VAL  29          1HG21     VAL  29   3.648   1.404  -4.384
  226    H    ASP  30           HN       ASP  30   0.692   1.301  -2.343
  227    HA   ASP  30           HA       ASP  30  -0.333   3.511  -4.016
  228   1HB   ASP  30          2HB       ASP  30  -1.626   2.801  -2.083
  229   2HB   ASP  30          1HB       ASP  30  -0.272   3.102  -0.997
  230    H    PHE  31           HN       PHE  31   1.443   4.428  -4.932
  231    HA   PHE  31           HA       PHE  31   3.760   5.272  -3.304
  232   1HB   PHE  31          1HB       PHE  31   2.945   5.727  -6.184
  233   2HB   PHE  31          2HB       PHE  31   4.365   6.434  -5.430
  234    HD1  PHE  31           HD2      PHE  31   6.263   5.003  -4.672
  235    HD2  PHE  31           HD1      PHE  31   2.940   3.384  -6.895
  236    HE1  PHE  31           HE2      PHE  31   7.707   3.172  -5.497
  237    HE2  PHE  31           HE1      PHE  31   4.436   1.644  -7.839
  238    HZ   PHE  31           HZ       PHE  31   6.814   1.526  -7.148
  239    H    THR  32           HN       THR  32   3.361   7.030  -1.964
  240    HA   THR  32           HA       THR  32   1.766   9.313  -3.018
  241    HB   THR  32           HB       THR  32   1.103   7.574  -0.614
  242    HG1  THR  32           HG1      THR  32  -0.200   7.240  -2.358
  243   1HG2  THR  32          2HG22     THR  32   0.332  10.493  -0.962
  244   2HG2  THR  32          1HG21     THR  32  -0.478   9.351   0.130
  245   3HG2  THR  32          3HG23     THR  32   1.212   9.776   0.421
  246    H    ALA  33           HN       ALA  33   2.241  11.308  -2.010
  247    HA   ALA  33           HA       ALA  33   4.911  11.409  -0.737
  248   1HB   ALA  33          3HB       ALA  33   3.005  13.600  -1.678
  249   2HB   ALA  33          1HB       ALA  33   4.613  13.861  -0.972
  250   3HB   ALA  33          2HB       ALA  33   4.461  13.022  -2.528
  251    H    THR  34           HN       THR  34   5.120  11.882   1.471
  252    HA   THR  34           HA       THR  34   2.797  11.418   3.171
  253    HB   THR  34           HB       THR  34   4.679  12.328   4.884
  254    HG1  THR  34           HG1      THR  34   6.273  11.253   2.798
  255   1HG2  THR  34          1HG21     THR  34   4.621   9.639   3.467
  256   2HG2  THR  34          3HG23     THR  34   5.588   9.978   4.927
  257   3HG2  THR  34          2HG22     THR  34   3.816  10.092   4.981
  258    H    TRP  35           HN       TRP  35   4.876  14.218   2.410
  259    HA   TRP  35           HA       TRP  35   3.151  16.066   3.901
  260   1HB   TRP  35          1HB       TRP  35   4.655  17.769   3.120
  261   2HB   TRP  35          2HB       TRP  35   5.555  16.422   3.802
  262    HD1  TRP  35           HD1      TRP  35   7.042  14.926   2.048
  263    HE1  TRP  35           HE1      TRP  35   7.969  15.442  -0.265
  264    HE3  TRP  35           HE3      TRP  35   4.057  18.893   0.791
  265    HZ2  TRP  35           HZ2      TRP  35   7.646  17.426  -2.318
  266    HZ3  TRP  35           HZ3      TRP  35   4.424  20.112  -1.341
  267    HH2  TRP  35           HH2      TRP  35   6.213  19.380  -2.905
  268    H    CYS  36           HN       CYS  36   1.068  16.022   2.987
  269    HA   CYS  36           HA       CYS  36   0.577  17.690   0.752
  270   1HB   CYS  36          2HB       CYS  36   1.164  16.254  -0.910
  271   2HB   CYS  36          1HB       CYS  36   1.037  14.836   0.115
  272    H    GLY  37           HN       GLY  37  -1.527  18.337   0.867
  273   1HA   GLY  37          1HA       GLY  37  -3.190  17.536   3.054
  274   2HA   GLY  37          2HA       GLY  37  -3.669  18.544   1.673
  275    HA   PRO  38           HA       PRO  38  -6.213  14.369   2.602
  276   1HB   PRO  38          1HB       PRO  38  -6.165  15.261  -0.296
  277   2HB   PRO  38          2HB       PRO  38  -7.459  14.340   0.543
  278   1HG   PRO  38          2HG       PRO  38  -7.284  17.151   0.515
  279   2HG   PRO  38          1HG       PRO  38  -8.116  16.230   1.797
  280   1HD   PRO  38          1HD       PRO  38  -5.841  17.856   2.191
  281   2HD   PRO  38          2HD       PRO  38  -6.461  16.643   3.328
  282    H    CYS  39           HN       CYS  39  -3.214  14.360   0.641
  283    HA   CYS  39           HA       CYS  39  -3.067  11.614   0.063
  284   1HB   CYS  39          1HB       CYS  39  -0.900  13.452   1.169
  285   2HB   CYS  39          2HB       CYS  39  -0.628  11.817   0.630
  286    H    LYS  40           HN       LYS  40  -2.351  13.368   3.016
  287    HA   LYS  40           HA       LYS  40  -1.598  11.326   4.738
  288   1HB   LYS  40          1HB       LYS  40  -1.682  14.004   4.909
  289   2HB   LYS  40          2HB       LYS  40  -3.246  13.704   5.658
  290   1HG   LYS  40          1HG       LYS  40  -1.732  13.849   7.446
  291   2HG   LYS  40          2HG       LYS  40  -1.953  12.101   7.260
  292   1HD   LYS  40          1HD       LYS  40   0.175  12.066   5.849
  293   2HD   LYS  40          2HD       LYS  40   0.377  13.786   6.174
  294   1HE   LYS  40          2HE       LYS  40   0.327  11.547   8.259
  295   2HE   LYS  40          1HE       LYS  40   1.768  12.376   7.654
  296   1HZ   LYS  40          2HZ       LYS  40   0.897  14.418   8.549
  297   2HZ   LYS  40          3HZ       LYS  40  -0.420  13.631   9.153
  298   3HZ   LYS  40          1HZ       LYS  40   1.082  13.279   9.725
  299    H    MET  41           HN       MET  41  -4.827  12.040   3.575
  300    HA   MET  41           HA       MET  41  -6.176  10.428   5.672
  301   1HB   MET  41          2HB       MET  41  -7.288  12.011   3.317
  302   2HB   MET  41          1HB       MET  41  -8.226  11.191   4.566
  303   1HG   MET  41          2HG       MET  41  -7.316  12.666   6.285
  304   2HG   MET  41          1HG       MET  41  -6.263  13.461   5.107
  305   1HE   MET  41          2HE       MET  41  -7.082  15.780   5.976
  306   2HE   MET  41          1HE       MET  41  -8.795  16.263   6.033
  307   3HE   MET  41          3HE       MET  41  -8.196  14.987   7.120
  308    H    ILE  42           HN       ILE  42  -5.538  10.588   2.204
  309    HA   ILE  42           HA       ILE  42  -6.944   8.316   1.318
  310    HB   ILE  42           HB       ILE  42  -4.511   9.778   0.260
  311   1HG1  ILE  42          1HG11     ILE  42  -7.368   9.696  -0.803
  312   2HG1  ILE  42          2HG12     ILE  42  -6.922  10.815   0.474
  313   1HG2  ILE  42          3HG23     ILE  42  -6.083   7.481  -0.974
  314   2HG2  ILE  42          1HG21     ILE  42  -5.089   8.589  -1.934
  315   3HG2  ILE  42          2HG22     ILE  42  -4.333   7.584  -0.697
  316   1HD1  ILE  42          1HD11     ILE  42  -5.135  11.777  -0.979
  317   2HD1  ILE  42          2HD12     ILE  42  -5.733  10.760  -2.303
  318   3HD1  ILE  42          3HD13     ILE  42  -6.784  11.993  -1.582
  319    H    ALA  43           HN       ALA  43  -3.554   8.563   2.531
  320    HA   ALA  43           HA       ALA  43  -2.903   5.828   2.139
  321   1HB   ALA  43          2HB       ALA  43  -1.920   7.920   4.101
  322   2HB   ALA  43          3HB       ALA  43  -1.336   6.234   4.148
  323   3HB   ALA  43          1HB       ALA  43  -1.135   7.224   2.692
  324    HA   PRO  44           HA       PRO  44  -4.838   4.849   6.579
  325   1HB   PRO  44          2HB       PRO  44  -6.826   7.126   6.520
  326   2HB   PRO  44          1HB       PRO  44  -6.155   6.272   7.934
  327   1HG   PRO  44          1HG       PRO  44  -5.249   8.705   7.037
  328   2HG   PRO  44          2HG       PRO  44  -4.165   7.518   7.824
  329   1HD   PRO  44          2HD       PRO  44  -4.215   8.317   4.976
  330   2HD   PRO  44          1HD       PRO  44  -2.984   7.452   5.928
  331    H    LEU  45           HN       LEU  45  -6.927   6.514   4.193
  332    HA   LEU  45           HA       LEU  45  -9.125   4.711   4.327
  333   1HB   LEU  45          2HB       LEU  45  -8.003   6.428   2.082
  334   2HB   LEU  45          1HB       LEU  45  -9.412   5.433   1.839
  335    HG   LEU  45           HG       LEU  45  -9.102   7.636   3.960
  336   1HD1  LEU  45          2HD12     LEU  45  -9.174   8.526   1.638
  337   2HD1  LEU  45          3HD13     LEU  45 -10.678   7.631   1.343
  338   3HD1  LEU  45          1HD11     LEU  45 -10.637   8.947   2.535
  339   1HD2  LEU  45          3HD23     LEU  45 -11.536   5.975   3.146
  340   2HD2  LEU  45          2HD22     LEU  45 -10.781   6.046   4.755
  341   3HD2  LEU  45          1HD21     LEU  45 -11.621   7.455   4.122
  342    H    PHE  46           HN       PHE  46  -6.389   4.678   2.037
  343    HA   PHE  46           HA       PHE  46  -7.055   2.208   0.755
  344   1HB   PHE  46          2HB       PHE  46  -5.549   3.699  -0.286
  345   2HB   PHE  46          1HB       PHE  46  -4.578   3.855   1.156
  346    HD1  PHE  46           HD2      PHE  46  -5.678   1.251  -1.374
  347    HD2  PHE  46           HD1      PHE  46  -2.528   2.694   1.181
  348    HE1  PHE  46           HE2      PHE  46  -4.088  -0.321  -2.432
  349    HE2  PHE  46           HE1      PHE  46  -0.987   0.962   0.252
  350    HZ   PHE  46           HZ       PHE  46  -1.713  -0.429  -1.660
  351    H    GLU  47           HN       GLU  47  -5.171   2.931   3.730
  352    HA   GLU  47           HA       GLU  47  -4.366   0.234   4.209
  353   1HB   GLU  47          2HB       GLU  47  -3.379   2.276   5.256
  354   2HB   GLU  47          1HB       GLU  47  -4.833   2.450   6.251
  355   1HG   GLU  47          1HG       GLU  47  -4.415   0.357   7.384
  356   2HG   GLU  47          2HG       GLU  47  -3.140  -0.087   6.242
  357    H    THR  48           HN       THR  48  -7.334   2.059   5.077
  358    HA   THR  48           HA       THR  48  -8.460   0.039   6.771
  359    HB   THR  48           HB       THR  48  -9.958   2.018   4.989
  360    HG1  THR  48           HG1      THR  48  -8.359   2.990   6.403
  361   1HG2  THR  48          1HG21     THR  48 -10.704   0.650   7.609
  362   2HG2  THR  48          3HG23     THR  48 -11.668   1.874   6.759
  363   3HG2  THR  48          2HG22     THR  48 -11.402   0.287   6.013
  364    H    LEU  49           HN       LEU  49  -8.680   0.678   3.230
  365    HA   LEU  49           HA       LEU  49 -10.273  -1.612   2.642
  366   1HB   LEU  49          2HB       LEU  49  -9.764   0.356   1.129
  367   2HB   LEU  49          1HB       LEU  49  -8.171  -0.329   0.850
  368    HG   LEU  49           HG       LEU  49  -9.404  -2.399  -0.047
  369   1HD1  LEU  49          1HD11     LEU  49 -11.766  -0.494   0.330
  370   2HD1  LEU  49          3HD13     LEU  49 -11.816  -1.848  -0.799
  371   3HD1  LEU  49          2HD12     LEU  49 -11.613  -2.160   0.927
  372   1HD2  LEU  49          3HD23     LEU  49  -8.421  -0.689  -1.533
  373   2HD2  LEU  49          1HD21     LEU  49  -9.928  -1.324  -2.203
  374   3HD2  LEU  49          2HD22     LEU  49  -9.904   0.275  -1.423
  375    H    SER  50           HN       SER  50  -6.697  -1.198   2.889
  376    HA   SER  50           HA       SER  50  -6.032  -3.830   2.106
  377   1HB   SER  50          1HB       SER  50  -3.940  -3.431   2.862
  378   2HB   SER  50          2HB       SER  50  -4.493  -1.771   2.614
  379    HG   SER  50           HG       SER  50  -4.975  -1.924   4.991
  380    H    ASN  51           HN       ASN  51  -6.996  -2.568   5.313
  381    HA   ASN  51           HA       ASN  51  -6.706  -5.040   6.709
  382   1HB   ASN  51          2HB       ASN  51  -7.045  -2.667   7.643
  383   2HB   ASN  51          1HB       ASN  51  -8.771  -2.898   7.350
  384   1HD2  ASN  51          2HD22     ASN  51  -8.509  -5.782   9.882
  385   2HD2  ASN  51          1HD21     ASN  51  -8.734  -5.875   8.148
  386    H    ASP  52           HN       ASP  52  -9.420  -3.580   4.856
  387    HA   ASP  52           HA       ASP  52 -11.416  -5.479   5.457
  388   1HB   ASP  52          1HB       ASP  52 -11.822  -3.357   4.210
  389   2HB   ASP  52          2HB       ASP  52 -10.979  -4.023   2.804
  390    H    TYR  53           HN       TYR  53  -8.996  -5.523   2.787
  391    HA   TYR  53           HA       TYR  53  -9.949  -8.114   1.824
  392   1HB   TYR  53          1HB       TYR  53  -7.653  -6.264   1.133
  393   2HB   TYR  53          2HB       TYR  53  -7.764  -7.898   0.487
  394    HD1  TYR  53           HD1      TYR  53  -9.736  -4.683   0.653
  395    HD2  TYR  53           HD2      TYR  53  -9.079  -8.423  -1.379
  396    HE1  TYR  53           HE1      TYR  53 -10.982  -3.850  -1.298
  397    HE2  TYR  53           HE2      TYR  53 -10.356  -7.595  -3.315
  398    HH   TYR  53           HH       TYR  53 -11.491  -5.796  -4.233
  399    H    ALA  54           HN       ALA  54  -7.050  -7.019   3.578
  400    HA   ALA  54           HA       ALA  54  -5.161  -8.298   4.199
  401   1HB   ALA  54          2HB       ALA  54  -6.424  -7.364   6.061
  402   2HB   ALA  54          1HB       ALA  54  -7.457  -8.809   6.129
  403   3HB   ALA  54          3HB       ALA  54  -5.726  -8.924   6.524
  404    H    GLY  55           HN       GLY  55  -5.092  -9.952   2.381
  405   1HA   GLY  55          1HA       GLY  55  -4.525 -12.477   3.465
  406   2HA   GLY  55          2HA       GLY  55  -6.180 -12.571   2.833
  407    H    LYS  56           HN       LYS  56  -6.520 -12.583   0.616
  408    HA   LYS  56           HA       LYS  56  -4.315 -13.443  -1.044
  409   1HB   LYS  56          1HB       LYS  56  -6.504 -14.496  -1.063
  410   2HB   LYS  56          2HB       LYS  56  -7.291 -12.980  -1.500
  411   1HG   LYS  56          2HG       LYS  56  -7.168 -14.649  -3.302
  412   2HG   LYS  56          1HG       LYS  56  -6.498 -13.097  -3.753
  413   1HD   LYS  56          1HD       LYS  56  -4.174 -14.057  -3.255
  414   2HD   LYS  56          2HD       LYS  56  -4.956 -15.634  -3.047
  415   1HE   LYS  56          1HE       LYS  56  -4.956 -13.855  -5.547
  416   2HE   LYS  56          2HE       LYS  56  -4.045 -15.357  -5.341
  417   1HZ   LYS  56          2HZ       LYS  56  -6.973 -15.151  -5.335
  418   2HZ   LYS  56          1HZ       LYS  56  -6.070 -15.602  -6.622
  419   3HZ   LYS  56          3HZ       LYS  56  -6.093 -16.545  -5.262
  420    H    VAL  57           HN       VAL  57  -3.599 -10.880  -0.274
  421    HA   VAL  57           HA       VAL  57  -3.494  -9.451  -2.799
  422    HB   VAL  57           HB       VAL  57  -4.405  -7.351  -1.916
  423   1HG1  VAL  57          3HG23     VAL  57  -6.108  -8.877  -3.001
  424   2HG1  VAL  57          2HG22     VAL  57  -6.584  -9.400  -1.374
  425   3HG1  VAL  57          1HG21     VAL  57  -6.754  -7.709  -1.859
  426   1HG2  VAL  57          3HG13     VAL  57  -3.912  -7.663   0.506
  427   2HG2  VAL  57          2HG12     VAL  57  -5.593  -7.235   0.252
  428   3HG2  VAL  57          1HG11     VAL  57  -5.168  -8.918   0.587
  429    H    ILE  58           HN       ILE  58  -1.968  -7.647  -2.697
  430    HA   ILE  58           HA       ILE  58  -0.363  -7.483  -0.165
  431    HB   ILE  58           HB       ILE  58   0.563  -7.732  -3.027
  432   1HG1  ILE  58          1HG11     ILE  58   2.215  -8.883  -0.894
  433   2HG1  ILE  58          2HG12     ILE  58   0.609  -9.596  -0.959
  434   1HG2  ILE  58          2HG22     ILE  58   1.982  -6.317  -0.732
  435   2HG2  ILE  58          3HG23     ILE  58   2.844  -6.967  -2.136
  436   3HG2  ILE  58          1HG21     ILE  58   1.631  -5.695  -2.352
  437   1HD1  ILE  58          1HD11     ILE  58   0.881  -9.980  -3.404
  438   2HD1  ILE  58          3HD13     ILE  58   2.535  -9.326  -3.302
  439   3HD1  ILE  58          2HD12     ILE  58   2.106 -10.826  -2.466
  440    H    PHE  59           HN       PHE  59  -0.539  -5.443   0.603
  441    HA   PHE  59           HA       PHE  59  -1.340  -3.226  -1.231
  442   1HB   PHE  59          2HB       PHE  59  -2.402  -4.004   1.463
  443   2HB   PHE  59          1HB       PHE  59  -2.287  -2.305   1.048
  444    HD1  PHE  59           HD1      PHE  59  -3.660  -5.416  -0.629
  445    HD2  PHE  59           HD2      PHE  59  -4.216  -1.264   0.392
  446    HE1  PHE  59           HE1      PHE  59  -6.063  -5.548  -1.281
  447    HE2  PHE  59           HE2      PHE  59  -6.567  -1.411  -0.251
  448    HZ   PHE  59           HZ       PHE  59  -7.559  -3.609  -0.879
  449    H    LEU  60           HN       LEU  60   0.670  -2.581  -1.527
  450    HA   LEU  60           HA       LEU  60   2.548  -2.190   0.713
  451   1HB   LEU  60          1HB       LEU  60   2.564  -2.313  -2.261
  452   2HB   LEU  60          2HB       LEU  60   3.720  -1.169  -1.569
  453    HG   LEU  60           HG       LEU  60   3.579  -3.907  -0.344
  454   1HD1  LEU  60          2HD12     LEU  60   4.909  -3.267  -2.998
  455   2HD1  LEU  60          1HD11     LEU  60   5.149  -4.747  -2.030
  456   3HD1  LEU  60          3HD13     LEU  60   3.554  -4.389  -2.726
  457   1HD2  LEU  60          3HD23     LEU  60   5.816  -1.917  -1.067
  458   2HD2  LEU  60          2HD22     LEU  60   5.083  -2.090   0.543
  459   3HD2  LEU  60          1HD21     LEU  60   6.041  -3.414  -0.162
  460    H    LYS  61           HN       LYS  61   2.762  -0.351   1.786
  461    HA   LYS  61           HA       LYS  61   1.658   2.195   0.613
  462   1HB   LYS  61          1HB       LYS  61   2.595   1.501   3.422
  463   2HB   LYS  61          2HB       LYS  61   2.201   3.123   2.850
  464   1HG   LYS  61          2HG       LYS  61   0.255   2.512   3.835
  465   2HG   LYS  61          1HG       LYS  61  -0.095   2.190   2.145
  466   1HD   LYS  61          2HD       LYS  61   0.379  -0.250   2.519
  467   2HD   LYS  61          1HD       LYS  61   0.754   0.090   4.213
  468   1HE   LYS  61          1HE       LYS  61  -1.559   0.803   4.598
  469   2HE   LYS  61          2HE       LYS  61  -1.940   0.611   2.874
  470   1HZ   LYS  61          3HZ       LYS  61  -1.376  -1.721   3.103
  471   2HZ   LYS  61          2HZ       LYS  61  -1.167  -1.535   4.724
  472   3HZ   LYS  61          1HZ       LYS  61  -2.650  -1.302   4.068
  473    H    VAL  62           HN       VAL  62   3.075   3.617  -0.289
  474    HA   VAL  62           HA       VAL  62   5.970   3.365   0.439
  475    HB   VAL  62           HB       VAL  62   4.915   3.297  -2.418
  476   1HG1  VAL  62          3HG13     VAL  62   7.729   3.487  -1.258
  477   2HG1  VAL  62          2HG12     VAL  62   7.372   3.137  -2.957
  478   3HG1  VAL  62          1HG11     VAL  62   6.952   4.714  -2.282
  479   1HG2  VAL  62          3HG23     VAL  62   6.547   1.320  -0.752
  480   2HG2  VAL  62          2HG22     VAL  62   4.875   1.084  -1.290
  481   3HG2  VAL  62          1HG21     VAL  62   6.182   1.167  -2.479
  482    H    ASP  63           HN       ASP  63   5.948   5.171   1.594
  483    HA   ASP  63           HA       ASP  63   5.201   7.739   0.783
  484   1HB   ASP  63          1HB       ASP  63   5.868   7.312   3.058
  485   2HB   ASP  63          2HB       ASP  63   7.497   6.837   2.546
  486    H    VAL  64           HN       VAL  64   5.729   8.419  -1.237
  487    HA   VAL  64           HA       VAL  64   7.978   7.823  -2.823
  488    HB   VAL  64           HB       VAL  64   6.120  10.240  -2.714
  489   1HG1  VAL  64          1HG11     VAL  64   8.178   9.540  -4.849
  490   2HG1  VAL  64          3HG13     VAL  64   6.848  10.695  -5.068
  491   3HG1  VAL  64          2HG12     VAL  64   8.109  11.026  -3.876
  492   1HG2  VAL  64          2HG22     VAL  64   5.159   7.961  -3.274
  493   2HG2  VAL  64          1HG21     VAL  64   4.986   9.156  -4.568
  494   3HG2  VAL  64          3HG23     VAL  64   6.243   7.902  -4.668
  495    H    ASP  65           HN       ASP  65   7.556  10.279  -0.279
  496    HA   ASP  65           HA       ASP  65   9.903  11.817  -0.840
  497   1HB   ASP  65          2HB       ASP  65   8.454  11.433   1.789
  498   2HB   ASP  65          1HB       ASP  65   9.616  12.697   1.381
  499    H    ALA  66           HN       ALA  66   9.426   8.692   0.753
  500    HA   ALA  66           HA       ALA  66  12.194   8.701   1.848
  501   1HB   ALA  66          1HB       ALA  66   9.902   6.707   2.137
  502   2HB   ALA  66          2HB       ALA  66  11.509   6.569   2.874
  503   3HB   ALA  66          3HB       ALA  66  10.434   7.900   3.339
  504    H    VAL  67           HN       VAL  67  10.085   6.474  -0.093
  505    HA   VAL  67           HA       VAL  67  12.556   5.233  -1.174
  506    HB   VAL  67           HB       VAL  67   9.735   4.389  -1.835
  507   1HG1  VAL  67          2HG22     VAL  67  11.864   3.473  -2.961
  508   2HG1  VAL  67          3HG23     VAL  67  12.283   2.773  -1.402
  509   3HG1  VAL  67          1HG21     VAL  67  10.792   2.258  -2.218
  510   1HG2  VAL  67          2HG12     VAL  67  11.346   3.670   0.660
  511   2HG2  VAL  67          1HG11     VAL  67   9.722   4.397   0.613
  512   3HG2  VAL  67          3HG13     VAL  67   9.964   2.732   0.065
  513    H    ALA  68           HN       ALA  68  12.675   7.658  -2.009
  514    HA   ALA  68           HA       ALA  68  11.266   8.533  -4.270
  515   1HB   ALA  68          1HB       ALA  68  12.792   9.943  -2.958
  516   2HB   ALA  68          3HB       ALA  68  14.190   9.009  -3.535
  517   3HB   ALA  68          2HB       ALA  68  13.232   9.976  -4.677
  518    H    ALA  69           HN       ALA  69  14.286   6.616  -4.176
  519    HA   ALA  69           HA       ALA  69  14.865   6.457  -6.890
  520   1HB   ALA  69          1HB       ALA  69  16.345   5.632  -5.116
  521   2HB   ALA  69          2HB       ALA  69  15.222   4.301  -4.759
  522   3HB   ALA  69          3HB       ALA  69  16.056   4.367  -6.326
  523    H    VAL  70           HN       VAL  70  12.807   4.172  -5.010
  524    HA   VAL  70           HA       VAL  70  12.178   2.521  -7.284
  525    HB   VAL  70           HB       VAL  70  10.634   2.907  -4.688
  526   1HG1  VAL  70          3HG23     VAL  70   9.292   1.793  -6.477
  527   2HG1  VAL  70          1HG21     VAL  70  10.573   0.580  -6.645
  528   3HG1  VAL  70          2HG22     VAL  70   9.674   0.737  -5.118
  529   1HG2  VAL  70          1HG11     VAL  70  13.017   2.124  -4.342
  530   2HG2  VAL  70          2HG12     VAL  70  11.836   0.852  -3.971
  531   3HG2  VAL  70          3HG13     VAL  70  12.726   0.827  -5.510
  532    H    ALA  71           HN       ALA  71  10.483   5.233  -5.639
  533    HA   ALA  71           HA       ALA  71   8.159   5.243  -7.243
  534   1HB   ALA  71          3HB       ALA  71   8.438   6.612  -5.214
  535   2HB   ALA  71          2HB       ALA  71   9.612   7.647  -6.048
  536   3HB   ALA  71          1HB       ALA  71   7.929   7.604  -6.597
  537    H    GLU  72           HN       GLU  72  11.150   7.232  -7.841
  538    HA   GLU  72           HA       GLU  72  10.136   8.231 -10.325
  539   1HB   GLU  72          1HB       GLU  72  12.346   9.070 -10.744
  540   2HB   GLU  72          2HB       GLU  72  11.915   9.331  -9.052
  541   1HG   GLU  72          2HG       GLU  72  13.281   7.267  -8.493
  542   2HG   GLU  72          1HG       GLU  72  13.852   7.253 -10.166
  543    H    ALA  73           HN       ALA  73  12.186   5.338  -9.607
  544    HA   ALA  73           HA       ALA  73  12.641   4.652 -12.338
  545   1HB   ALA  73          2HB       ALA  73  13.908   3.695 -10.451
  546   2HB   ALA  73          3HB       ALA  73  12.447   2.864  -9.872
  547   3HB   ALA  73          1HB       ALA  73  13.166   2.418 -11.434
  548    H    ALA  74           HN       ALA  74  10.002   3.790 -10.090
  549    HA   ALA  74           HA       ALA  74   8.697   1.897 -11.779
  550   1HB   ALA  74          3HB       ALA  74   7.651   3.581  -9.460
  551   2HB   ALA  74          2HB       ALA  74   6.826   2.184 -10.175
  552   3HB   ALA  74          1HB       ALA  74   8.376   1.962  -9.354
  553    H    GLY  75           HN       GLY  75   8.170   5.371 -11.208
  554   1HA   GLY  75          1HA       GLY  75   7.571   6.810 -13.094
  555   2HA   GLY  75          2HA       GLY  75   6.571   5.513 -13.760
  556    H    ILE  76           HN       ILE  76   6.878   7.867 -11.178
  557    HA   ILE  76           HA       ILE  76   3.974   7.711 -10.485
  558    HB   ILE  76           HB       ILE  76   6.483   8.356  -8.896
  559   1HG1  ILE  76          2HG12     ILE  76   5.676   6.838  -7.293
  560   2HG1  ILE  76          1HG11     ILE  76   4.037   6.827  -7.965
  561   1HG2  ILE  76          2HG22     ILE  76   3.636   9.216  -8.208
  562   2HG2  ILE  76          1HG21     ILE  76   4.988   9.183  -7.061
  563   3HG2  ILE  76          3HG23     ILE  76   5.046  10.277  -8.438
  564   1HD1  ILE  76          1HD11     ILE  76   6.383   5.654  -9.470
  565   2HD1  ILE  76          3HD13     ILE  76   5.432   4.735  -8.322
  566   3HD1  ILE  76          2HD12     ILE  76   4.641   5.412  -9.741
  567    H    THR  77           HN       THR  77   2.817   9.629 -10.774
  568    HA   THR  77           HA       THR  77   4.335  12.076 -11.583
  569    HB   THR  77           HB       THR  77   2.617  12.439 -13.333
  570    HG1  THR  77           HG1      THR  77   1.447  10.431 -13.918
  571   1HG2  THR  77          3HG23     THR  77   4.813  11.340 -13.876
  572   2HG2  THR  77          1HG21     THR  77   4.033   9.755 -13.695
  573   3HG2  THR  77          2HG22     THR  77   3.498  10.866 -14.967
  574    H    ALA  78           HN       ALA  78   0.872  11.728 -11.671
  575    HA   ALA  78           HA       ALA  78   0.581  13.915  -9.711
  576   1HB   ALA  78          3HB       ALA  78  -1.468  12.342 -11.326
  577   2HB   ALA  78          2HB       ALA  78  -1.814  13.749 -10.299
  578   3HB   ALA  78          1HB       ALA  78  -0.781  13.926 -11.731
  579    H    MET  79           HN       MET  79   1.678  12.511  -8.093
  580    HA   MET  79           HA       MET  79   0.628  10.248  -6.923
  581   1HB   MET  79          1HB       MET  79   1.849  10.760  -4.950
  582   2HB   MET  79          2HB       MET  79   2.800  11.180  -6.367
  583   1HG   MET  79          1HG       MET  79   1.290  13.152  -4.582
  584   2HG   MET  79          2HG       MET  79   3.001  12.788  -4.493
  585   1HE   MET  79          3HE       MET  79   4.236  12.817  -7.245
  586   2HE   MET  79          2HE       MET  79   4.570  14.541  -7.505
  587   3HE   MET  79          1HE       MET  79   4.856  13.816  -5.906
  588    HA   PRO  80           HA       PRO  80  -0.240   9.271  -4.497
  589   1HB   PRO  80          2HB       PRO  80  -3.207   8.764  -4.864
  590   2HB   PRO  80          1HB       PRO  80  -2.143   8.065  -3.626
  591   1HG   PRO  80          1HG       PRO  80  -3.680  10.165  -2.967
  592   2HG   PRO  80          2HG       PRO  80  -1.946  10.253  -2.545
  593   1HD   PRO  80          1HD       PRO  80  -3.342  11.457  -4.967
  594   2HD   PRO  80          2HD       PRO  80  -2.210  12.240  -3.834
  595    H    THR  81           HN       THR  81   0.021   7.203  -5.540
  596    HA   THR  81           HA       THR  81  -1.191   6.857  -8.229
  597    HB   THR  81           HB       THR  81   1.765   7.143  -7.643
  598    HG1  THR  81           HG1      THR  81  -0.094   8.798  -8.499
  599   1HG2  THR  81          2HG22     THR  81   0.335   6.066 -10.114
  600   2HG2  THR  81          3HG23     THR  81   2.019   6.617 -10.115
  601   3HG2  THR  81          1HG21     THR  81   1.556   5.237  -9.111
  602    H    PHE  82           HN       PHE  82  -2.169   5.036  -8.015
  603    HA   PHE  82           HA       PHE  82  -1.172   2.871  -6.261
  604   1HB   PHE  82          1HB       PHE  82  -3.806   3.370  -7.667
  605   2HB   PHE  82          2HB       PHE  82  -3.451   1.967  -6.679
  606    HD1  PHE  82           HD2      PHE  82  -3.151   2.185  -4.228
  607    HD2  PHE  82           HD1      PHE  82  -4.227   5.587  -6.671
  608    HE1  PHE  82           HE2      PHE  82  -3.705   3.503  -2.197
  609    HE2  PHE  82           HE1      PHE  82  -4.759   6.875  -4.633
  610    HZ   PHE  82           HZ       PHE  82  -4.320   5.850  -2.372
  611    H    HIS  83           HN       HIS  83   0.496   1.935  -7.531
  612    HA   HIS  83           HA       HIS  83  -0.130   1.056 -10.326
  613   1HB   HIS  83          2HB       HIS  83   2.236   0.659  -8.531
  614   2HB   HIS  83          1HB       HIS  83   2.049  -0.171 -10.080
  615    HD2  HIS  83           HD2      HIS  83   1.041   3.434 -10.547
  616    HE1  HIS  83           HE1      HIS  83   5.125   3.145 -11.578
  617    HE2  HIS  83           HE2      HIS  83   3.114   4.656 -11.692
  618    H    VAL  84           HN       VAL  84  -0.550  -1.141 -10.814
  619    HA   VAL  84           HA       VAL  84  -0.944  -2.975  -8.469
  620    HB   VAL  84           HB       VAL  84  -2.490  -3.077 -11.073
  621   1HG1  VAL  84          3HG23     VAL  84  -2.786  -4.446  -8.359
  622   2HG1  VAL  84          1HG21     VAL  84  -3.923  -4.591  -9.709
  623   3HG1  VAL  84          2HG22     VAL  84  -2.274  -5.211  -9.875
  624   1HG2  VAL  84          2HG12     VAL  84  -3.323  -1.917  -8.372
  625   2HG2  VAL  84          1HG11     VAL  84  -3.157  -1.006  -9.887
  626   3HG2  VAL  84          3HG13     VAL  84  -4.419  -2.235  -9.732
  627    H    TYR  85           HN       TYR  85   0.822  -4.261  -8.479
  628    HA   TYR  85           HA       TYR  85   2.107  -4.979 -11.058
  629   1HB   TYR  85          1HB       TYR  85   3.100  -5.079  -8.208
  630   2HB   TYR  85          2HB       TYR  85   3.918  -5.908  -9.522
  631    HD1  TYR  85           HD1      TYR  85   2.917  -2.605  -8.214
  632    HD2  TYR  85           HD2      TYR  85   5.316  -4.733 -11.081
  633    HE1  TYR  85           HE1      TYR  85   4.157  -0.514  -8.747
  634    HE2  TYR  85           HE2      TYR  85   6.468  -2.616 -11.688
  635    HH   TYR  85           HH       TYR  85   5.247   0.511 -10.542
  636    H    LYS  86           HN       LYS  86  -0.282  -6.137 -11.002
  637    HA   LYS  86           HA       LYS  86  -0.723  -8.315  -9.311
  638   1HB   LYS  86          2HB       LYS  86  -2.419  -7.361 -10.913
  639   2HB   LYS  86          1HB       LYS  86  -1.576  -8.208 -12.227
  640   1HG   LYS  86          1HG       LYS  86  -1.964 -10.368 -11.030
  641   2HG   LYS  86          2HG       LYS  86  -2.840  -9.511  -9.759
  642   1HD   LYS  86          1HD       LYS  86  -4.606  -8.903 -11.291
  643   2HD   LYS  86          2HD       LYS  86  -3.647  -9.397 -12.692
  644   1HE   LYS  86          1HE       LYS  86  -5.387 -11.059 -12.178
  645   2HE   LYS  86          2HE       LYS  86  -3.766 -11.760 -12.023
  646   1HZ   LYS  86          1HZ       LYS  86  -5.346 -10.752  -9.763
  647   2HZ   LYS  86          2HZ       LYS  86  -5.341 -12.322 -10.232
  648   3HZ   LYS  86          3HZ       LYS  86  -3.945 -11.621  -9.693
  649    H    ASP  87           HN       ASP  87   0.076 -10.277  -9.133
  650    HA   ASP  87           HA       ASP  87   1.174 -12.237  -9.456
  651   1HB   ASP  87          1HB       ASP  87   1.826 -11.455 -12.338
  652   2HB   ASP  87          2HB       ASP  87   1.894 -13.044 -11.596
  653    H    GLY  88           HN       GLY  88   2.810  -9.740 -11.326
  654   1HA   GLY  88          1HA       GLY  88   4.756  -8.926  -9.546
  655   2HA   GLY  88          2HA       GLY  88   5.477 -10.355 -10.322
  656    H    VAL  89           HN       VAL  89   3.271  -7.924 -11.854
  657    HA   VAL  89           HA       VAL  89   5.450  -6.577 -13.221
  658    HB   VAL  89           HB       VAL  89   5.273  -8.607 -14.589
  659   1HG1  VAL  89          2HG12     VAL  89   2.942  -9.288 -14.070
  660   2HG1  VAL  89          3HG13     VAL  89   2.332  -7.922 -15.027
  661   3HG1  VAL  89          1HG11     VAL  89   3.250  -9.217 -15.809
  662   1HG2  VAL  89          2HG22     VAL  89   5.720  -6.431 -15.695
  663   2HG2  VAL  89          1HG21     VAL  89   4.906  -7.594 -16.754
  664   3HG2  VAL  89          3HG23     VAL  89   3.983  -6.261 -16.041
  665    H    LYS  90           HN       LYS  90   4.688  -4.542 -13.979
  666    HA   LYS  90           HA       LYS  90   2.429  -3.479 -12.635
  667   1HB   LYS  90          2HB       LYS  90   4.437  -2.212 -13.327
  668   2HB   LYS  90          1HB       LYS  90   3.907  -2.290 -15.012
  669   1HG   LYS  90          1HG       LYS  90   1.945  -0.953 -14.531
  670   2HG   LYS  90          2HG       LYS  90   2.119  -1.201 -12.791
  671   1HD   LYS  90          2HD       LYS  90   2.778   1.039 -13.283
  672   2HD   LYS  90          1HD       LYS  90   4.202   0.127 -12.768
  673   1HE   LYS  90          2HE       LYS  90   4.937  -0.095 -15.122
  674   2HE   LYS  90          1HE       LYS  90   3.471   0.750 -15.661
  675   1HZ   LYS  90          3HZ       LYS  90   4.208   2.668 -14.442
  676   2HZ   LYS  90          1HZ       LYS  90   5.588   1.906 -13.969
  677   3HZ   LYS  90          2HZ       LYS  90   5.325   2.215 -15.561
  678    H    ALA  91           HN       ALA  91   0.628  -4.668 -13.073
  679    HA   ALA  91           HA       ALA  91  -0.359  -5.146 -15.777
  680   1HB   ALA  91          3HB       ALA  91  -0.628  -6.785 -13.934
  681   2HB   ALA  91          1HB       ALA  91  -1.618  -5.609 -13.035
  682   3HB   ALA  91          2HB       ALA  91  -2.197  -6.260 -14.583
  683    H    ASP  92           HN       ASP  92  -0.895  -2.836 -13.145
  684    HA   ASP  92           HA       ASP  92  -2.563  -1.227 -14.965
  685   1HB   ASP  92          1HB       ASP  92  -3.864  -2.989 -13.323
  686   2HB   ASP  92          2HB       ASP  92  -3.779  -1.593 -12.246
  687    H    ASP  93           HN       ASP  93  -3.305   0.813 -13.775
  688    HA   ASP  93           HA       ASP  93  -1.487   1.886 -11.760
  689   1HB   ASP  93          1HB       ASP  93  -0.098   2.268 -13.682
  690   2HB   ASP  93          2HB       ASP  93  -1.483   2.852 -14.639
  691    H    LEU  94           HN       LEU  94  -2.161   4.115 -11.368
  692    HA   LEU  94           HA       LEU  94  -4.678   5.189 -12.141
  693   1HB   LEU  94          2HB       LEU  94  -5.718   3.318 -11.024
  694   2HB   LEU  94          1HB       LEU  94  -4.682   3.497  -9.616
  695    HG   LEU  94           HG       LEU  94  -5.811   5.681  -9.088
  696   1HD1  LEU  94          3HD13     LEU  94  -7.320   4.963 -11.633
  697   2HD1  LEU  94          2HD12     LEU  94  -7.960   6.105 -10.447
  698   3HD1  LEU  94          1HD11     LEU  94  -6.449   6.468 -11.281
  699   1HD2  LEU  94          2HD22     LEU  94  -7.648   3.300  -9.487
  700   2HD2  LEU  94          1HD21     LEU  94  -6.599   3.617  -8.092
  701   3HD2  LEU  94          3HD23     LEU  94  -7.960   4.695  -8.433
  702    H    VAL  95           HN       VAL  95  -3.930   7.252 -11.984
  703    HA   VAL  95           HA       VAL  95  -2.255   8.093  -9.723
  704    HB   VAL  95           HB       VAL  95  -2.006  10.155 -10.966
  705   1HG1  VAL  95          2HG12     VAL  95  -0.500   8.264 -11.433
  706   2HG1  VAL  95          3HG13     VAL  95  -1.574   7.714 -12.738
  707   3HG1  VAL  95          1HG11     VAL  95  -0.749   9.278 -12.865
  708   1HG2  VAL  95          1HG21     VAL  95  -4.241  10.295 -12.054
  709   2HG2  VAL  95          2HG22     VAL  95  -2.912  10.473 -13.208
  710   3HG2  VAL  95          3HG23     VAL  95  -3.799   8.943 -13.120
  711    H    GLY  96           HN       GLY  96  -2.762  10.196  -8.645
  712   1HA   GLY  96          1HA       GLY  96  -4.136  11.645  -7.528
  713   2HA   GLY  96          2HA       GLY  96  -5.485  11.201  -8.600
  714    H    ALA  97           HN       ALA  97  -6.408  11.504  -6.245
  715    HA   ALA  97           HA       ALA  97  -6.108   9.445  -4.291
  716   1HB   ALA  97          3HB       ALA  97  -7.169  11.683  -3.902
  717   2HB   ALA  97          1HB       ALA  97  -8.549  11.207  -4.888
  718   3HB   ALA  97          2HB       ALA  97  -8.208  10.339  -3.379
  719    H    SER  98           HN       SER  98  -8.737  10.006  -6.584
  720    HA   SER  98           HA       SER  98 -10.360   8.639  -7.482
  721   1HB   SER  98          2HB       SER  98  -7.838   7.040  -8.061
  722   2HB   SER  98          1HB       SER  98  -9.280   7.236  -9.094
  723    HG   SER  98           HG       SER  98  -7.155   8.665  -9.297
  724    H    GLN  99           HN       GLN  99 -10.333   8.031  -4.771
  725    HA   GLN  99           HA       GLN  99  -9.839   5.499  -3.858
  726   1HB   GLN  99          1HB       GLN  99 -12.376   7.072  -3.216
  727   2HB   GLN  99          2HB       GLN  99 -11.596   5.850  -2.207
  728   1HG   GLN  99          2HG       GLN  99 -10.541   8.631  -2.876
  729   2HG   GLN  99          1HG       GLN  99 -11.110   8.042  -1.322
  730   1HE2  GLN  99          2HE22     GLN  99  -8.108   6.082  -0.699
  731   2HE2  GLN  99          1HE21     GLN  99  -9.848   5.958  -0.513
  732    H    ASP 100           HN       ASP 100 -12.706   6.450  -5.757
  733    HA   ASP 100           HA       ASP 100 -14.172   4.003  -5.457
  734   1HB   ASP 100          2HB       ASP 100 -15.477   4.830  -7.339
  735   2HB   ASP 100          1HB       ASP 100 -15.205   6.129  -6.173
  736    H    LYS 101           HN       LYS 101 -11.994   5.239  -8.044
  737    HA   LYS 101           HA       LYS 101 -12.148   2.782  -9.538
  738   1HB   LYS 101          1HB       LYS 101 -11.611   4.986 -10.526
  739   2HB   LYS 101          2HB       LYS 101 -10.030   4.960  -9.722
  740   1HG   LYS 101          1HG       LYS 101  -9.337   3.028 -10.999
  741   2HG   LYS 101          2HG       LYS 101 -10.989   2.707 -11.544
  742   1HD   LYS 101          1HD       LYS 101 -11.012   4.613 -12.992
  743   2HD   LYS 101          2HD       LYS 101  -9.536   5.271 -12.288
  744   1HE   LYS 101          1HE       LYS 101  -9.082   4.227 -14.482
  745   2HE   LYS 101          2HE       LYS 101  -8.208   3.389 -13.191
  746   1HZ   LYS 101          3HZ       LYS 101 -10.734   2.494 -14.385
  747   2HZ   LYS 101          1HZ       LYS 101  -9.240   1.878 -14.703
  748   3HZ   LYS 101          2HZ       LYS 101  -9.892   1.712 -13.202
  749    H    LEU 102           HN       LEU 102 -10.043   3.961  -6.927
  750    HA   LEU 102           HA       LEU 102  -8.010   2.006  -7.013
  751   1HB   LEU 102          2HB       LEU 102  -8.336   4.072  -5.406
  752   2HB   LEU 102          1HB       LEU 102  -9.271   2.957  -4.416
  753    HG   LEU 102           HG       LEU 102  -6.336   2.927  -5.117
  754   1HD1  LEU 102          3HD13     LEU 102  -7.117   4.437  -3.326
  755   2HD1  LEU 102          1HD11     LEU 102  -7.947   3.088  -2.519
  756   3HD1  LEU 102          2HD12     LEU 102  -6.187   3.105  -2.627
  757   1HD2  LEU 102          3HD23     LEU 102  -7.879   0.751  -3.649
  758   2HD2  LEU 102          2HD22     LEU 102  -6.981   0.577  -5.184
  759   3HD2  LEU 102          1HD21     LEU 102  -6.110   0.916  -3.693
  760    H    LYS 103           HN       LYS 103 -11.114   1.968  -5.148
  761    HA   LYS 103           HA       LYS 103 -11.015  -0.707  -4.275
  762   1HB   LYS 103          2HB       LYS 103 -13.355   1.125  -4.961
  763   2HB   LYS 103          1HB       LYS 103 -13.527  -0.447  -4.175
  764   1HG   LYS 103          2HG       LYS 103 -12.194   0.261  -2.277
  765   2HG   LYS 103          1HG       LYS 103 -11.818   1.807  -3.057
  766   1HD   LYS 103          1HD       LYS 103 -14.258   2.378  -3.058
  767   2HD   LYS 103          2HD       LYS 103 -14.603   0.834  -2.260
  768   1HE   LYS 103          1HE       LYS 103 -14.578   2.612  -0.597
  769   2HE   LYS 103          2HE       LYS 103 -13.200   1.536  -0.314
  770   1HZ   LYS 103          3HZ       LYS 103 -13.102   4.113  -1.726
  771   2HZ   LYS 103          2HZ       LYS 103 -12.608   3.847  -0.175
  772   3HZ   LYS 103          1HZ       LYS 103 -11.812   3.132  -1.427
  773    H    ALA 104           HN       ALA 104 -12.552   0.641  -7.249
  774    HA   ALA 104           HA       ALA 104 -13.530  -1.771  -8.292
  775   1HB   ALA 104          1HB       ALA 104 -13.977   0.510  -9.223
  776   2HB   ALA 104          2HB       ALA 104 -12.332   0.523  -9.902
  777   3HB   ALA 104          3HB       ALA 104 -13.511  -0.675 -10.460
  778    H    LEU 105           HN       LEU 105 -10.228  -0.349  -8.726
  779    HA   LEU 105           HA       LEU 105  -9.313  -2.486 -10.415
  780   1HB   LEU 105          2HB       LEU 105  -7.835  -0.447  -8.699
  781   2HB   LEU 105          1HB       LEU 105  -7.021  -1.669  -9.671
  782    HG   LEU 105           HG       LEU 105  -8.789   0.575 -10.724
  783   1HD1  LEU 105          3HD13     LEU 105  -6.477   1.171 -10.017
  784   2HD1  LEU 105          2HD12     LEU 105  -5.833  -0.080 -11.100
  785   3HD1  LEU 105          1HD11     LEU 105  -6.699   1.313 -11.775
  786   1HD2  LEU 105          3HD23     LEU 105  -7.552  -1.785 -12.177
  787   2HD2  LEU 105          2HD22     LEU 105  -9.245  -1.239 -12.217
  788   3HD2  LEU 105          1HD21     LEU 105  -7.994  -0.273 -12.995
  789    H    VAL 106           HN       VAL 106  -9.040  -1.997  -6.811
  790    HA   VAL 106           HA       VAL 106  -7.520  -4.388  -6.492
  791    HB   VAL 106           HB       VAL 106  -9.568  -3.442  -4.446
  792   1HG1  VAL 106          2HG22     VAL 106  -8.450  -5.713  -4.161
  793   2HG1  VAL 106          1HG21     VAL 106  -6.886  -4.886  -4.165
  794   3HG1  VAL 106          3HG23     VAL 106  -8.068  -4.562  -2.885
  795   1HG2  VAL 106          2HG12     VAL 106  -6.816  -2.348  -5.102
  796   2HG2  VAL 106          1HG11     VAL 106  -8.310  -1.488  -4.676
  797   3HG2  VAL 106          3HG13     VAL 106  -7.417  -2.341  -3.430
  798    H    ALA 107           HN       ALA 107 -11.059  -3.898  -6.465
  799    HA   ALA 107           HA       ALA 107 -11.848  -6.594  -6.070
  800   1HB   ALA 107          1HB       ALA 107 -13.410  -4.684  -6.019
  801   2HB   ALA 107          2HB       ALA 107 -13.211  -4.451  -7.767
  802   3HB   ALA 107          3HB       ALA 107 -13.959  -5.936  -7.150
  803    H    LYS 108           HN       LYS 108 -11.333  -4.887  -9.195
  804    HA   LYS 108           HA       LYS 108 -11.764  -7.016 -10.952
  805   1HB   LYS 108          1HB       LYS 108 -11.440  -4.654 -11.557
  806   2HB   LYS 108          2HB       LYS 108  -9.743  -4.723 -11.115
  807   1HG   LYS 108          2HG       LYS 108  -9.374  -6.475 -12.892
  808   2HG   LYS 108          1HG       LYS 108 -11.052  -6.233 -13.408
  809   1HD   LYS 108          2HD       LYS 108  -8.825  -4.132 -13.333
  810   2HD   LYS 108          1HD       LYS 108  -9.400  -4.984 -14.772
  811   1HE   LYS 108          1HE       LYS 108 -11.668  -3.963 -14.442
  812   2HE   LYS 108          2HE       LYS 108 -11.027  -3.033 -13.073
  813   1HZ   LYS 108          2HZ       LYS 108  -9.462  -2.028 -14.560
  814   2HZ   LYS 108          1HZ       LYS 108 -10.071  -2.872 -15.837
  815   3HZ   LYS 108          3HZ       LYS 108 -11.009  -1.762 -15.062
  816    H    HIS 109           HN       HIS 109  -8.586  -5.875  -9.777
  817    HA   HIS 109           HA       HIS 109  -7.173  -8.113 -10.891
  818   1HB   HIS 109          2HB       HIS 109  -6.405  -5.915  -8.936
  819   2HB   HIS 109          1HB       HIS 109  -5.285  -7.144  -9.524
  820    HD2  HIS 109           HD2      HIS 109  -7.232  -4.052 -10.998
  821    HE1  HIS 109           HE1      HIS 109  -4.553  -5.503 -13.911
  822    HE2  HIS 109           HE2      HIS 109  -6.150  -3.606 -13.339
  823    H    ALA 110           HN       ALA 110  -8.886  -7.806  -7.826
  824    HA   ALA 110           HA       ALA 110  -7.553 -10.229  -6.762
  825   1HB   ALA 110          2HB       ALA 110  -8.147  -8.299  -5.275
  826   2HB   ALA 110          3HB       ALA 110  -9.862  -8.594  -5.651
  827   3HB   ALA 110          1HB       ALA 110  -8.908  -9.826  -4.800
  828    H    ALA 111           HN       ALA 111  -9.747  -9.878  -9.227
  829    HA   ALA 111           HA       ALA 111 -11.965 -11.394  -8.488
  830   1HB   ALA 111          2HB       ALA 111 -10.495 -11.282 -11.158
  831   2HB   ALA 111          3HB       ALA 111 -12.128 -11.944 -10.921
  832   3HB   ALA 111          1HB       ALA 111 -11.824 -10.224 -10.622
  833    H    ALA 112           HN       ALA 112  -8.752 -12.558  -9.523
  834    HA   ALA 112           HA       ALA 112  -9.138 -15.097  -8.219
  835   1HB   ALA 112          2HB       ALA 112  -8.861 -14.989 -11.264
  836   2HB   ALA 112          3HB       ALA 112  -8.710 -16.447 -10.260
  837   3HB   ALA 112          1HB       ALA 112 -10.271 -15.607 -10.370
   
  No H/Q in entry =         837
  Start of MODEL   18
    1   1H    GLY   1          2HN       GLY   1  -1.973 -10.551   3.241
    2   2H    GLY   1          1HN       GLY   1  -1.155 -10.028   1.942
    3   3H    GLY   1          3HN       GLY   1  -1.855 -11.501   1.894
    4   1HA   GLY   1          1HA       GLY   1  -0.432 -12.503   3.414
    5   2HA   GLY   1          2HA       GLY   1   0.641 -11.513   2.406
    6    H    GLY   2           HN       GLY   2   2.082 -11.600   4.438
    7   1HA   GLY   2          1HA       GLY   2   1.259 -10.369   6.892
    8   2HA   GLY   2          2HA       GLY   2   2.923 -10.555   6.302
    9    H    SER   3           HN       SER   3   2.548  -9.116   3.851
   10    HA   SER   3           HA       SER   3   3.096  -6.481   4.483
   11   1HB   SER   3          1HB       SER   3   2.049  -7.654   1.900
   12   2HB   SER   3          2HB       SER   3   3.191  -6.299   2.075
   13    HG   SER   3           HG       SER   3   4.301  -8.343   1.666
   14    H    VAL   4           HN       VAL   4   1.055  -6.250   5.943
   15    HA   VAL   4           HA       VAL   4  -0.772  -4.412   4.521
   16    HB   VAL   4           HB       VAL   4  -2.478  -5.302   6.199
   17   1HG1  VAL   4          3HG13     VAL   4  -2.604  -5.893   3.764
   18   2HG1  VAL   4          1HG11     VAL   4  -1.626  -7.337   4.095
   19   3HG1  VAL   4          2HG12     VAL   4  -3.226  -7.160   4.820
   20   1HG2  VAL   4          2HG22     VAL   4  -0.851  -6.499   7.644
   21   2HG2  VAL   4          3HG23     VAL   4  -2.282  -7.436   7.169
   22   3HG2  VAL   4          1HG21     VAL   4  -0.729  -7.741   6.375
   23    H    ILE   5           HN       ILE   5   1.727  -3.999   5.830
   24    HA   ILE   5           HA       ILE   5   0.998  -2.767   8.455
   25    HB   ILE   5           HB       ILE   5   3.408  -3.182   9.045
   26   1HG1  ILE   5          1HG11     ILE   5   3.363  -5.020   6.601
   27   2HG1  ILE   5          2HG12     ILE   5   4.243  -3.496   6.690
   28   1HG2  ILE   5          1HG21     ILE   5   1.479  -4.613   9.786
   29   2HG2  ILE   5          3HG23     ILE   5   1.779  -5.688   8.406
   30   3HG2  ILE   5          2HG22     ILE   5   2.999  -5.503   9.682
   31   1HD1  ILE   5          3HD13     ILE   5   5.517  -4.444   8.671
   32   2HD1  ILE   5          2HD12     ILE   5   4.751  -6.011   8.321
   33   3HD1  ILE   5          1HD11     ILE   5   5.801  -5.254   7.116
   34    H    VAL   6           HN       VAL   6   1.862  -0.849   9.018
   35    HA   VAL   6           HA       VAL   6   2.381   0.976   6.788
   36    HB   VAL   6           HB       VAL   6   0.696   1.524   8.388
   37   1HG1  VAL   6          2HG12     VAL   6   1.482   0.452  10.455
   38   2HG1  VAL   6          1HG11     VAL   6   2.792   1.641  10.597
   39   3HG1  VAL   6          3HG13     VAL   6   1.105   2.156  10.698
   40   1HG2  VAL   6          2HG22     VAL   6   1.988   3.346   7.297
   41   2HG2  VAL   6          3HG23     VAL   6   1.255   3.801   8.843
   42   3HG2  VAL   6          1HG21     VAL   6   2.991   3.479   8.755
   43    H    ILE   7           HN       ILE   7   4.426  -0.186   6.308
   44    HA   ILE   7           HA       ILE   7   6.536   1.563   7.342
   45    HB   ILE   7           HB       ILE   7   6.769  -0.201   8.926
   46   1HG1  ILE   7          1HG11     ILE   7   8.896  -0.490   6.762
   47   2HG1  ILE   7          2HG12     ILE   7   8.782   0.872   7.866
   48   1HG2  ILE   7          1HG21     ILE   7   5.590  -2.005   7.749
   49   2HG2  ILE   7          3HG23     ILE   7   6.930  -2.175   6.599
   50   3HG2  ILE   7          2HG22     ILE   7   7.161  -2.553   8.315
   51   1HD1  ILE   7          1HD11     ILE   7   9.045  -0.688   9.800
   52   2HD1  ILE   7          2HD12     ILE   7   9.301  -2.026   8.656
   53   3HD1  ILE   7          3HD13     ILE   7  10.436  -0.669   8.696
   54    H    ASP   8           HN       ASP   8   7.581   2.336   5.743
   55    HA   ASP   8           HA       ASP   8   7.280   1.286   3.012
   56   1HB   ASP   8          1HB       ASP   8   7.916   3.562   2.432
   57   2HB   ASP   8          2HB       ASP   8   6.582   3.600   3.614
   58    H    SER   9           HN       SER   9   9.733   1.779   5.475
   59    HA   SER   9           HA       SER   9  12.033   2.303   4.289
   60   1HB   SER   9          1HB       SER   9  11.700  -0.062   6.177
   61   2HB   SER   9          2HB       SER   9  13.065   1.074   6.095
   62    HG   SER   9           HG       SER   9  11.511   2.729   6.713
   63    H    LYS  10           HN       LYS  10  13.370   1.441   2.665
   64    HA   LYS  10           HA       LYS  10  12.496  -0.452   0.916
   65   1HB   LYS  10          1HB       LYS  10  14.281   1.087   0.470
   66   2HB   LYS  10          2HB       LYS  10  15.399   0.205   1.544
   67   1HG   LYS  10          2HG       LYS  10  15.234  -1.787   0.063
   68   2HG   LYS  10          1HG       LYS  10  14.036  -0.955  -0.942
   69   1HD   LYS  10          1HD       LYS  10  15.727   0.758  -1.548
   70   2HD   LYS  10          2HD       LYS  10  16.921  -0.054  -0.510
   71   1HE   LYS  10          2HE       LYS  10  16.716  -2.118  -1.889
   72   2HE   LYS  10          1HE       LYS  10  15.529  -1.308  -2.927
   73   1HZ   LYS  10          1HZ       LYS  10  18.319  -0.477  -2.549
   74   2HZ   LYS  10          3HZ       LYS  10  17.709  -1.257  -3.865
   75   3HZ   LYS  10          2HZ       LYS  10  17.217   0.276  -3.516
   76    H    ALA  11           HN       ALA  11  14.510  -1.154   3.797
   77    HA   ALA  11           HA       ALA  11  14.972  -3.920   3.259
   78   1HB   ALA  11          2HB       ALA  11  16.078  -2.692   5.095
   79   2HB   ALA  11          3HB       ALA  11  14.523  -2.531   5.945
   80   3HB   ALA  11          1HB       ALA  11  15.248  -4.136   5.708
   81    H    ALA  12           HN       ALA  12  12.177  -2.214   4.641
   82    HA   ALA  12           HA       ALA  12  10.706  -4.632   5.342
   83   1HB   ALA  12          1HB       ALA  12  10.482  -2.446   6.562
   84   2HB   ALA  12          2HB       ALA  12   9.686  -1.783   5.109
   85   3HB   ALA  12          3HB       ALA  12   8.957  -3.144   5.979
   86    H    TRP  13           HN       TRP  13  10.906  -2.312   2.597
   87    HA   TRP  13           HA       TRP  13   8.628  -3.258   1.134
   88   1HB   TRP  13          1HB       TRP  13   9.796  -1.253   0.361
   89   2HB   TRP  13          2HB       TRP  13  11.293  -2.134   0.236
   90    HD1  TRP  13           HD1      TRP  13  11.739  -3.817  -1.699
   91    HE1  TRP  13           HE1      TRP  13  10.918  -3.869  -4.127
   92    HE3  TRP  13           HE3      TRP  13   7.740  -0.629  -1.298
   93    HZ2  TRP  13           HZ2      TRP  13   8.900  -2.668  -5.691
   94    HZ3  TRP  13           HZ3      TRP  13   6.480  -0.005  -3.351
   95    HH2  TRP  13           HH2      TRP  13   7.001  -1.050  -5.522
   96    H    ASP  14           HN       ASP  14  12.082  -4.244   1.084
   97    HA   ASP  14           HA       ASP  14  11.845  -6.439  -0.664
   98   1HB   ASP  14          2HB       ASP  14  13.763  -6.096   1.692
   99   2HB   ASP  14          1HB       ASP  14  13.943  -7.255   0.373
  100    H    ALA  15           HN       ALA  15  11.703  -6.416   2.904
  101    HA   ALA  15           HA       ALA  15  11.153  -9.164   3.251
  102   1HB   ALA  15          1HB       ALA  15  11.706  -7.588   5.095
  103   2HB   ALA  15          2HB       ALA  15  10.094  -6.854   4.939
  104   3HB   ALA  15          3HB       ALA  15  10.253  -8.545   5.443
  105    H    GLN  16           HN       GLN  16   8.822  -6.491   2.963
  106    HA   GLN  16           HA       GLN  16   6.424  -8.001   3.109
  107   1HB   GLN  16          2HB       GLN  16   7.104  -5.312   1.875
  108   2HB   GLN  16          1HB       GLN  16   5.474  -5.999   1.865
  109   1HG   GLN  16          1HG       GLN  16   5.384  -6.199   4.229
  110   2HG   GLN  16          2HG       GLN  16   7.054  -5.703   4.446
  111   1HE2  GLN  16          2HE22     GLN  16   6.464  -2.206   4.105
  112   2HE2  GLN  16          1HE21     GLN  16   7.644  -3.510   3.870
  113    H    LEU  17           HN       LEU  17   8.457  -7.152   0.322
  114    HA   LEU  17           HA       LEU  17   6.771  -8.242  -1.664
  115   1HB   LEU  17          1HB       LEU  17   8.737  -6.712  -1.974
  116   2HB   LEU  17          2HB       LEU  17   9.811  -8.081  -1.671
  117    HG   LEU  17           HG       LEU  17   8.997  -9.188  -3.723
  118   1HD1  LEU  17          2HD22     LEU  17   7.238  -6.703  -4.026
  119   2HD1  LEU  17          1HD21     LEU  17   7.572  -7.864  -5.325
  120   3HD1  LEU  17          3HD23     LEU  17   6.688  -8.390  -3.895
  121   1HD2  LEU  17          3HD13     LEU  17  10.910  -7.630  -3.801
  122   2HD2  LEU  17          1HD11     LEU  17   9.991  -7.614  -5.316
  123   3HD2  LEU  17          2HD12     LEU  17   9.804  -6.285  -4.152
  124    H    ALA  18           HN       ALA  18   8.418  -9.941   0.837
  125    HA   ALA  18           HA       ALA  18   8.218 -12.533  -0.641
  126   1HB   ALA  18          2HB       ALA  18  10.444 -12.012   0.274
  127   2HB   ALA  18          3HB       ALA  18   9.754 -11.829   1.898
  128   3HB   ALA  18          1HB       ALA  18   9.698 -13.403   1.085
  129    H    LYS  19           HN       LYS  19   7.649 -11.135   2.676
  130    HA   LYS  19           HA       LYS  19   5.933 -13.334   3.421
  131   1HB   LYS  19          2HB       LYS  19   5.395 -12.077   5.404
  132   2HB   LYS  19          1HB       LYS  19   7.134 -12.009   5.066
  133   1HG   LYS  19          1HG       LYS  19   6.969  -9.753   4.285
  134   2HG   LYS  19          2HG       LYS  19   5.203  -9.778   4.300
  135   1HD   LYS  19          1HD       LYS  19   6.049  -8.483   6.142
  136   2HD   LYS  19          2HD       LYS  19   5.195  -9.892   6.764
  137   1HE   LYS  19          1HE       LYS  19   8.224  -9.916   6.413
  138   2HE   LYS  19          2HE       LYS  19   7.468  -9.172   7.832
  139   1HZ   LYS  19          1HZ       LYS  19   6.419 -11.223   8.341
  140   2HZ   LYS  19          2HZ       LYS  19   7.091 -11.965   7.037
  141   3HZ   LYS  19          3HZ       LYS  19   8.051 -11.419   8.255
  142    H    GLY  20           HN       GLY  20   5.290 -10.687   1.337
  143   1HA   GLY  20          1HA       GLY  20   2.502 -10.393   1.688
  144   2HA   GLY  20          2HA       GLY  20   3.440 -10.156   0.206
  145    H    LYS  21           HN       LYS  21   4.467 -12.992   0.252
  146    HA   LYS  21           HA       LYS  21   3.991 -14.925  -0.807
  147   1HB   LYS  21          2HB       LYS  21   1.311 -14.805   0.658
  148   2HB   LYS  21          1HB       LYS  21   2.068 -16.211  -0.097
  149   1HG   LYS  21          2HG       LYS  21   4.079 -15.810   1.477
  150   2HG   LYS  21          1HG       LYS  21   3.066 -14.620   2.298
  151   1HD   LYS  21          2HD       LYS  21   2.858 -16.600   3.565
  152   2HD   LYS  21          1HD       LYS  21   1.339 -16.465   2.661
  153   1HE   LYS  21          1HE       LYS  21   2.184 -18.141   1.014
  154   2HE   LYS  21          2HE       LYS  21   3.740 -18.196   1.865
  155   1HZ   LYS  21          2HZ       LYS  21   2.590 -19.044   3.773
  156   2HZ   LYS  21          3HZ       LYS  21   1.144 -18.982   2.983
  157   3HZ   LYS  21          1HZ       LYS  21   2.325 -20.004   2.461
  158    H    GLU  22           HN       GLU  22   3.877 -12.919  -2.385
  159    HA   GLU  22           HA       GLU  22   1.411 -12.625  -3.906
  160   1HB   GLU  22          1HB       GLU  22   3.077 -11.360  -5.454
  161   2HB   GLU  22          2HB       GLU  22   2.613 -10.654  -3.921
  162   1HG   GLU  22          1HG       GLU  22   5.144 -12.319  -4.070
  163   2HG   GLU  22          2HG       GLU  22   5.133 -10.672  -4.672
  164    H    GLU  23           HN       GLU  23   1.501 -15.106  -3.904
  165    HA   GLU  23           HA       GLU  23   2.973 -16.603  -5.789
  166   1HB   GLU  23          1HB       GLU  23  -0.002 -16.834  -5.108
  167   2HB   GLU  23          2HB       GLU  23   0.965 -18.073  -5.908
  168   1HG   GLU  23          2HG       GLU  23   2.383 -18.319  -3.918
  169   2HG   GLU  23          1HG       GLU  23   1.512 -17.024  -3.085
  170    H    HIS  24           HN       HIS  24  -0.078 -14.906  -6.212
  171    HA   HIS  24           HA       HIS  24   0.521 -13.867  -8.859
  172   1HB   HIS  24          2HB       HIS  24  -1.448 -14.982  -9.923
  173   2HB   HIS  24          1HB       HIS  24  -0.224 -16.155  -9.442
  174    HD2  HIS  24           HD2      HIS  24  -3.771 -14.912  -8.207
  175    HE1  HIS  24           HE1      HIS  24  -2.930 -18.648  -6.415
  176    HE2  HIS  24           HE2      HIS  24  -4.720 -16.825  -6.713
  177    H    LYS  25           HN       LYS  25  -0.108 -13.000  -6.118
  178    HA   LYS  25           HA       LYS  25  -2.905 -12.085  -6.142
  179   1HB   LYS  25          2HB       LYS  25  -0.675 -11.877  -4.092
  180   2HB   LYS  25          1HB       LYS  25  -2.336 -11.397  -3.783
  181   1HG   LYS  25          2HG       LYS  25  -1.335 -14.225  -4.329
  182   2HG   LYS  25          1HG       LYS  25  -1.877 -13.548  -2.792
  183   1HD   LYS  25          2HD       LYS  25  -4.153 -13.110  -3.900
  184   2HD   LYS  25          1HD       LYS  25  -3.599 -14.076  -5.269
  185   1HE   LYS  25          1HE       LYS  25  -3.842 -15.032  -2.383
  186   2HE   LYS  25          2HE       LYS  25  -4.919 -15.406  -3.743
  187   1HZ   LYS  25          3HZ       LYS  25  -3.059 -16.461  -4.824
  188   2HZ   LYS  25          2HZ       LYS  25  -2.090 -16.177  -3.522
  189   3HZ   LYS  25          1HZ       LYS  25  -3.391 -17.171  -3.376
  190    HA   PRO  26           HA       PRO  26  -1.801  -7.955  -7.236
  191   1HB   PRO  26          1HB       PRO  26  -3.683  -6.425  -5.988
  192   2HB   PRO  26          2HB       PRO  26  -4.032  -7.530  -7.342
  193   1HG   PRO  26          2HG       PRO  26  -4.410  -8.083  -4.391
  194   2HG   PRO  26          1HG       PRO  26  -5.576  -8.333  -5.688
  195   1HD   PRO  26          2HD       PRO  26  -3.996 -10.341  -4.745
  196   2HD   PRO  26          1HD       PRO  26  -4.381 -10.246  -6.479
  197    H    ILE  27           HN       ILE  27   0.015  -6.990  -6.631
  198    HA   ILE  27           HA       ILE  27   0.458  -6.277  -3.802
  199    HB   ILE  27           HB       ILE  27   2.204  -5.794  -6.232
  200   1HG1  ILE  27          1HG11     ILE  27   2.417  -7.973  -4.109
  201   2HG1  ILE  27          2HG12     ILE  27   1.952  -8.222  -5.795
  202   1HG2  ILE  27          2HG22     ILE  27   2.506  -4.218  -4.290
  203   2HG2  ILE  27          1HG21     ILE  27   2.878  -5.626  -3.281
  204   3HG2  ILE  27          3HG23     ILE  27   3.926  -5.185  -4.646
  205   1HD1  ILE  27          1HD11     ILE  27   4.170  -7.309  -6.513
  206   2HD1  ILE  27          3HD13     ILE  27   4.660  -7.267  -4.799
  207   3HD1  ILE  27          2HD12     ILE  27   4.255  -8.802  -5.563
  208    H    VAL  28           HN       VAL  28  -0.956  -4.730  -3.321
  209    HA   VAL  28           HA       VAL  28  -1.594  -2.581  -5.273
  210    HB   VAL  28           HB       VAL  28  -2.793  -3.088  -2.522
  211   1HG1  VAL  28          2HG12     VAL  28  -2.939  -0.763  -3.521
  212   2HG1  VAL  28          3HG13     VAL  28  -3.770  -1.456  -4.919
  213   3HG1  VAL  28          1HG11     VAL  28  -4.521  -1.547  -3.313
  214   1HG2  VAL  28          1HG21     VAL  28  -3.282  -5.008  -4.048
  215   2HG2  VAL  28          3HG23     VAL  28  -4.711  -4.053  -3.662
  216   3HG2  VAL  28          2HG22     VAL  28  -3.928  -3.868  -5.245
  217    H    VAL  29           HN       VAL  29  -0.057  -0.991  -5.169
  218    HA   VAL  29           HA       VAL  29   1.240  -0.510  -2.506
  219    HB   VAL  29           HB       VAL  29   2.848  -1.341  -4.036
  220   1HG1  VAL  29          2HG12     VAL  29   2.059   0.903  -5.896
  221   2HG1  VAL  29          3HG13     VAL  29   3.481  -0.153  -6.078
  222   3HG1  VAL  29          1HG11     VAL  29   1.855  -0.846  -6.188
  223   1HG2  VAL  29          3HG23     VAL  29   3.454   0.445  -2.443
  224   2HG2  VAL  29          1HG21     VAL  29   4.434   0.500  -3.920
  225   3HG2  VAL  29          2HG22     VAL  29   3.138   1.679  -3.679
  226    H    ASP  30           HN       ASP  30   0.967   1.277  -1.560
  227    HA   ASP  30           HA       ASP  30  -0.592   3.506  -2.753
  228   1HB   ASP  30          1HB       ASP  30  -1.551   2.572  -0.767
  229   2HB   ASP  30          2HB       ASP  30   0.003   2.535   0.069
  230    H    PHE  31           HN       PHE  31   0.883   4.829  -3.755
  231    HA   PHE  31           HA       PHE  31   3.365   5.608  -2.292
  232   1HB   PHE  31          1HB       PHE  31   2.459   6.177  -5.130
  233   2HB   PHE  31          2HB       PHE  31   3.949   6.692  -4.390
  234    HD1  PHE  31           HD2      PHE  31   5.624   4.927  -3.572
  235    HD2  PHE  31           HD1      PHE  31   2.338   4.040  -6.221
  236    HE1  PHE  31           HE2      PHE  31   6.845   2.941  -4.431
  237    HE2  PHE  31           HE1      PHE  31   3.639   2.164  -7.187
  238    HZ   PHE  31           HZ       PHE  31   5.844   1.551  -6.232
  239    H    THR  32           HN       THR  32   2.638   6.981  -0.751
  240    HA   THR  32           HA       THR  32   1.402   9.535  -1.535
  241    HB   THR  32           HB       THR  32   0.306   7.700   0.658
  242    HG1  THR  32           HG1      THR  32  -0.701   7.131  -1.134
  243   1HG2  THR  32          3HG23     THR  32  -0.385  10.588  -0.037
  244   2HG2  THR  32          1HG21     THR  32  -1.492   9.507   0.824
  245   3HG2  THR  32          2HG22     THR  32   0.044   9.923   1.569
  246    H    ALA  33           HN       ALA  33   1.642  10.926   0.873
  247    HA   ALA  33           HA       ALA  33   3.878  10.055   2.420
  248   1HB   ALA  33          1HB       ALA  33   4.373  12.216   0.311
  249   2HB   ALA  33          3HB       ALA  33   5.496  11.821   1.627
  250   3HB   ALA  33          2HB       ALA  33   5.178  10.637   0.383
  251    H    THR  34           HN       THR  34   4.824  12.207   3.500
  252    HA   THR  34           HA       THR  34   2.871  13.507   5.095
  253    HB   THR  34           HB       THR  34   4.932  15.040   5.441
  254    HG1  THR  34           HG1      THR  34   6.845  14.176   4.433
  255   1HG2  THR  34          1HG21     THR  34   4.575  13.024   6.860
  256   2HG2  THR  34          2HG22     THR  34   5.462  12.041   5.666
  257   3HG2  THR  34          3HG23     THR  34   6.297  13.334   6.546
  258    H    TRP  35           HN       TRP  35   4.839  14.457   2.420
  259    HA   TRP  35           HA       TRP  35   4.025  17.053   1.955
  260   1HB   TRP  35          2HB       TRP  35   5.680  14.991   0.670
  261   2HB   TRP  35          1HB       TRP  35   4.981  16.068  -0.525
  262    HD1  TRP  35           HD1      TRP  35   7.851  15.946   1.727
  263    HE1  TRP  35           HE1      TRP  35   8.898  18.332   1.979
  264    HE3  TRP  35           HE3      TRP  35   4.023  18.714  -0.181
  265    HZ2  TRP  35           HZ2      TRP  35   8.082  21.062   1.507
  266    HZ3  TRP  35           HZ3      TRP  35   4.074  21.169  -0.118
  267    HH2  TRP  35           HH2      TRP  35   6.132  22.372   0.668
  268    H    CYS  36           HN       CYS  36   1.825  16.825   2.284
  269    HA   CYS  36           HA       CYS  36   0.341  17.741   0.137
  270   1HB   CYS  36          2HB       CYS  36  -1.261  16.013  -0.348
  271   2HB   CYS  36          1HB       CYS  36   0.311  15.330  -0.703
  272    H    GLY  37           HN       GLY  37   0.532  16.309   3.361
  273   1HA   GLY  37          1HA       GLY  37  -0.542  16.921   5.285
  274   2HA   GLY  37          2HA       GLY  37  -1.295  18.258   4.406
  275    HA   PRO  38           HA       PRO  38  -5.126  16.058   5.258
  276   1HB   PRO  38          1HB       PRO  38  -5.807  17.332   2.581
  277   2HB   PRO  38          2HB       PRO  38  -6.887  17.107   3.990
  278   1HG   PRO  38          1HG       PRO  38  -5.651  19.483   3.670
  279   2HG   PRO  38          2HG       PRO  38  -5.626  18.708   5.282
  280   1HD   PRO  38          1HD       PRO  38  -3.440  18.806   3.217
  281   2HD   PRO  38          2HD       PRO  38  -3.333  18.938   4.997
  282    H    CYS  39           HN       CYS  39  -3.788  15.714   1.960
  283    HA   CYS  39           HA       CYS  39  -5.376  13.490   1.205
  284   1HB   CYS  39          1HB       CYS  39  -4.170  13.390  -0.647
  285   2HB   CYS  39          2HB       CYS  39  -3.502  14.930  -0.122
  286    H    LYS  40           HN       LYS  40  -2.629  13.637   3.428
  287    HA   LYS  40           HA       LYS  40  -1.849  10.923   3.344
  288   1HB   LYS  40          2HB       LYS  40  -0.754  12.963   4.509
  289   2HB   LYS  40          1HB       LYS  40  -1.858  12.633   5.858
  290   1HG   LYS  40          1HG       LYS  40  -0.891  10.270   5.921
  291   2HG   LYS  40          2HG       LYS  40   0.210  10.764   4.616
  292   1HD   LYS  40          2HD       LYS  40   1.052  12.614   6.140
  293   2HD   LYS  40          1HD       LYS  40   0.029  11.958   7.421
  294   1HE   LYS  40          2HE       LYS  40   2.292  11.140   7.740
  295   2HE   LYS  40          1HE       LYS  40   1.260   9.779   7.274
  296   1HZ   LYS  40          1HZ       LYS  40   3.044  11.276   5.475
  297   2HZ   LYS  40          2HZ       LYS  40   3.352   9.790   6.111
  298   3HZ   LYS  40          3HZ       LYS  40   2.112   9.987   5.047
  299    H    MET  41           HN       MET  41  -4.784  12.389   4.623
  300    HA   MET  41           HA       MET  41  -5.491  10.364   6.541
  301   1HB   MET  41          1HB       MET  41  -7.220  12.205   4.819
  302   2HB   MET  41          2HB       MET  41  -7.795  11.229   6.184
  303   1HG   MET  41          1HG       MET  41  -6.082  12.337   7.628
  304   2HG   MET  41          2HG       MET  41  -5.761  13.490   6.345
  305   1HE   MET  41          2HE       MET  41  -7.643  15.033   5.287
  306   2HE   MET  41          3HE       MET  41  -8.939  13.810   5.247
  307   3HE   MET  41          1HE       MET  41  -9.208  15.365   6.065
  308    H    ILE  42           HN       ILE  42  -5.232  10.175   3.109
  309    HA   ILE  42           HA       ILE  42  -7.173   8.067   2.704
  310    HB   ILE  42           HB       ILE  42  -4.624   8.842   1.229
  311   1HG1  ILE  42          1HG11     ILE  42  -7.535   9.275   0.403
  312   2HG1  ILE  42          2HG12     ILE  42  -6.665  10.467   1.367
  313   1HG2  ILE  42          2HG22     ILE  42  -6.791   6.817   0.567
  314   2HG2  ILE  42          3HG23     ILE  42  -5.706   7.488  -0.662
  315   3HG2  ILE  42          1HG21     ILE  42  -5.046   6.541   0.678
  316   1HD1  ILE  42          1HD11     ILE  42  -4.866  10.534  -0.387
  317   2HD1  ILE  42          2HD12     ILE  42  -5.936   9.575  -1.430
  318   3HD1  ILE  42          3HD13     ILE  42  -6.443  11.180  -0.858
  319    H    ALA  43           HN       ALA  43  -3.878   8.188   4.050
  320    HA   ALA  43           HA       ALA  43  -3.101   5.539   3.621
  321   1HB   ALA  43          3HB       ALA  43  -1.583   7.290   4.414
  322   2HB   ALA  43          2HB       ALA  43  -2.410   7.362   5.979
  323   3HB   ALA  43          1HB       ALA  43  -1.544   5.890   5.502
  324    HA   PRO  44           HA       PRO  44  -4.995   4.148   7.840
  325   1HB   PRO  44          2HB       PRO  44  -7.184   5.516   8.838
  326   2HB   PRO  44          1HB       PRO  44  -5.495   5.807   9.347
  327   1HG   PRO  44          1HG       PRO  44  -7.060   7.256   7.203
  328   2HG   PRO  44          2HG       PRO  44  -6.161   7.997   8.569
  329   1HD   PRO  44          1HD       PRO  44  -4.893   7.866   6.233
  330   2HD   PRO  44          2HD       PRO  44  -4.040   7.271   7.665
  331    H    LEU  45           HN       LEU  45  -7.040   5.715   5.382
  332    HA   LEU  45           HA       LEU  45  -9.150   3.713   5.499
  333   1HB   LEU  45          2HB       LEU  45  -8.334   5.861   3.524
  334   2HB   LEU  45          1HB       LEU  45  -9.460   4.591   3.036
  335    HG   LEU  45           HG       LEU  45 -10.980   5.115   4.809
  336   1HD1  LEU  45          3HD23     LEU  45  -9.035   7.251   5.715
  337   2HD1  LEU  45          1HD21     LEU  45 -10.715   7.101   6.265
  338   3HD1  LEU  45          2HD22     LEU  45  -9.563   5.821   6.635
  339   1HD2  LEU  45          3HD13     LEU  45 -11.159   6.374   2.688
  340   2HD2  LEU  45          2HD12     LEU  45 -11.691   7.366   4.056
  341   3HD2  LEU  45          1HD11     LEU  45 -10.088   7.635   3.339
  342    H    PHE  46           HN       PHE  46  -6.234   4.138   3.468
  343    HA   PHE  46           HA       PHE  46  -6.487   1.690   2.018
  344   1HB   PHE  46          1HB       PHE  46  -4.943   3.568   1.466
  345   2HB   PHE  46          2HB       PHE  46  -3.949   3.148   2.851
  346    HD1  PHE  46           HD1      PHE  46  -5.323   1.753  -0.376
  347    HD2  PHE  46           HD2      PHE  46  -2.226   1.545   2.608
  348    HE1  PHE  46           HE1      PHE  46  -4.010   0.255  -1.827
  349    HE2  PHE  46           HE2      PHE  46  -0.880   0.074   1.122
  350    HZ   PHE  46           HZ       PHE  46  -1.753  -0.569  -1.090
  351    H    GLU  47           HN       GLU  47  -5.091   2.426   5.230
  352    HA   GLU  47           HA       GLU  47  -4.075  -0.181   5.788
  353   1HB   GLU  47          2HB       GLU  47  -3.620   2.016   7.044
  354   2HB   GLU  47          1HB       GLU  47  -5.168   1.772   7.855
  355   1HG   GLU  47          2HG       GLU  47  -4.419  -0.314   8.831
  356   2HG   GLU  47          1HG       GLU  47  -2.946  -0.314   7.851
  357    H    THR  48           HN       THR  48  -7.264   1.341   6.364
  358    HA   THR  48           HA       THR  48  -8.482  -0.802   7.771
  359    HB   THR  48           HB       THR  48  -9.798   1.178   5.849
  360    HG1  THR  48           HG1      THR  48  -8.549   2.147   7.569
  361   1HG2  THR  48          3HG23     THR  48 -10.927  -0.374   8.206
  362   2HG2  THR  48          1HG21     THR  48 -11.773   0.874   7.270
  363   3HG2  THR  48          2HG22     THR  48 -11.316  -0.652   6.489
  364    H    LEU  49           HN       LEU  49  -8.288  -0.081   4.235
  365    HA   LEU  49           HA       LEU  49  -9.594  -2.485   3.398
  366   1HB   LEU  49          2HB       LEU  49  -7.614  -0.624   2.064
  367   2HB   LEU  49          1HB       LEU  49  -8.269  -2.044   1.237
  368    HG   LEU  49           HG       LEU  49 -10.217  -0.207   2.559
  369   1HD1  LEU  49          2HD22     LEU  49  -8.891   0.344  -0.137
  370   2HD1  LEU  49          1HD21     LEU  49 -10.334   1.175   0.481
  371   3HD1  LEU  49          3HD23     LEU  49  -8.783   1.364   1.315
  372   1HD2  LEU  49          3HD13     LEU  49 -10.927  -2.354   1.486
  373   2HD2  LEU  49          2HD12     LEU  49 -11.671  -0.913   0.773
  374   3HD2  LEU  49          1HD11     LEU  49 -10.331  -1.721  -0.067
  375    H    SER  50           HN       SER  50  -6.137  -1.781   4.068
  376    HA   SER  50           HA       SER  50  -5.021  -4.269   3.333
  377   1HB   SER  50          1HB       SER  50  -4.162  -2.717   5.810
  378   2HB   SER  50          2HB       SER  50  -3.222  -3.791   4.797
  379    HG   SER  50           HG       SER  50  -4.343  -1.464   3.683
  380    H    ASN  51           HN       ASN  51  -6.461  -3.313   6.470
  381    HA   ASN  51           HA       ASN  51  -6.205  -5.891   7.684
  382   1HB   ASN  51          2HB       ASN  51  -6.645  -3.603   8.769
  383   2HB   ASN  51          1HB       ASN  51  -8.341  -3.816   8.329
  384   1HD2  ASN  51          2HD22     ASN  51  -8.191  -6.886  10.677
  385   2HD2  ASN  51          1HD21     ASN  51  -8.264  -6.876   8.928
  386    H    ASP  52           HN       ASP  52  -8.864  -4.350   5.822
  387    HA   ASP  52           HA       ASP  52 -10.863  -6.287   6.226
  388   1HB   ASP  52          1HB       ASP  52 -11.256  -4.078   5.188
  389   2HB   ASP  52          2HB       ASP  52 -10.312  -4.569   3.766
  390    H    TYR  53           HN       TYR  53  -8.426  -6.085   3.584
  391    HA   TYR  53           HA       TYR  53  -9.341  -8.607   2.408
  392   1HB   TYR  53          1HB       TYR  53  -7.118  -6.637   1.891
  393   2HB   TYR  53          2HB       TYR  53  -7.163  -8.187   1.062
  394    HD1  TYR  53           HD2      TYR  53  -8.966  -8.788  -0.500
  395    HD2  TYR  53           HD1      TYR  53  -8.747  -4.840   1.225
  396    HE1  TYR  53           HE2      TYR  53 -10.552  -7.950  -2.200
  397    HE2  TYR  53           HE1      TYR  53 -10.300  -4.014  -0.482
  398    HH   TYR  53           HH       TYR  53 -11.632  -4.535  -2.283
  399    H    ALA  54           HN       ALA  54  -6.442  -7.534   4.238
  400    HA   ALA  54           HA       ALA  54  -4.848  -8.601   5.384
  401   1HB   ALA  54          3HB       ALA  54  -6.752  -9.216   6.761
  402   2HB   ALA  54          2HB       ALA  54  -7.033 -10.683   5.809
  403   3HB   ALA  54          1HB       ALA  54  -5.542 -10.507   6.752
  404    H    GLY  55           HN       GLY  55  -6.379 -11.429   3.872
  405   1HA   GLY  55          1HA       GLY  55  -3.767 -12.751   3.606
  406   2HA   GLY  55          2HA       GLY  55  -5.356 -13.422   3.235
  407    H    LYS  56           HN       LYS  56  -6.436 -12.379   1.258
  408    HA   LYS  56           HA       LYS  56  -4.844 -13.231  -0.926
  409   1HB   LYS  56          2HB       LYS  56  -7.462 -13.216  -0.292
  410   2HB   LYS  56          1HB       LYS  56  -7.462 -11.789  -1.328
  411   1HG   LYS  56          2HG       LYS  56  -6.702 -13.148  -3.224
  412   2HG   LYS  56          1HG       LYS  56  -6.424 -14.533  -2.139
  413   1HD   LYS  56          1HD       LYS  56  -8.831 -14.624  -1.579
  414   2HD   LYS  56          2HD       LYS  56  -9.127 -13.198  -2.590
  415   1HE   LYS  56          2HE       LYS  56  -9.792 -15.292  -3.717
  416   2HE   LYS  56          1HE       LYS  56  -8.537 -14.417  -4.599
  417   1HZ   LYS  56          3HZ       LYS  56  -8.021 -16.715  -2.849
  418   2HZ   LYS  56          2HZ       LYS  56  -8.116 -16.757  -4.499
  419   3HZ   LYS  56          1HZ       LYS  56  -6.927 -15.900  -3.787
  420    H    VAL  57           HN       VAL  57  -3.884 -10.518   0.269
  421    HA   VAL  57           HA       VAL  57  -3.397  -9.179  -2.287
  422    HB   VAL  57           HB       VAL  57  -4.797  -7.689  -0.020
  423   1HG1  VAL  57          1HG11     VAL  57  -3.837  -6.830  -2.778
  424   2HG1  VAL  57          3HG13     VAL  57  -4.954  -5.866  -1.828
  425   3HG1  VAL  57          2HG12     VAL  57  -3.327  -6.167  -1.230
  426   1HG2  VAL  57          3HG23     VAL  57  -5.945  -8.492  -2.717
  427   2HG2  VAL  57          1HG21     VAL  57  -6.513  -9.033  -1.120
  428   3HG2  VAL  57          2HG22     VAL  57  -6.689  -7.349  -1.589
  429    H    ILE  58           HN       ILE  58  -1.666  -7.678  -2.146
  430    HA   ILE  58           HA       ILE  58  -0.115  -7.700   0.438
  431    HB   ILE  58           HB       ILE  58   0.767  -7.763  -2.470
  432   1HG1  ILE  58          2HG12     ILE  58   2.134  -9.713  -1.530
  433   2HG1  ILE  58          1HG11     ILE  58   0.949  -9.730  -0.208
  434   1HG2  ILE  58          2HG22     ILE  58   2.182  -6.206  -0.934
  435   2HG2  ILE  58          1HG21     ILE  58   2.671  -7.707  -0.125
  436   3HG2  ILE  58          3HG23     ILE  58   3.014  -7.483  -1.827
  437   1HD1  ILE  58          2HD12     ILE  58   0.303  -9.943  -3.188
  438   2HD1  ILE  58          3HD13     ILE  58   0.575 -11.334  -2.118
  439   3HD1  ILE  58          1HD11     ILE  58  -0.812 -10.295  -1.848
  440    H    PHE  59           HN       PHE  59  -0.635  -5.750   1.379
  441    HA   PHE  59           HA       PHE  59  -1.207  -3.362  -0.327
  442   1HB   PHE  59          1HB       PHE  59  -1.856  -4.094   2.514
  443   2HB   PHE  59          2HB       PHE  59  -1.779  -2.428   2.014
  444    HD1  PHE  59           HD1      PHE  59  -3.499  -5.648   1.110
  445    HD2  PHE  59           HD2      PHE  59  -3.705  -1.356   1.310
  446    HE1  PHE  59           HE1      PHE  59  -5.873  -5.691   0.360
  447    HE2  PHE  59           HE2      PHE  59  -5.985  -1.397   0.414
  448    HZ   PHE  59           HZ       PHE  59  -7.115  -3.585   0.015
  449    H    LEU  60           HN       LEU  60   0.824  -2.583  -0.867
  450    HA   LEU  60           HA       LEU  60   2.927  -2.345   1.244
  451   1HB   LEU  60          1HB       LEU  60   2.868  -1.789  -1.741
  452   2HB   LEU  60          2HB       LEU  60   4.277  -1.468  -0.702
  453    HG   LEU  60           HG       LEU  60   3.006  -4.130  -1.424
  454   1HD1  LEU  60          1HD21     LEU  60   4.468  -3.048  -3.136
  455   2HD1  LEU  60          3HD23     LEU  60   5.781  -2.972  -1.947
  456   3HD1  LEU  60          2HD22     LEU  60   5.184  -4.545  -2.506
  457   1HD2  LEU  60          2HD12     LEU  60   5.320  -3.578   0.491
  458   2HD2  LEU  60          1HD11     LEU  60   3.769  -4.357   0.887
  459   3HD2  LEU  60          3HD13     LEU  60   4.913  -5.170  -0.191
  460    H    LYS  61           HN       LYS  61   3.043  -0.530   2.449
  461    HA   LYS  61           HA       LYS  61   1.761   2.000   1.490
  462   1HB   LYS  61          1HB       LYS  61   2.649   0.941   4.198
  463   2HB   LYS  61          2HB       LYS  61   2.219   2.641   3.916
  464   1HG   LYS  61          1HG       LYS  61   0.017   2.069   3.175
  465   2HG   LYS  61          2HG       LYS  61   0.358   0.324   3.231
  466   1HD   LYS  61          2HD       LYS  61   0.524   0.275   5.586
  467   2HD   LYS  61          1HD       LYS  61   0.643   2.045   5.717
  468   1HE   LYS  61          1HE       LYS  61  -1.848   0.582   4.755
  469   2HE   LYS  61          2HE       LYS  61  -1.553   1.108   6.419
  470   1HZ   LYS  61          2HZ       LYS  61  -1.592   2.924   4.108
  471   2HZ   LYS  61          3HZ       LYS  61  -2.823   2.736   5.182
  472   3HZ   LYS  61          1HZ       LYS  61  -1.378   3.343   5.683
  473    H    VAL  62           HN       VAL  62   3.161   3.377   0.410
  474    HA   VAL  62           HA       VAL  62   6.020   3.380   1.297
  475    HB   VAL  62           HB       VAL  62   4.946   3.881  -1.488
  476   1HG1  VAL  62          1HG11     VAL  62   7.135   5.058  -0.880
  477   2HG1  VAL  62          3HG13     VAL  62   7.754   3.467  -0.401
  478   3HG1  VAL  62          2HG12     VAL  62   7.381   3.791  -2.089
  479   1HG2  VAL  62          3HG23     VAL  62   6.388   1.447  -0.334
  480   2HG2  VAL  62          2HG22     VAL  62   4.703   1.489  -0.890
  481   3HG2  VAL  62          1HG21     VAL  62   6.016   1.737  -2.049
  482    H    ASP  63           HN       ASP  63   6.597   5.255   2.247
  483    HA   ASP  63           HA       ASP  63   5.072   7.728   1.775
  484   1HB   ASP  63          2HB       ASP  63   5.789   7.271   4.042
  485   2HB   ASP  63          1HB       ASP  63   7.478   7.251   3.530
  486    H    VAL  64           HN       VAL  64   5.474   8.328  -0.282
  487    HA   VAL  64           HA       VAL  64   7.558   7.836  -1.997
  488    HB   VAL  64           HB       VAL  64   5.703  10.247  -1.738
  489   1HG1  VAL  64          3HG23     VAL  64   7.566   9.644  -4.055
  490   2HG1  VAL  64          1HG21     VAL  64   6.200  10.775  -4.102
  491   3HG1  VAL  64          2HG22     VAL  64   7.570  11.103  -3.040
  492   1HG2  VAL  64          2HG12     VAL  64   4.709   8.000  -2.223
  493   2HG2  VAL  64          3HG13     VAL  64   4.509   9.137  -3.565
  494   3HG2  VAL  64          1HG11     VAL  64   5.766   7.880  -3.640
  495    H    ASP  65           HN       ASP  65   7.297  10.873  -0.102
  496    HA   ASP  65           HA       ASP  65   9.767  11.976  -0.817
  497   1HB   ASP  65          2HB       ASP  65   8.063  12.335   1.660
  498   2HB   ASP  65          1HB       ASP  65   9.481  13.321   1.254
  499    H    ALA  66           HN       ALA  66   9.020   9.758   1.944
  500    HA   ALA  66           HA       ALA  66  11.678   9.947   3.048
  501   1HB   ALA  66          2HB       ALA  66   9.717   9.208   4.361
  502   2HB   ALA  66          3HB       ALA  66   9.605   7.747   3.357
  503   3HB   ALA  66          1HB       ALA  66  11.024   8.004   4.383
  504    H    VAL  67           HN       VAL  67  10.136   7.148   1.281
  505    HA   VAL  67           HA       VAL  67  12.920   6.203   0.674
  506    HB   VAL  67           HB       VAL  67  11.877   4.195  -0.192
  507   1HG1  VAL  67          3HG13     VAL  67  12.934   4.280   2.001
  508   2HG1  VAL  67          2HG12     VAL  67  11.415   4.821   2.742
  509   3HG1  VAL  67          1HG11     VAL  67  11.534   3.207   2.010
  510   1HG2  VAL  67          2HG22     VAL  67   9.574   5.016  -0.559
  511   2HG2  VAL  67          3HG23     VAL  67   9.685   3.570   0.479
  512   3HG2  VAL  67          1HG21     VAL  67   9.356   5.161   1.201
  513    H    ALA  68           HN       ALA  68  12.906   8.361  -0.445
  514    HA   ALA  68           HA       ALA  68  11.799   8.895  -2.920
  515   1HB   ALA  68          3HB       ALA  68  13.317  10.410  -1.712
  516   2HB   ALA  68          2HB       ALA  68  14.692   9.333  -2.049
  517   3HB   ALA  68          1HB       ALA  68  13.867  10.168  -3.382
  518    H    ALA  69           HN       ALA  69  14.530   6.712  -2.207
  519    HA   ALA  69           HA       ALA  69  15.330   6.046  -4.824
  520   1HB   ALA  69          1HB       ALA  69  16.583   5.428  -2.805
  521   2HB   ALA  69          3HB       ALA  69  15.287   4.312  -2.316
  522   3HB   ALA  69          2HB       ALA  69  16.228   3.996  -3.790
  523    H    VAL  70           HN       VAL  70  12.752   4.604  -2.772
  524    HA   VAL  70           HA       VAL  70  12.122   2.478  -4.658
  525    HB   VAL  70           HB       VAL  70  10.536   3.595  -2.310
  526   1HG1  VAL  70          1HG21     VAL  70  10.271   0.951  -3.813
  527   2HG1  VAL  70          3HG23     VAL  70   9.374   1.425  -2.356
  528   3HG1  VAL  70          2HG22     VAL  70   9.112   2.294  -3.873
  529   1HG2  VAL  70          1HG11     VAL  70  12.775   2.669  -1.643
  530   2HG2  VAL  70          3HG13     VAL  70  11.434   1.664  -1.074
  531   3HG2  VAL  70          2HG12     VAL  70  12.378   1.167  -2.495
  532    H    ALA  71           HN       ALA  71  10.803   5.662  -3.758
  533    HA   ALA  71           HA       ALA  71   8.587   5.723  -5.514
  534   1HB   ALA  71          3HB       ALA  71   9.017   7.394  -3.738
  535   2HB   ALA  71          1HB       ALA  71  10.377   8.052  -4.666
  536   3HB   ALA  71          2HB       ALA  71   8.740   8.170  -5.314
  537    H    GLU  72           HN       GLU  72  11.913   7.028  -6.205
  538    HA   GLU  72           HA       GLU  72  11.220   7.656  -8.916
  539   1HB   GLU  72          1HB       GLU  72  13.535   8.093  -9.281
  540   2HB   GLU  72          2HB       GLU  72  13.077   8.717  -7.693
  541   1HG   GLU  72          2HG       GLU  72  14.088   6.621  -6.692
  542   2HG   GLU  72          1HG       GLU  72  14.711   6.210  -8.294
  543    H    ALA  73           HN       ALA  73  12.734   4.710  -7.428
  544    HA   ALA  73           HA       ALA  73  13.245   3.342  -9.844
  545   1HB   ALA  73          2HB       ALA  73  12.322   2.207  -7.166
  546   2HB   ALA  73          3HB       ALA  73  13.067   1.289  -8.487
  547   3HB   ALA  73          1HB       ALA  73  14.003   2.538  -7.645
  548    H    ALA  74           HN       ALA  74  10.212   3.582  -7.934
  549    HA   ALA  74           HA       ALA  74   8.695   1.962  -9.848
  550   1HB   ALA  74          2HB       ALA  74   7.869   3.625  -7.434
  551   2HB   ALA  74          1HB       ALA  74   6.812   2.524  -8.350
  552   3HB   ALA  74          3HB       ALA  74   8.208   1.885  -7.458
  553    H    GLY  75           HN       GLY  75   9.940   4.981 -10.304
  554   1HA   GLY  75          1HA       GLY  75   9.463   6.643 -11.771
  555   2HA   GLY  75          2HA       GLY  75   8.236   5.573 -12.478
  556    H    ILE  76           HN       ILE  76   8.322   6.855  -9.134
  557    HA   ILE  76           HA       ILE  76   5.649   8.083  -9.567
  558    HB   ILE  76           HB       ILE  76   7.268   7.662  -7.024
  559   1HG1  ILE  76          1HG11     ILE  76   6.723   5.501  -8.047
  560   2HG1  ILE  76          2HG12     ILE  76   5.843   5.767  -6.555
  561   1HG2  ILE  76          1HG21     ILE  76   4.379   8.516  -7.508
  562   2HG2  ILE  76          2HG22     ILE  76   4.985   7.926  -5.952
  563   3HG2  ILE  76          3HG23     ILE  76   5.649   9.401  -6.633
  564   1HD1  ILE  76          3HD13     ILE  76   4.683   6.080  -9.365
  565   2HD1  ILE  76          2HD12     ILE  76   4.454   4.716  -8.272
  566   3HD1  ILE  76          1HD11     ILE  76   3.792   6.295  -7.833
  567    H    THR  77           HN       THR  77   5.229  10.210  -8.878
  568    HA   THR  77           HA       THR  77   7.375  12.058  -8.241
  569    HB   THR  77           HB       THR  77   5.877  12.468 -10.879
  570    HG1  THR  77           HG1      THR  77   8.250  11.204 -10.273
  571   1HG2  THR  77          1HG21     THR  77   8.179  13.992  -9.567
  572   2HG2  THR  77          2HG22     THR  77   7.491  14.320 -11.170
  573   3HG2  THR  77          3HG23     THR  77   6.507  14.577  -9.717
  574    H    ALA  78           HN       ALA  78   4.037  11.871  -9.596
  575    HA   ALA  78           HA       ALA  78   3.058  13.825  -7.599
  576   1HB   ALA  78          3HB       ALA  78   2.291  13.999  -9.949
  577   2HB   ALA  78          1HB       ALA  78   1.650  12.341  -9.865
  578   3HB   ALA  78          2HB       ALA  78   0.947  13.620  -8.854
  579    H    MET  79           HN       MET  79   1.169  13.201  -6.238
  580    HA   MET  79           HA       MET  79   0.527  10.431  -5.887
  581   1HB   MET  79          1HB       MET  79   1.203  10.420  -3.486
  582   2HB   MET  79          2HB       MET  79   2.563  10.360  -4.596
  583   1HG   MET  79          1HG       MET  79   1.633  12.953  -3.292
  584   2HG   MET  79          2HG       MET  79   2.750  11.827  -2.521
  585   1HE   MET  79          2HE       MET  79   4.489  13.660  -2.100
  586   2HE   MET  79          3HE       MET  79   5.159  14.706  -3.371
  587   3HE   MET  79          1HE       MET  79   3.453  14.874  -2.895
  588    HA   PRO  80           HA       PRO  80  -0.819   9.543  -3.431
  589   1HB   PRO  80          2HB       PRO  80  -3.732   9.450  -4.169
  590   2HB   PRO  80          1HB       PRO  80  -2.912   8.836  -2.705
  591   1HG   PRO  80          1HG       PRO  80  -4.344  11.153  -2.662
  592   2HG   PRO  80          2HG       PRO  80  -2.799  10.988  -1.785
  593   1HD   PRO  80          1HD       PRO  80  -3.333  12.269  -4.495
  594   2HD   PRO  80          2HD       PRO  80  -2.343  12.896  -3.149
  595    H    THR  81           HN       THR  81  -0.044   7.935  -4.741
  596    HA   THR  81           HA       THR  81  -1.398   7.433  -7.363
  597    HB   THR  81           HB       THR  81   1.583   7.529  -6.769
  598    HG1  THR  81           HG1      THR  81   1.429   9.380  -7.752
  599   1HG2  THR  81          1HG21     THR  81   0.076   6.556  -9.237
  600   2HG2  THR  81          3HG23     THR  81   1.807   6.945  -9.205
  601   3HG2  THR  81          2HG22     THR  81   1.187   5.611  -8.215
  602    H    PHE  82           HN       PHE  82  -2.229   5.475  -7.395
  603    HA   PHE  82           HA       PHE  82  -1.188   3.384  -5.553
  604   1HB   PHE  82          2HB       PHE  82  -3.929   3.828  -6.772
  605   2HB   PHE  82          1HB       PHE  82  -3.460   2.400  -5.858
  606    HD1  PHE  82           HD2      PHE  82  -2.953   2.526  -3.435
  607    HD2  PHE  82           HD1      PHE  82  -4.325   5.987  -5.626
  608    HE1  PHE  82           HE2      PHE  82  -3.322   3.755  -1.305
  609    HE2  PHE  82           HE1      PHE  82  -4.631   7.206  -3.494
  610    HZ   PHE  82           HZ       PHE  82  -3.962   6.119  -1.332
  611    H    HIS  83           HN       HIS  83  -0.320   1.567  -6.537
  612    HA   HIS  83           HA       HIS  83  -0.910   1.098  -9.460
  613   1HB   HIS  83          2HB       HIS  83   1.640   0.582  -8.010
  614   2HB   HIS  83          1HB       HIS  83   1.272  -0.005  -9.618
  615    HD2  HIS  83           HD2      HIS  83   0.301   3.640  -9.674
  616    HE1  HIS  83           HE1      HIS  83   4.411   3.476 -10.658
  617    HE2  HIS  83           HE2      HIS  83   2.330   4.958 -10.667
  618    H    VAL  84           HN       VAL  84  -1.156  -1.142  -9.970
  619    HA   VAL  84           HA       VAL  84  -1.393  -3.012  -7.643
  620    HB   VAL  84           HB       VAL  84  -3.010  -3.151 -10.219
  621   1HG1  VAL  84          3HG23     VAL  84  -3.261  -4.436  -7.464
  622   2HG1  VAL  84          1HG21     VAL  84  -4.391  -4.659  -8.810
  623   3HG1  VAL  84          2HG22     VAL  84  -2.728  -5.253  -8.947
  624   1HG2  VAL  84          2HG12     VAL  84  -3.862  -1.913  -7.580
  625   2HG2  VAL  84          3HG13     VAL  84  -3.713  -1.080  -9.150
  626   3HG2  VAL  84          1HG11     VAL  84  -4.934  -2.335  -8.935
  627    H    TYR  85           HN       TYR  85   0.701  -3.960  -7.844
  628    HA   TYR  85           HA       TYR  85   1.478  -4.947 -10.545
  629   1HB   TYR  85          2HB       TYR  85   3.081  -5.002  -7.979
  630   2HB   TYR  85          1HB       TYR  85   3.552  -5.681  -9.508
  631    HD1  TYR  85           HD2      TYR  85   2.524  -2.456  -7.888
  632    HD2  TYR  85           HD1      TYR  85   4.987  -4.388 -10.842
  633    HE1  TYR  85           HE2      TYR  85   3.616  -0.292  -8.431
  634    HE2  TYR  85           HE1      TYR  85   5.931  -2.189 -11.495
  635    HH   TYR  85           HH       TYR  85   4.579   0.852 -10.195
  636    H    LYS  86           HN       LYS  86   0.455  -6.824 -11.115
  637    HA   LYS  86           HA       LYS  86  -0.429  -8.670  -8.950
  638   1HB   LYS  86          2HB       LYS  86  -1.955  -8.368 -10.797
  639   2HB   LYS  86          1HB       LYS  86  -0.713  -8.843 -11.977
  640   1HG   LYS  86          2HG       LYS  86  -0.626 -11.074 -11.195
  641   2HG   LYS  86          1HG       LYS  86  -1.437 -10.700  -9.680
  642   1HD   LYS  86          2HD       LYS  86  -2.766 -10.557 -12.433
  643   2HD   LYS  86          1HD       LYS  86  -2.800 -11.976 -11.376
  644   1HE   LYS  86          1HE       LYS  86  -4.051  -9.262 -10.748
  645   2HE   LYS  86          2HE       LYS  86  -4.873 -10.779 -11.120
  646   1HZ   LYS  86          2HZ       LYS  86  -3.792 -11.706  -9.129
  647   2HZ   LYS  86          3HZ       LYS  86  -3.268 -10.195  -8.748
  648   3HZ   LYS  86          1HZ       LYS  86  -4.884 -10.501  -8.825
  649    H    ASP  87           HN       ASP  87   0.940 -10.205  -8.243
  650    HA   ASP  87           HA       ASP  87   2.611 -11.739  -8.054
  651   1HB   ASP  87          2HB       ASP  87   2.106 -12.665 -10.249
  652   2HB   ASP  87          1HB       ASP  87   2.997 -11.404 -11.083
  653    H    GLY  88           HN       GLY  88   3.678  -9.486 -10.476
  654   1HA   GLY  88          1HA       GLY  88   5.254  -7.772  -8.787
  655   2HA   GLY  88          2HA       GLY  88   6.299  -8.941  -9.622
  656    H    VAL  89           HN       VAL  89   3.342  -7.883 -11.322
  657    HA   VAL  89           HA       VAL  89   4.919  -5.871 -12.855
  658    HB   VAL  89           HB       VAL  89   5.157  -7.893 -14.089
  659   1HG1  VAL  89          2HG12     VAL  89   2.128  -8.235 -14.059
  660   2HG1  VAL  89          3HG13     VAL  89   3.279  -9.173 -15.022
  661   3HG1  VAL  89          1HG11     VAL  89   3.325  -9.281 -13.262
  662   1HG2  VAL  89          2HG22     VAL  89   4.731  -5.783 -15.326
  663   2HG2  VAL  89          1HG21     VAL  89   4.212  -7.225 -16.216
  664   3HG2  VAL  89          3HG23     VAL  89   3.005  -6.199 -15.421
  665    H    LYS  90           HN       LYS  90   3.887  -4.043 -12.920
  666    HA   LYS  90           HA       LYS  90   1.468  -3.323 -11.881
  667   1HB   LYS  90          1HB       LYS  90   3.361  -1.853 -12.694
  668   2HB   LYS  90          2HB       LYS  90   2.653  -1.970 -14.308
  669   1HG   LYS  90          1HG       LYS  90   0.471  -1.088 -13.306
  670   2HG   LYS  90          2HG       LYS  90   1.283  -0.999 -11.750
  671   1HD   LYS  90          1HD       LYS  90   1.303   1.209 -12.630
  672   2HD   LYS  90          2HD       LYS  90   2.956   0.602 -12.718
  673   1HE   LYS  90          1HE       LYS  90   2.330   1.844 -14.753
  674   2HE   LYS  90          2HE       LYS  90   2.661   0.155 -15.152
  675   1HZ   LYS  90          2HZ       LYS  90  -0.017   1.331 -14.771
  676   2HZ   LYS  90          1HZ       LYS  90   0.693   0.987 -16.216
  677   3HZ   LYS  90          3HZ       LYS  90   0.306  -0.234 -15.187
  678    H    ALA  91           HN       ALA  91  -0.286  -4.588 -12.305
  679    HA   ALA  91           HA       ALA  91  -1.168  -5.214 -15.031
  680   1HB   ALA  91          3HB       ALA  91  -1.439  -6.827 -13.173
  681   2HB   ALA  91          1HB       ALA  91  -2.459  -5.661 -12.299
  682   3HB   ALA  91          2HB       ALA  91  -3.012  -6.345 -13.842
  683    H    ASP  92           HN       ASP  92  -1.807  -2.852 -12.475
  684    HA   ASP  92           HA       ASP  92  -3.445  -1.222 -14.241
  685   1HB   ASP  92          1HB       ASP  92  -4.865  -3.137 -13.208
  686   2HB   ASP  92          2HB       ASP  92  -4.756  -2.247 -11.681
  687    H    ASP  93           HN       ASP  93  -4.331   0.742 -12.702
  688    HA   ASP  93           HA       ASP  93  -2.797   1.316 -10.396
  689   1HB   ASP  93          2HB       ASP  93  -1.428   3.186 -11.253
  690   2HB   ASP  93          1HB       ASP  93  -0.947   1.672 -11.986
  691    H    LEU  94           HN       LEU  94  -3.011   3.802 -10.034
  692    HA   LEU  94           HA       LEU  94  -5.338   5.166 -11.112
  693   1HB   LEU  94          1HB       LEU  94  -6.686   3.805  -9.826
  694   2HB   LEU  94          2HB       LEU  94  -5.460   3.541  -8.600
  695    HG   LEU  94           HG       LEU  94  -5.868   5.859  -7.726
  696   1HD1  LEU  94          2HD12     LEU  94  -6.640   6.885  -9.908
  697   2HD1  LEU  94          1HD11     LEU  94  -8.144   5.967  -9.757
  698   3HD1  LEU  94          3HD13     LEU  94  -7.719   7.203  -8.557
  699   1HD2  LEU  94          1HD21     LEU  94  -7.040   3.968  -6.771
  700   2HD2  LEU  94          2HD22     LEU  94  -8.034   5.431  -6.730
  701   3HD2  LEU  94          3HD23     LEU  94  -8.361   4.161  -7.933
  702    H    VAL  95           HN       VAL  95  -4.227   7.011 -11.353
  703    HA   VAL  95           HA       VAL  95  -2.184   7.925  -9.481
  704    HB   VAL  95           HB       VAL  95  -1.878   9.699 -11.167
  705   1HG1  VAL  95          3HG23     VAL  95  -0.741   7.533 -11.445
  706   2HG1  VAL  95          1HG21     VAL  95  -2.097   6.930 -12.421
  707   3HG1  VAL  95          2HG22     VAL  95  -1.122   8.293 -12.999
  708   1HG2  VAL  95          2HG12     VAL  95  -4.309   9.909 -11.848
  709   2HG2  VAL  95          3HG13     VAL  95  -3.181   9.772 -13.202
  710   3HG2  VAL  95          1HG11     VAL  95  -4.159   8.376 -12.722
  711    H    GLY  96           HN       GLY  96  -4.934   7.911  -8.341
  712   1HA   GLY  96          1HA       GLY  96  -4.872  10.627  -7.286
  713   2HA   GLY  96          2HA       GLY  96  -6.281  10.317  -8.326
  714    H    ALA  97           HN       ALA  97  -6.674  11.028  -5.751
  715    HA   ALA  97           HA       ALA  97  -6.884   8.872  -3.857
  716   1HB   ALA  97          1HB       ALA  97  -6.580  11.276  -3.294
  717   2HB   ALA  97          3HB       ALA  97  -8.198  11.623  -3.933
  718   3HB   ALA  97          2HB       ALA  97  -8.016  10.583  -2.509
  719    H    SER  98           HN       SER  98  -8.286   8.002  -6.236
  720    HA   SER  98           HA       SER  98 -11.182   8.554  -5.818
  721   1HB   SER  98          2HB       SER  98  -9.803   6.725  -7.811
  722   2HB   SER  98          1HB       SER  98 -11.508   7.191  -7.801
  723    HG   SER  98           HG       SER  98  -9.403   9.093  -7.906
  724    H    GLN  99           HN       GLN  99 -10.808   7.693  -3.574
  725    HA   GLN  99           HA       GLN  99 -10.192   5.246  -2.664
  726   1HB   GLN  99          1HB       GLN  99 -12.748   6.744  -1.897
  727   2HB   GLN  99          2HB       GLN  99 -11.956   5.495  -0.929
  728   1HG   GLN  99          2HG       GLN  99 -10.823   8.242  -1.633
  729   2HG   GLN  99          1HG       GLN  99 -11.368   7.684  -0.057
  730   1HE2  GLN  99          2HE22     GLN  99  -8.484   5.548   0.481
  731   2HE2  GLN  99          1HE21     GLN  99 -10.213   5.602   0.760
  732    H    ASP 100           HN       ASP 100 -13.490   5.810  -4.034
  733    HA   ASP 100           HA       ASP 100 -14.383   3.136  -3.674
  734   1HB   ASP 100          1HB       ASP 100 -15.901   4.995  -4.199
  735   2HB   ASP 100          2HB       ASP 100 -15.160   5.182  -5.800
  736    H    LYS 101           HN       LYS 101 -12.597   4.662  -6.352
  737    HA   LYS 101           HA       LYS 101 -12.761   2.391  -8.134
  738   1HB   LYS 101          2HB       LYS 101 -12.381   4.891  -8.639
  739   2HB   LYS 101          1HB       LYS 101 -10.690   4.626  -8.209
  740   1HG   LYS 101          2HG       LYS 101 -12.125   2.935 -10.295
  741   2HG   LYS 101          1HG       LYS 101 -11.479   4.539 -10.664
  742   1HD   LYS 101          1HD       LYS 101  -9.229   3.907 -10.077
  743   2HD   LYS 101          2HD       LYS 101  -9.748   2.300  -9.563
  744   1HE   LYS 101          2HE       LYS 101 -10.022   3.416 -12.399
  745   2HE   LYS 101          1HE       LYS 101  -8.703   2.374 -11.852
  746   1HZ   LYS 101          2HZ       LYS 101 -10.314   0.685 -11.345
  747   2HZ   LYS 101          3HZ       LYS 101 -11.543   1.637 -11.894
  748   3HZ   LYS 101          1HZ       LYS 101 -10.376   1.115 -12.933
  749    H    LEU 102           HN       LEU 102 -10.449   3.677  -5.786
  750    HA   LEU 102           HA       LEU 102  -8.321   1.860  -5.980
  751   1HB   LEU 102          1HB       LEU 102  -8.884   3.961  -4.376
  752   2HB   LEU 102          2HB       LEU 102  -9.264   2.677  -3.223
  753    HG   LEU 102           HG       LEU 102  -6.594   3.163  -4.555
  754   1HD1  LEU 102          2HD12     LEU 102  -7.710   3.501  -1.726
  755   2HD1  LEU 102          1HD11     LEU 102  -6.005   3.642  -2.144
  756   3HD1  LEU 102          3HD13     LEU 102  -7.171   4.789  -2.825
  757   1HD2  LEU 102          1HD21     LEU 102  -7.412   1.039  -2.521
  758   2HD2  LEU 102          3HD23     LEU 102  -6.885   0.738  -4.198
  759   3HD2  LEU 102          2HD22     LEU 102  -5.753   1.422  -3.027
  760    H    LYS 103           HN       LYS 103 -11.191   1.651  -3.822
  761    HA   LYS 103           HA       LYS 103 -10.808  -0.930  -2.805
  762   1HB   LYS 103          1HB       LYS 103 -12.483   0.813  -2.098
  763   2HB   LYS 103          2HB       LYS 103 -13.476   0.405  -3.489
  764   1HG   LYS 103          2HG       LYS 103 -13.731  -1.914  -2.689
  765   2HG   LYS 103          1HG       LYS 103 -12.685  -1.561  -1.300
  766   1HD   LYS 103          1HD       LYS 103 -14.297   0.178  -0.538
  767   2HD   LYS 103          2HD       LYS 103 -15.333  -0.175  -1.936
  768   1HE   LYS 103          1HE       LYS 103 -15.612  -2.518  -1.130
  769   2HE   LYS 103          2HE       LYS 103 -14.590  -2.154   0.274
  770   1HZ   LYS 103          2HZ       LYS 103 -17.147  -0.859  -0.366
  771   2HZ   LYS 103          1HZ       LYS 103 -16.901  -2.003   0.795
  772   3HZ   LYS 103          3HZ       LYS 103 -16.199  -0.520   0.940
  773    H    ALA 104           HN       ALA 104 -12.773   0.078  -5.596
  774    HA   ALA 104           HA       ALA 104 -13.631  -2.427  -6.501
  775   1HB   ALA 104          1HB       ALA 104 -14.446  -0.251  -7.374
  776   2HB   ALA 104          2HB       ALA 104 -12.904  -0.019  -8.227
  777   3HB   ALA 104          3HB       ALA 104 -13.971  -1.359  -8.677
  778    H    LEU 105           HN       LEU 105 -10.554  -0.724  -7.345
  779    HA   LEU 105           HA       LEU 105  -9.609  -2.693  -9.168
  780   1HB   LEU 105          2HB       LEU 105  -8.159  -0.736  -7.336
  781   2HB   LEU 105          1HB       LEU 105  -7.292  -1.840  -8.392
  782    HG   LEU 105           HG       LEU 105  -9.355   0.120  -9.437
  783   1HD1  LEU 105          1HD11     LEU 105  -6.314   0.375  -9.198
  784   2HD1  LEU 105          3HD13     LEU 105  -7.354   1.492 -10.096
  785   3HD1  LEU 105          2HD12     LEU 105  -7.517   1.359  -8.336
  786   1HD2  LEU 105          3HD23     LEU 105  -7.160  -1.523 -10.745
  787   2HD2  LEU 105          2HD22     LEU 105  -8.908  -1.705 -11.006
  788   3HD2  LEU 105          1HD21     LEU 105  -8.085  -0.250 -11.570
  789    H    VAL 106           HN       VAL 106  -9.045  -2.349  -5.594
  790    HA   VAL 106           HA       VAL 106  -7.454  -4.704  -5.479
  791    HB   VAL 106           HB       VAL 106  -9.285  -3.760  -3.227
  792   1HG1  VAL 106          1HG21     VAL 106  -6.670  -5.339  -3.338
  793   2HG1  VAL 106          3HG23     VAL 106  -7.515  -4.867  -1.853
  794   3HG1  VAL 106          2HG22     VAL 106  -8.257  -6.016  -2.965
  795   1HG2  VAL 106          1HG11     VAL 106  -6.554  -2.770  -4.127
  796   2HG2  VAL 106          3HG13     VAL 106  -7.993  -1.823  -3.720
  797   3HG2  VAL 106          2HG12     VAL 106  -7.098  -2.626  -2.440
  798    H    ALA 107           HN       ALA 107 -10.973  -4.307  -5.048
  799    HA   ALA 107           HA       ALA 107 -11.624  -6.998  -4.531
  800   1HB   ALA 107          1HB       ALA 107 -13.240  -5.117  -4.370
  801   2HB   ALA 107          3HB       ALA 107 -13.259  -4.976  -6.139
  802   3HB   ALA 107          2HB       ALA 107 -13.875  -6.444  -5.360
  803    H    LYS 108           HN       LYS 108 -11.478  -5.369  -7.714
  804    HA   LYS 108           HA       LYS 108 -12.085  -7.573  -9.363
  805   1HB   LYS 108          1HB       LYS 108 -12.013  -5.243 -10.075
  806   2HB   LYS 108          2HB       LYS 108 -10.286  -5.133  -9.793
  807   1HG   LYS 108          2HG       LYS 108  -9.894  -6.868 -11.575
  808   2HG   LYS 108          1HG       LYS 108 -11.632  -6.840 -11.923
  809   1HD   LYS 108          2HD       LYS 108  -9.667  -4.501 -12.115
  810   2HD   LYS 108          1HD       LYS 108 -10.290  -5.450 -13.469
  811   1HE   LYS 108          2HE       LYS 108 -12.616  -4.675 -12.894
  812   2HE   LYS 108          1HE       LYS 108 -11.922  -3.625 -11.641
  813   1HZ   LYS 108          1HZ       LYS 108 -10.664  -2.524 -13.336
  814   2HZ   LYS 108          2HZ       LYS 108 -11.319  -3.482 -14.504
  815   3HZ   LYS 108          3HZ       LYS 108 -12.279  -2.446 -13.656
  816    H    HIS 109           HN       HIS 109  -8.877  -6.208  -8.662
  817    HA   HIS 109           HA       HIS 109  -7.481  -8.341  -9.995
  818   1HB   HIS 109          1HB       HIS 109  -6.538  -6.137  -8.120
  819   2HB   HIS 109          2HB       HIS 109  -5.475  -7.290  -8.947
  820    HD2  HIS 109           HD2      HIS 109  -7.792  -4.262  -9.994
  821    HE1  HIS 109           HE1      HIS 109  -5.378  -5.413 -13.243
  822    HE2  HIS 109           HE2      HIS 109  -7.029  -3.659 -12.421
  823    H    ALA 110           HN       ALA 110  -8.616  -8.079  -6.645
  824    HA   ALA 110           HA       ALA 110  -6.900 -10.253  -5.705
  825   1HB   ALA 110          1HB       ALA 110  -7.734  -8.443  -4.215
  826   2HB   ALA 110          2HB       ALA 110  -9.397  -9.028  -4.468
  827   3HB   ALA 110          3HB       ALA 110  -8.196 -10.058  -3.659
  828    H    ALA 111           HN       ALA 111  -9.456 -10.393  -7.919
  829    HA   ALA 111           HA       ALA 111 -10.849 -12.665  -6.749
  830   1HB   ALA 111          1HB       ALA 111 -11.895 -11.049  -8.312
  831   2HB   ALA 111          2HB       ALA 111 -10.807 -11.608  -9.603
  832   3HB   ALA 111          3HB       ALA 111 -11.998 -12.720  -8.897
  833    H    ALA 112           HN       ALA 112  -8.157 -13.374  -6.523
  834    HA   ALA 112           HA       ALA 112  -8.045 -15.865  -7.888
  835   1HB   ALA 112          1HB       ALA 112  -6.025 -13.726  -8.724
  836   2HB   ALA 112          2HB       ALA 112  -5.948 -15.457  -9.132
  837   3HB   ALA 112          3HB       ALA 112  -7.247 -14.453  -9.791
   
  No H/Q in entry =         837
  Start of MODEL   19
    1   1H    GLY   1          2HN       GLY   1  -3.812  -9.072   3.145
    2   2H    GLY   1          1HN       GLY   1  -3.355  -9.247   1.539
    3   3H    GLY   1          3HN       GLY   1  -4.544 -10.220   2.170
    4   1HA   GLY   1          1HA       GLY   1  -3.252 -11.654   3.085
    5   2HA   GLY   1          2HA       GLY   1  -1.989 -10.923   2.070
    6    H    GLY   2           HN       GLY   2  -0.754 -11.766   4.230
    7   1HA   GLY   2          1HA       GLY   2  -0.967 -10.246   6.634
    8   2HA   GLY   2          2HA       GLY   2   0.488 -11.081   6.048
    9    H    SER   3           HN       SER   3   0.832  -9.786   3.600
   10    HA   SER   3           HA       SER   3   2.191  -7.409   4.175
   11   1HB   SER   3          1HB       SER   3   1.130  -8.480   1.561
   12   2HB   SER   3          2HB       SER   3   2.569  -7.460   1.763
   13    HG   SER   3           HG       SER   3   3.484  -9.208   2.975
   14    H    VAL   4           HN       VAL   4   0.265  -6.466   5.312
   15    HA   VAL   4           HA       VAL   4  -0.983  -4.360   3.615
   16    HB   VAL   4           HB       VAL   4  -2.197  -6.079   5.828
   17   1HG1  VAL   4          1HG21     VAL   4  -2.878  -3.245   5.079
   18   2HG1  VAL   4          2HG22     VAL   4  -4.151  -4.364   5.645
   19   3HG1  VAL   4          3HG23     VAL   4  -2.769  -3.995   6.672
   20   1HG2  VAL   4          3HG13     VAL   4  -3.154  -5.350   3.016
   21   2HG2  VAL   4          2HG12     VAL   4  -2.605  -6.907   3.574
   22   3HG2  VAL   4          1HG11     VAL   4  -4.108  -6.236   4.217
   23    H    ILE   5           HN       ILE   5   0.761  -2.958   4.092
   24    HA   ILE   5           HA       ILE   5   1.292  -2.395   6.976
   25    HB   ILE   5           HB       ILE   5   3.784  -2.375   6.319
   26   1HG1  ILE   5          2HG12     ILE   5   4.539  -3.788   4.553
   27   2HG1  ILE   5          1HG11     ILE   5   2.905  -4.246   4.075
   28   1HG2  ILE   5          3HG23     ILE   5   2.722  -4.101   7.750
   29   2HG2  ILE   5          2HG22     ILE   5   2.385  -5.078   6.307
   30   3HG2  ILE   5          1HG21     ILE   5   4.057  -4.731   6.775
   31   1HD1  ILE   5          1HD11     ILE   5   3.940  -1.381   3.870
   32   2HD1  ILE   5          2HD12     ILE   5   4.089  -2.584   2.582
   33   3HD1  ILE   5          3HD13     ILE   5   2.487  -2.081   3.124
   34    H    VAL   6           HN       VAL   6   2.907  -0.564   7.154
   35    HA   VAL   6           HA       VAL   6   2.365   1.574   5.189
   36    HB   VAL   6           HB       VAL   6   2.155   3.146   7.093
   37   1HG1  VAL   6          2HG22     VAL   6   0.107   2.088   6.187
   38   2HG1  VAL   6          1HG21     VAL   6   0.208   0.822   7.426
   39   3HG1  VAL   6          3HG23     VAL   6  -0.045   2.511   7.897
   40   1HG2  VAL   6          1HG11     VAL   6   3.526   1.925   8.780
   41   2HG2  VAL   6          2HG12     VAL   6   1.930   2.356   9.404
   42   3HG2  VAL   6          3HG13     VAL   6   2.257   0.688   8.908
   43    H    ILE   7           HN       ILE   7   4.638  -0.288   5.566
   44    HA   ILE   7           HA       ILE   7   6.788   1.497   6.548
   45    HB   ILE   7           HB       ILE   7   6.875  -0.846   7.146
   46   1HG1  ILE   7          2HG12     ILE   7   9.151  -0.024   5.275
   47   2HG1  ILE   7          1HG11     ILE   7   8.895   0.613   6.905
   48   1HG2  ILE   7          3HG23     ILE   7   5.951  -1.734   4.865
   49   2HG2  ILE   7          2HG22     ILE   7   7.639  -1.648   4.327
   50   3HG2  ILE   7          1HG21     ILE   7   7.195  -2.655   5.705
   51   1HD1  ILE   7          3HD13     ILE   7   9.112  -1.653   7.863
   52   2HD1  ILE   7          2HD12     ILE   7   9.434  -2.311   6.245
   53   3HD1  ILE   7          1HD11     ILE   7  10.562  -1.152   6.970
   54    H    ASP   8           HN       ASP   8   6.176   3.125   5.076
   55    HA   ASP   8           HA       ASP   8   6.451   2.960   2.222
   56   1HB   ASP   8          1HB       ASP   8   6.369   5.264   4.216
   57   2HB   ASP   8          2HB       ASP   8   6.601   5.496   2.484
   58    H    SER   9           HN       SER   9   8.498   1.650   2.665
   59    HA   SER   9           HA       SER   9  10.798   3.323   1.891
   60   1HB   SER   9          2HB       SER   9  10.893   1.450   4.297
   61   2HB   SER   9          1HB       SER   9  12.269   2.333   3.608
   62    HG   SER   9           HG       SER   9  10.374   4.121   4.035
   63    H    LYS  10           HN       LYS  10  12.631   1.923   1.233
   64    HA   LYS  10           HA       LYS  10  12.217   0.249  -0.833
   65   1HB   LYS  10          1HB       LYS  10  14.358   1.172  -0.235
   66   2HB   LYS  10          2HB       LYS  10  14.422   0.244   1.274
   67   1HG   LYS  10          1HG       LYS  10  14.722  -1.826   0.103
   68   2HG   LYS  10          2HG       LYS  10  14.388  -1.065  -1.468
   69   1HD   LYS  10          1HD       LYS  10  16.439   0.251  -1.324
   70   2HD   LYS  10          2HD       LYS  10  16.703  -0.252   0.355
   71   1HE   LYS  10          1HE       LYS  10  18.178  -1.479  -1.203
   72   2HE   LYS  10          2HE       LYS  10  17.088  -2.567  -0.326
   73   1HZ   LYS  10          3HZ       LYS  10  16.617  -1.599  -3.059
   74   2HZ   LYS  10          2HZ       LYS  10  17.254  -3.071  -2.666
   75   3HZ   LYS  10          1HZ       LYS  10  15.714  -2.703  -2.218
   76    H    ALA  11           HN       ALA  11  12.398  -0.797   2.541
   77    HA   ALA  11           HA       ALA  11  12.430  -3.559   2.389
   78   1HB   ALA  11          2HB       ALA  11  10.781  -1.804   4.254
   79   2HB   ALA  11          1HB       ALA  11  11.196  -3.510   4.538
   80   3HB   ALA  11          3HB       ALA  11  12.478  -2.282   4.491
   81    H    ALA  12           HN       ALA  12   9.569  -1.417   1.855
   82    HA   ALA  12           HA       ALA  12   7.709  -3.613   1.745
   83   1HB   ALA  12          2HB       ALA  12   7.566  -0.761   0.670
   84   2HB   ALA  12          3HB       ALA  12   6.224  -1.920   0.609
   85   3HB   ALA  12          1HB       ALA  12   6.857  -1.399   2.170
   86    H    TRP  13           HN       TRP  13   9.488  -1.714  -0.663
   87    HA   TRP  13           HA       TRP  13   8.329  -2.760  -3.011
   88   1HB   TRP  13          2HB       TRP  13   9.744  -0.707  -2.832
   89   2HB   TRP  13          1HB       TRP  13  11.169  -1.725  -2.610
   90    HD1  TRP  13           HD1      TRP  13  12.211  -2.840  -4.733
   91    HE1  TRP  13           HE1      TRP  13  11.767  -2.682  -7.270
   92    HE3  TRP  13           HE3      TRP  13   7.738  -0.354  -4.641
   93    HZ2  TRP  13           HZ2      TRP  13   9.751  -1.694  -8.987
   94    HZ3  TRP  13           HZ3      TRP  13   6.607   0.239  -6.751
   95    HH2  TRP  13           HH2      TRP  13   7.599  -0.414  -8.943
   96    H    ASP  14           HN       ASP  14  11.114  -3.944  -1.087
   97    HA   ASP  14           HA       ASP  14  11.324  -6.284  -2.980
   98   1HB   ASP  14          2HB       ASP  14  13.545  -6.632  -1.748
   99   2HB   ASP  14          1HB       ASP  14  13.347  -5.358  -2.932
  100    H    ALA  15           HN       ALA  15  12.015  -5.894   0.442
  101    HA   ALA  15           HA       ALA  15  11.752  -8.616   1.056
  102   1HB   ALA  15          2HB       ALA  15  12.818  -6.936   2.545
  103   2HB   ALA  15          1HB       ALA  15  11.213  -6.335   3.010
  104   3HB   ALA  15          3HB       ALA  15  11.680  -7.995   3.399
  105    H    GLN  16           HN       GLN  16   9.249  -6.132   1.622
  106    HA   GLN  16           HA       GLN  16   7.307  -8.025   2.546
  107   1HB   GLN  16          2HB       GLN  16   7.214  -5.513   2.863
  108   2HB   GLN  16          1HB       GLN  16   6.616  -5.423   1.187
  109   1HG   GLN  16          2HG       GLN  16   4.718  -5.390   2.652
  110   2HG   GLN  16          1HG       GLN  16   4.749  -6.920   1.771
  111   1HE2  GLN  16          2HE22     GLN  16   5.647  -6.975   5.820
  112   2HE2  GLN  16          1HE21     GLN  16   6.119  -5.580   4.868
  113    H    LEU  17           HN       LEU  17   7.731  -6.489  -0.697
  114    HA   LEU  17           HA       LEU  17   5.770  -7.788  -2.131
  115   1HB   LEU  17          1HB       LEU  17   7.224  -6.089  -3.100
  116   2HB   LEU  17          2HB       LEU  17   8.638  -7.132  -2.943
  117    HG   LEU  17           HG       LEU  17   7.739  -8.693  -4.624
  118   1HD1  LEU  17          2HD12     LEU  17   5.444  -6.706  -4.798
  119   2HD1  LEU  17          1HD11     LEU  17   5.751  -8.002  -5.970
  120   3HD1  LEU  17          3HD13     LEU  17   5.313  -8.408  -4.306
  121   1HD2  LEU  17          1HD21     LEU  17   7.739  -5.783  -5.533
  122   2HD2  LEU  17          3HD23     LEU  17   9.165  -6.827  -5.351
  123   3HD2  LEU  17          2HD22     LEU  17   7.947  -7.202  -6.580
  124    H    ALA  18           HN       ALA  18   9.052  -9.081  -1.470
  125    HA   ALA  18           HA       ALA  18   8.747 -11.535  -2.825
  126   1HB   ALA  18          1HB       ALA  18  10.892 -10.625  -2.048
  127   2HB   ALA  18          2HB       ALA  18  10.417 -10.882  -0.357
  128   3HB   ALA  18          3HB       ALA  18  10.637 -12.275  -1.437
  129    H    LYS  19           HN       LYS  19   8.331 -10.946   0.760
  130    HA   LYS  19           HA       LYS  19   7.375 -13.632   1.166
  131   1HB   LYS  19          1HB       LYS  19   6.624 -12.926   3.343
  132   2HB   LYS  19          2HB       LYS  19   8.273 -12.381   3.023
  133   1HG   LYS  19          2HG       LYS  19   7.531 -10.152   2.599
  134   2HG   LYS  19          1HG       LYS  19   5.820 -10.568   2.742
  135   1HD   LYS  19          1HD       LYS  19   7.857 -10.901   5.000
  136   2HD   LYS  19          2HD       LYS  19   6.884  -9.442   4.760
  137   1HE   LYS  19          1HE       LYS  19   4.794 -10.800   4.941
  138   2HE   LYS  19          2HE       LYS  19   5.773 -12.235   5.301
  139   1HZ   LYS  19          1HZ       LYS  19   5.699  -9.771   6.886
  140   2HZ   LYS  19          2HZ       LYS  19   4.976 -11.200   7.271
  141   3HZ   LYS  19          3HZ       LYS  19   6.620 -11.099   7.217
  142    H    GLY  20           HN       GLY  20   5.716 -10.800  -0.108
  143   1HA   GLY  20          1HA       GLY  20   3.051 -11.592   0.389
  144   2HA   GLY  20          2HA       GLY  20   3.636 -10.606  -0.969
  145    H    LYS  21           HN       LYS  21   5.433 -13.204  -1.582
  146    HA   LYS  21           HA       LYS  21   5.346 -14.930  -3.046
  147   1HB   LYS  21          1HB       LYS  21   2.603 -15.436  -1.800
  148   2HB   LYS  21          2HB       LYS  21   3.495 -16.556  -2.838
  149   1HG   LYS  21          1HG       LYS  21   5.364 -16.614  -1.220
  150   2HG   LYS  21          2HG       LYS  21   4.490 -15.481  -0.174
  151   1HD   LYS  21          1HD       LYS  21   2.624 -17.105   0.043
  152   2HD   LYS  21          2HD       LYS  21   3.511 -18.257  -0.980
  153   1HE   LYS  21          2HE       LYS  21   5.369 -18.291   0.683
  154   2HE   LYS  21          1HE       LYS  21   4.481 -17.134   1.696
  155   1HZ   LYS  21          1HZ       LYS  21   2.746 -18.754   1.920
  156   2HZ   LYS  21          2HZ       LYS  21   3.566 -19.831   0.979
  157   3HZ   LYS  21          3HZ       LYS  21   4.184 -19.371   2.436
  158    H    GLU  22           HN       GLU  22   5.276 -13.025  -4.479
  159    HA   GLU  22           HA       GLU  22   2.862 -12.382  -5.931
  160   1HB   GLU  22          1HB       GLU  22   4.894 -10.868  -5.412
  161   2HB   GLU  22          2HB       GLU  22   5.701 -11.663  -6.770
  162   1HG   GLU  22          1HG       GLU  22   3.030 -10.179  -6.846
  163   2HG   GLU  22          2HG       GLU  22   4.575  -9.525  -7.410
  164    H    GLU  23           HN       GLU  23   2.638 -14.814  -6.217
  165    HA   GLU  23           HA       GLU  23   3.952 -16.066  -8.486
  166   1HB   GLU  23          2HB       GLU  23   1.138 -16.557  -7.385
  167   2HB   GLU  23          1HB       GLU  23   2.017 -17.591  -8.511
  168   1HG   GLU  23          1HG       GLU  23   3.781 -17.984  -6.818
  169   2HG   GLU  23          2HG       GLU  23   2.934 -16.946  -5.662
  170    H    HIS  24           HN       HIS  24   0.836 -14.435  -8.076
  171    HA   HIS  24           HA       HIS  24   1.040 -12.846 -10.499
  172   1HB   HIS  24          2HB       HIS  24  -0.992 -13.778 -11.540
  173   2HB   HIS  24          1HB       HIS  24   0.224 -15.042 -11.393
  174    HD2  HIS  24           HD2      HIS  24  -3.281 -14.066  -9.889
  175    HE1  HIS  24           HE1      HIS  24  -2.263 -17.923  -8.493
  176    HE2  HIS  24           HE2      HIS  24  -4.166 -16.208  -8.711
  177    H    LYS  25           HN       LYS  25   0.773 -12.524  -7.576
  178    HA   LYS  25           HA       LYS  25  -2.016 -12.154  -6.909
  179   1HB   LYS  25          2HB       LYS  25   0.480 -11.173  -5.454
  180   2HB   LYS  25          1HB       LYS  25  -1.149 -11.246  -4.773
  181   1HG   LYS  25          2HG       LYS  25   0.556 -13.613  -5.638
  182   2HG   LYS  25          1HG       LYS  25   0.258 -13.078  -3.982
  183   1HD   LYS  25          1HD       LYS  25  -2.231 -13.470  -4.391
  184   2HD   LYS  25          2HD       LYS  25  -1.795 -14.236  -5.930
  185   1HE   LYS  25          1HE       LYS  25  -0.921 -15.116  -3.138
  186   2HE   LYS  25          2HE       LYS  25  -2.058 -15.949  -4.213
  187   1HZ   LYS  25          2HZ       LYS  25  -0.235 -16.219  -5.770
  188   2HZ   LYS  25          1HZ       LYS  25   0.811 -15.525  -4.693
  189   3HZ   LYS  25          3HZ       LYS  25   0.080 -16.955  -4.334
  190    HA   PRO  26           HA       PRO  26  -2.211  -7.808  -8.134
  191   1HB   PRO  26          2HB       PRO  26  -4.379  -6.955  -6.721
  192   2HB   PRO  26          1HB       PRO  26  -4.528  -8.050  -8.127
  193   1HG   PRO  26          1HG       PRO  26  -4.367  -8.868  -5.224
  194   2HG   PRO  26          2HG       PRO  26  -5.662  -9.270  -6.359
  195   1HD   PRO  26          1HD       PRO  26  -3.588 -10.977  -5.904
  196   2HD   PRO  26          2HD       PRO  26  -4.094 -10.703  -7.589
  197    H    ILE  27           HN       ILE  27  -0.155  -7.327  -7.185
  198    HA   ILE  27           HA       ILE  27  -0.276  -6.393  -4.380
  199    HB   ILE  27           HB       ILE  27   1.939  -6.593  -4.164
  200   1HG1  ILE  27          2HG12     ILE  27   3.503  -6.753  -6.290
  201   2HG1  ILE  27          1HG11     ILE  27   2.226  -5.795  -7.022
  202   1HG2  ILE  27          2HG22     ILE  27   0.937  -8.816  -4.929
  203   2HG2  ILE  27          3HG23     ILE  27   1.657  -8.468  -6.515
  204   3HG2  ILE  27          1HG21     ILE  27   2.691  -8.646  -5.083
  205   1HD1  ILE  27          2HD12     ILE  27   2.447  -4.201  -5.028
  206   2HD1  ILE  27          1HD11     ILE  27   3.797  -5.191  -4.480
  207   3HD1  ILE  27          3HD13     ILE  27   3.926  -4.322  -6.020
  208    H    VAL  28           HN       VAL  28  -0.987  -4.499  -3.997
  209    HA   VAL  28           HA       VAL  28  -1.168  -2.531  -6.201
  210    HB   VAL  28           HB       VAL  28  -2.545  -2.389  -3.500
  211   1HG1  VAL  28          1HG11     VAL  28  -2.523  -0.404  -5.055
  212   2HG1  VAL  28          3HG13     VAL  28  -3.294  -1.404  -6.297
  213   3HG1  VAL  28          2HG12     VAL  28  -4.156  -1.066  -4.787
  214   1HG2  VAL  28          2HG22     VAL  28  -3.569  -3.884  -5.949
  215   2HG2  VAL  28          1HG21     VAL  28  -3.191  -4.598  -4.366
  216   3HG2  VAL  28          3HG23     VAL  28  -4.518  -3.456  -4.506
  217    H    VAL  29           HN       VAL  29   0.293  -0.935  -6.176
  218    HA   VAL  29           HA       VAL  29   1.823  -0.338  -3.671
  219    HB   VAL  29           HB       VAL  29   2.523   0.121  -6.590
  220   1HG1  VAL  29          2HG12     VAL  29   4.131   0.473  -4.031
  221   2HG1  VAL  29          1HG11     VAL  29   4.738   0.681  -5.689
  222   3HG1  VAL  29          3HG13     VAL  29   3.545   1.806  -5.046
  223   1HG2  VAL  29          2HG22     VAL  29   3.382  -1.933  -4.519
  224   2HG2  VAL  29          1HG21     VAL  29   2.518  -2.224  -6.044
  225   3HG2  VAL  29          3HG23     VAL  29   4.209  -1.674  -6.070
  226    H    ASP  30           HN       ASP  30   0.801   1.262  -2.645
  227    HA   ASP  30           HA       ASP  30  -0.377   3.579  -4.021
  228   1HB   ASP  30          1HB       ASP  30  -1.460   2.792  -2.027
  229   2HB   ASP  30          2HB       ASP  30   0.048   2.777  -1.125
  230    H    PHE  31           HN       PHE  31   1.373   4.497  -5.167
  231    HA   PHE  31           HA       PHE  31   3.756   5.438  -3.694
  232   1HB   PHE  31          1HB       PHE  31   2.721   5.937  -6.499
  233   2HB   PHE  31          2HB       PHE  31   4.124   6.726  -5.822
  234    HD1  PHE  31           HD1      PHE  31   6.202   5.502  -5.312
  235    HD2  PHE  31           HD2      PHE  31   2.844   3.573  -7.212
  236    HE1  PHE  31           HE1      PHE  31   7.744   3.930  -6.439
  237    HE2  PHE  31           HE2      PHE  31   4.406   2.044  -8.385
  238    HZ   PHE  31           HZ       PHE  31   6.850   2.261  -8.065
  239    H    THR  32           HN       THR  32   3.413   7.167  -2.285
  240    HA   THR  32           HA       THR  32   1.768   9.427  -3.250
  241    HB   THR  32           HB       THR  32   1.298   7.946  -0.629
  242    HG1  THR  32           HG1      THR  32  -0.071   7.208  -2.195
  243   1HG2  THR  32          1HG21     THR  32   0.355  10.706  -1.515
  244   2HG2  THR  32          3HG23     THR  32  -0.377   9.783  -0.195
  245   3HG2  THR  32          2HG22     THR  32   1.300  10.334  -0.054
  246    H    ALA  33           HN       ALA  33   2.398  11.405  -2.425
  247    HA   ALA  33           HA       ALA  33   5.173  11.589  -1.468
  248   1HB   ALA  33          3HB       ALA  33   2.994  13.484  -2.386
  249   2HB   ALA  33          1HB       ALA  33   4.369  14.087  -1.459
  250   3HB   ALA  33          2HB       ALA  33   4.637  13.255  -3.008
  251    H    THR  34           HN       THR  34   5.421  11.030   0.718
  252    HA   THR  34           HA       THR  34   3.358  11.241   2.660
  253    HB   THR  34           HB       THR  34   6.384  11.233   3.015
  254    HG1  THR  34           HG1      THR  34   5.542   9.478   1.867
  255   1HG2  THR  34          3HG23     THR  34   4.178  10.482   4.974
  256   2HG2  THR  34          2HG22     THR  34   5.915  10.182   5.188
  257   3HG2  THR  34          1HG21     THR  34   5.312  11.850   5.138
  258    H    TRP  35           HN       TRP  35   5.781  13.560   1.590
  259    HA   TRP  35           HA       TRP  35   5.308  15.597   3.538
  260   1HB   TRP  35          1HB       TRP  35   6.254  17.083   1.708
  261   2HB   TRP  35          2HB       TRP  35   7.262  15.757   2.267
  262    HD1  TRP  35           HD1      TRP  35   7.810  13.790   0.608
  263    HE1  TRP  35           HE1      TRP  35   7.720  13.563  -1.972
  264    HE3  TRP  35           HE3      TRP  35   4.869  17.842  -0.473
  265    HZ2  TRP  35           HZ2      TRP  35   6.664  15.035  -4.175
  266    HZ3  TRP  35           HZ3      TRP  35   4.324  18.388  -2.825
  267    HH2  TRP  35           HH2      TRP  35   5.217  17.003  -4.681
  268    H    CYS  36           HN       CYS  36   3.448  14.571   0.680
  269    HA   CYS  36           HA       CYS  36   1.828  17.044   0.659
  270   1HB   CYS  36          1HB       CYS  36   2.286  15.959  -1.484
  271   2HB   CYS  36          2HB       CYS  36   1.557  14.461  -0.889
  272    H    GLY  37           HN       GLY  37   1.451  16.717   2.984
  273   1HA   GLY  37          1HA       GLY  37   0.120  14.843   4.387
  274   2HA   GLY  37          2HA       GLY  37  -0.315  16.556   4.519
  275    HA   PRO  38           HA       PRO  38  -4.272  16.057   2.595
  276   1HB   PRO  38          1HB       PRO  38  -3.294  17.131  -0.063
  277   2HB   PRO  38          2HB       PRO  38  -4.797  17.537   0.817
  278   1HG   PRO  38          1HG       PRO  38  -2.687  19.219   0.970
  279   2HG   PRO  38          2HG       PRO  38  -3.551  18.776   2.474
  280   1HD   PRO  38          1HD       PRO  38  -0.982  17.612   1.385
  281   2HD   PRO  38          2HD       PRO  38  -1.345  18.148   3.053
  282    H    CYS  39           HN       CYS  39  -1.700  15.056   0.343
  283    HA   CYS  39           HA       CYS  39  -3.308  13.259  -1.252
  284   1HB   CYS  39          1HB       CYS  39  -0.315  13.067  -0.721
  285   2HB   CYS  39          2HB       CYS  39  -1.242  12.287  -1.989
  286    H    LYS  40           HN       LYS  40  -1.195  12.923   1.628
  287    HA   LYS  40           HA       LYS  40  -1.591  10.100   1.887
  288   1HB   LYS  40          1HB       LYS  40  -0.643  12.278   3.771
  289   2HB   LYS  40          2HB       LYS  40  -0.956  10.660   4.392
  290   1HG   LYS  40          1HG       LYS  40   0.963  11.262   2.112
  291   2HG   LYS  40          2HG       LYS  40   1.398  11.044   3.816
  292   1HD   LYS  40          2HD       LYS  40   0.370   8.741   3.761
  293   2HD   LYS  40          1HD       LYS  40   0.160   8.907   2.010
  294   1HE   LYS  40          2HE       LYS  40   2.612   9.184   1.736
  295   2HE   LYS  40          1HE       LYS  40   2.811   8.930   3.484
  296   1HZ   LYS  40          3HZ       LYS  40   1.622   7.009   1.608
  297   2HZ   LYS  40          2HZ       LYS  40   3.143   6.924   2.223
  298   3HZ   LYS  40          1HZ       LYS  40   1.847   6.775   3.221
  299    H    MET  41           HN       MET  41  -4.004  12.557   2.417
  300    HA   MET  41           HA       MET  41  -5.417  11.035   4.486
  301   1HB   MET  41          2HB       MET  41  -6.461  13.055   2.435
  302   2HB   MET  41          1HB       MET  41  -7.334  12.453   3.847
  303   1HG   MET  41          2HG       MET  41  -5.669  13.417   5.359
  304   2HG   MET  41          1HG       MET  41  -4.730  14.019   3.989
  305   1HE   MET  41          1HE       MET  41  -4.628  16.344   5.155
  306   2HE   MET  41          3HE       MET  41  -6.065  17.273   5.645
  307   3HE   MET  41          2HE       MET  41  -5.649  15.766   6.495
  308    H    ILE  42           HN       ILE  42  -4.824  10.386   1.140
  309    HA   ILE  42           HA       ILE  42  -7.174   8.594   1.000
  310    HB   ILE  42           HB       ILE  42  -4.828   9.136  -0.864
  311   1HG1  ILE  42          1HG11     ILE  42  -6.953   9.758  -2.298
  312   2HG1  ILE  42          2HG12     ILE  42  -7.783   9.911  -0.762
  313   1HG2  ILE  42          3HG23     ILE  42  -7.164   7.210  -1.110
  314   2HG2  ILE  42          2HG22     ILE  42  -6.119   7.706  -2.459
  315   3HG2  ILE  42          1HG21     ILE  42  -5.431   6.808  -1.106
  316   1HD1  ILE  42          1HD11     ILE  42  -5.277  11.444  -1.611
  317   2HD1  ILE  42          2HD12     ILE  42  -6.935  12.057  -1.673
  318   3HD1  ILE  42          3HD13     ILE  42  -6.189  11.715  -0.109
  319    H    ALA  43           HN       ALA  43  -3.856   8.494   2.151
  320    HA   ALA  43           HA       ALA  43  -3.305   5.764   1.804
  321   1HB   ALA  43          2HB       ALA  43  -1.661   7.458   2.582
  322   2HB   ALA  43          1HB       ALA  43  -2.442   7.477   4.182
  323   3HB   ALA  43          3HB       ALA  43  -1.681   5.997   3.584
  324    HA   PRO  44           HA       PRO  44  -5.499   4.751   5.974
  325   1HB   PRO  44          1HB       PRO  44  -7.658   6.287   6.756
  326   2HB   PRO  44          2HB       PRO  44  -5.991   6.505   7.362
  327   1HG   PRO  44          1HG       PRO  44  -7.341   7.990   5.098
  328   2HG   PRO  44          2HG       PRO  44  -6.426   8.686   6.468
  329   1HD   PRO  44          2HD       PRO  44  -5.255   8.332   4.110
  330   2HD   PRO  44          1HD       PRO  44  -4.344   7.903   5.574
  331    H    LEU  45           HN       LEU  45  -7.285   6.370   3.343
  332    HA   LEU  45           HA       LEU  45  -9.474   4.449   3.324
  333   1HB   LEU  45          1HB       LEU  45  -8.373   6.347   1.224
  334   2HB   LEU  45          2HB       LEU  45  -9.547   5.122   0.793
  335    HG   LEU  45           HG       LEU  45 -10.486   7.370   1.237
  336   1HD1  LEU  45          3HD23     LEU  45 -11.877   5.322   1.373
  337   2HD1  LEU  45          1HD21     LEU  45 -11.564   5.226   3.119
  338   3HD1  LEU  45          2HD22     LEU  45 -12.440   6.611   2.450
  339   1HD2  LEU  45          1HD11     LEU  45  -9.036   8.000   3.151
  340   2HD2  LEU  45          2HD12     LEU  45 -10.762   8.217   3.484
  341   3HD2  LEU  45          3HD13     LEU  45  -9.902   6.833   4.178
  342    H    PHE  46           HN       PHE  46  -6.341   4.591   1.594
  343    HA   PHE  46           HA       PHE  46  -6.560   2.129   0.200
  344   1HB   PHE  46          1HB       PHE  46  -4.781   3.875  -0.108
  345   2HB   PHE  46          2HB       PHE  46  -4.032   3.353   1.392
  346    HD1  PHE  46           HD2      PHE  46  -4.882   2.323  -2.054
  347    HD2  PHE  46           HD1      PHE  46  -2.652   1.345   1.472
  348    HE1  PHE  46           HE2      PHE  46  -3.569   0.665  -3.339
  349    HE2  PHE  46           HE1      PHE  46  -1.108  -0.059   0.118
  350    HZ   PHE  46           HZ       PHE  46  -1.591  -0.457  -2.290
  351    H    GLU  47           HN       GLU  47  -5.309   2.833   3.491
  352    HA   GLU  47           HA       GLU  47  -4.636   0.188   4.212
  353   1HB   GLU  47          2HB       GLU  47  -3.974   2.256   5.451
  354   2HB   GLU  47          1HB       GLU  47  -5.649   2.449   5.995
  355   1HG   GLU  47          2HG       GLU  47  -4.236   1.442   7.736
  356   2HG   GLU  47          1HG       GLU  47  -5.544   0.359   7.253
  357    H    THR  48           HN       THR  48  -7.753   1.963   4.464
  358    HA   THR  48           HA       THR  48  -9.186  -0.098   5.819
  359    HB   THR  48           HB       THR  48 -10.291   1.909   3.799
  360    HG1  THR  48           HG1      THR  48  -9.089   2.894   5.517
  361   1HG2  THR  48          1HG21     THR  48 -11.578   0.451   6.147
  362   2HG2  THR  48          2HG22     THR  48 -12.346   1.703   5.152
  363   3HG2  THR  48          3HG23     THR  48 -11.910   0.146   4.426
  364    H    LEU  49           HN       LEU  49  -8.644   0.553   2.305
  365    HA   LEU  49           HA       LEU  49 -10.139  -1.695   1.422
  366   1HB   LEU  49          2HB       LEU  49  -9.234   0.302   0.054
  367   2HB   LEU  49          1HB       LEU  49  -7.697  -0.559  -0.017
  368    HG   LEU  49           HG       LEU  49  -8.886  -2.401  -1.201
  369   1HD1  LEU  49          3HD13     LEU  49 -11.284  -0.602  -0.629
  370   2HD1  LEU  49          1HD11     LEU  49 -11.298  -1.681  -2.022
  371   3HD1  LEU  49          2HD12     LEU  49 -11.157  -2.360  -0.403
  372   1HD2  LEU  49          1HD21     LEU  49  -7.885  -0.508  -2.443
  373   2HD2  LEU  49          3HD23     LEU  49  -9.256  -1.234  -3.285
  374   3HD2  LEU  49          2HD22     LEU  49  -9.464   0.313  -2.433
  375    H    SER  50           HN       SER  50  -6.767  -1.334   2.433
  376    HA   SER  50           HA       SER  50  -5.835  -3.974   1.788
  377   1HB   SER  50          2HB       SER  50  -4.936  -2.300   4.174
  378   2HB   SER  50          1HB       SER  50  -4.034  -3.470   3.227
  379    HG   SER  50           HG       SER  50  -4.987  -1.124   2.005
  380    H    ASN  51           HN       ASN  51  -7.299  -2.679   4.782
  381    HA   ASN  51           HA       ASN  51  -7.338  -5.144   6.209
  382   1HB   ASN  51          2HB       ASN  51  -7.724  -3.042   7.332
  383   2HB   ASN  51          1HB       ASN  51  -9.136  -2.682   6.335
  384   1HD2  ASN  51          1HD21     ASN  51 -11.358  -4.761   8.178
  385   2HD2  ASN  51          2HD22     ASN  51 -11.138  -3.869   6.681
  386    H    ASP  52           HN       ASP  52  -9.744  -3.643   3.993
  387    HA   ASP  52           HA       ASP  52 -11.753  -5.628   4.229
  388   1HB   ASP  52          1HB       ASP  52 -12.144  -3.467   3.142
  389   2HB   ASP  52          2HB       ASP  52 -10.995  -3.865   1.857
  390    H    TYR  53           HN       TYR  53  -9.071  -5.405   1.766
  391    HA   TYR  53           HA       TYR  53  -9.745  -8.128   0.783
  392   1HB   TYR  53          1HB       TYR  53  -7.922  -5.917  -0.081
  393   2HB   TYR  53          2HB       TYR  53  -7.859  -7.528  -0.797
  394    HD1  TYR  53           HD2      TYR  53  -9.785  -8.413  -2.134
  395    HD2  TYR  53           HD1      TYR  53  -9.631  -4.366  -0.712
  396    HE1  TYR  53           HE2      TYR  53 -11.175  -7.681  -4.048
  397    HE2  TYR  53           HE1      TYR  53 -10.780  -3.604  -2.780
  398    HH   TYR  53           HH       TYR  53 -11.871  -4.260  -4.775
  399    H    ALA  54           HN       ALA  54  -9.180  -8.413   3.311
  400    HA   ALA  54           HA       ALA  54  -6.428  -8.556   3.985
  401   1HB   ALA  54          3HB       ALA  54  -8.808 -10.169   5.054
  402   2HB   ALA  54          2HB       ALA  54  -7.208 -10.086   5.823
  403   3HB   ALA  54          1HB       ALA  54  -8.200  -8.628   5.699
  404    H    GLY  55           HN       GLY  55  -8.409 -10.615   1.988
  405   1HA   GLY  55          1HA       GLY  55  -7.123 -13.126   2.195
  406   2HA   GLY  55          2HA       GLY  55  -8.084 -12.519   0.834
  407    H    LYS  56           HN       LYS  56  -6.751 -13.467  -0.736
  408    HA   LYS  56           HA       LYS  56  -3.859 -13.166  -0.733
  409   1HB   LYS  56          1HB       LYS  56  -4.101 -14.431  -2.932
  410   2HB   LYS  56          2HB       LYS  56  -4.578 -15.213  -1.446
  411   1HG   LYS  56          1HG       LYS  56  -6.104 -15.797  -3.208
  412   2HG   LYS  56          2HG       LYS  56  -6.941 -14.981  -1.912
  413   1HD   LYS  56          2HD       LYS  56  -7.867 -14.123  -3.918
  414   2HD   LYS  56          1HD       LYS  56  -6.793 -12.836  -3.372
  415   1HE   LYS  56          1HE       LYS  56  -5.015 -13.897  -4.966
  416   2HE   LYS  56          2HE       LYS  56  -6.327 -14.909  -5.576
  417   1HZ   LYS  56          1HZ       LYS  56  -7.497 -12.873  -6.142
  418   2HZ   LYS  56          3HZ       LYS  56  -6.190 -11.984  -5.639
  419   3HZ   LYS  56          2HZ       LYS  56  -6.060 -13.045  -6.908
  420    H    VAL  57           HN       VAL  57  -4.543 -10.694  -0.610
  421    HA   VAL  57           HA       VAL  57  -3.828  -9.530  -3.245
  422    HB   VAL  57           HB       VAL  57  -5.772  -8.378  -1.203
  423   1HG1  VAL  57          2HG22     VAL  57  -4.478  -6.666  -2.549
  424   2HG1  VAL  57          3HG23     VAL  57  -5.211  -7.333  -4.012
  425   3HG1  VAL  57          1HG21     VAL  57  -6.236  -6.622  -2.774
  426   1HG2  VAL  57          3HG13     VAL  57  -6.327  -9.684  -3.899
  427   2HG2  VAL  57          1HG11     VAL  57  -6.941 -10.184  -2.310
  428   3HG2  VAL  57          2HG12     VAL  57  -7.501  -8.675  -3.039
  429    H    ILE  58           HN       ILE  58  -2.206  -7.880  -3.041
  430    HA   ILE  58           HA       ILE  58  -0.997  -7.721  -0.274
  431    HB   ILE  58           HB       ILE  58   0.298  -7.801  -3.016
  432   1HG1  ILE  58          1HG11     ILE  58  -0.428  -9.995  -2.452
  433   2HG1  ILE  58          2HG12     ILE  58   1.327  -9.869  -2.397
  434   1HG2  ILE  58          1HG21     ILE  58   1.500  -7.382  -0.276
  435   2HG2  ILE  58          2HG22     ILE  58   2.448  -7.862  -1.697
  436   3HG2  ILE  58          3HG23     ILE  58   1.594  -6.315  -1.673
  437   1HD1  ILE  58          2HD12     ILE  58  -0.425  -9.850   0.095
  438   2HD1  ILE  58          3HD13     ILE  58   0.371 -11.269  -0.601
  439   3HD1  ILE  58          1HD11     ILE  58   1.358  -9.932  -0.011
  440    H    PHE  59           HN       PHE  59  -0.617  -5.663   0.548
  441    HA   PHE  59           HA       PHE  59  -1.156  -3.347  -1.298
  442   1HB   PHE  59          2HB       PHE  59  -2.158  -3.769   1.511
  443   2HB   PHE  59          1HB       PHE  59  -2.109  -2.222   0.719
  444    HD1  PHE  59           HD1      PHE  59  -3.540  -5.671   0.324
  445    HD2  PHE  59           HD2      PHE  59  -3.920  -1.468  -0.573
  446    HE1  PHE  59           HE1      PHE  59  -5.813  -6.043  -0.496
  447    HE2  PHE  59           HE2      PHE  59  -6.160  -1.859  -1.499
  448    HZ   PHE  59           HZ       PHE  59  -7.181  -4.104  -1.373
  449    H    LEU  60           HN       LEU  60   0.677  -2.336  -1.543
  450    HA   LEU  60           HA       LEU  60   2.569  -1.994   0.745
  451   1HB   LEU  60          1HB       LEU  60   3.011  -1.920  -2.255
  452   2HB   LEU  60          2HB       LEU  60   4.261  -1.673  -1.018
  453    HG   LEU  60           HG       LEU  60   2.767  -4.223  -1.754
  454   1HD1  LEU  60          3HD23     LEU  60   4.692  -3.511  -3.171
  455   2HD1  LEU  60          2HD22     LEU  60   5.725  -3.481  -1.738
  456   3HD1  LEU  60          1HD21     LEU  60   5.036  -5.019  -2.296
  457   1HD2  LEU  60          3HD13     LEU  60   4.710  -3.816   0.563
  458   2HD2  LEU  60          1HD11     LEU  60   2.996  -4.276   0.700
  459   3HD2  LEU  60          2HD12     LEU  60   4.148  -5.385  -0.050
  460    H    LYS  61           HN       LYS  61   3.368   0.111   1.077
  461    HA   LYS  61           HA       LYS  61   2.130   2.321  -0.500
  462   1HB   LYS  61          2HB       LYS  61   2.859   2.333   2.452
  463   2HB   LYS  61          1HB       LYS  61   2.267   3.712   1.498
  464   1HG   LYS  61          2HG       LYS  61   0.127   2.480   1.085
  465   2HG   LYS  61          1HG       LYS  61   0.758   1.167   2.098
  466   1HD   LYS  61          1HD       LYS  61   1.003   2.861   3.976
  467   2HD   LYS  61          2HD       LYS  61   0.283   4.082   2.926
  468   1HE   LYS  61          2HE       LYS  61  -1.325   3.109   4.567
  469   2HE   LYS  61          1HE       LYS  61  -1.844   2.910   2.895
  470   1HZ   LYS  61          2HZ       LYS  61  -0.410   0.823   4.408
  471   2HZ   LYS  61          3HZ       LYS  61  -2.051   0.915   4.344
  472   3HZ   LYS  61          1HZ       LYS  61  -1.176   0.654   2.969
  473    H    VAL  62           HN       VAL  62   3.590   3.919  -1.087
  474    HA   VAL  62           HA       VAL  62   6.459   3.531  -0.367
  475    HB   VAL  62           HB       VAL  62   5.382   3.647  -3.232
  476   1HG1  VAL  62          2HG12     VAL  62   8.229   3.672  -2.152
  477   2HG1  VAL  62          1HG11     VAL  62   7.791   3.487  -3.859
  478   3HG1  VAL  62          3HG13     VAL  62   7.445   5.009  -3.027
  479   1HG2  VAL  62          3HG23     VAL  62   6.971   1.513  -1.741
  480   2HG2  VAL  62          2HG22     VAL  62   5.272   1.386  -2.239
  481   3HG2  VAL  62          1HG21     VAL  62   6.540   1.488  -3.464
  482    H    ASP  63           HN       ASP  63   7.351   5.410   0.217
  483    HA   ASP  63           HA       ASP  63   5.797   7.860  -0.090
  484   1HB   ASP  63          1HB       ASP  63   6.754   7.635   2.032
  485   2HB   ASP  63          2HB       ASP  63   8.344   7.240   1.399
  486    H    VAL  64           HN       VAL  64   5.970   9.074  -1.841
  487    HA   VAL  64           HA       VAL  64   8.195   8.902  -3.734
  488    HB   VAL  64           HB       VAL  64   5.795  10.786  -3.653
  489   1HG1  VAL  64          1HG21     VAL  64   7.806  10.105  -5.848
  490   2HG1  VAL  64          2HG22     VAL  64   6.286  10.970  -6.123
  491   3HG1  VAL  64          3HG23     VAL  64   7.541  11.698  -5.121
  492   1HG2  VAL  64          1HG11     VAL  64   6.248   8.152  -5.129
  493   2HG2  VAL  64          3HG13     VAL  64   5.103   8.407  -3.804
  494   3HG2  VAL  64          2HG12     VAL  64   4.858   9.229  -5.348
  495    H    ASP  65           HN       ASP  65   9.662   9.301  -1.993
  496    HA   ASP  65           HA       ASP  65  11.090  11.701  -2.230
  497   1HB   ASP  65          1HB       ASP  65   9.610  12.923  -0.884
  498   2HB   ASP  65          2HB       ASP  65   9.324  11.591   0.239
  499    H    ALA  66           HN       ALA  66  10.396   9.624   0.662
  500    HA   ALA  66           HA       ALA  66  13.040   8.887   1.159
  501   1HB   ALA  66          2HB       ALA  66  11.129   8.450   2.693
  502   2HB   ALA  66          3HB       ALA  66  10.565   7.164   1.598
  503   3HB   ALA  66          1HB       ALA  66  12.123   7.006   2.424
  504    H    VAL  67           HN       VAL  67  10.675   7.348  -1.086
  505    HA   VAL  67           HA       VAL  67  12.948   5.734  -2.207
  506    HB   VAL  67           HB       VAL  67  10.060   5.006  -2.607
  507   1HG1  VAL  67          1HG21     VAL  67  12.101   3.957  -3.784
  508   2HG1  VAL  67          3HG23     VAL  67  12.542   3.266  -2.226
  509   3HG1  VAL  67          2HG22     VAL  67  10.998   2.816  -2.984
  510   1HG2  VAL  67          1HG11     VAL  67  11.713   4.245  -0.162
  511   2HG2  VAL  67          3HG13     VAL  67  10.135   5.075  -0.164
  512   3HG2  VAL  67          2HG12     VAL  67  10.252   3.391  -0.692
  513    H    ALA  68           HN       ALA  68  12.546   8.490  -2.814
  514    HA   ALA  68           HA       ALA  68  11.004   9.189  -4.970
  515   1HB   ALA  68          3HB       ALA  68  13.907   9.943  -4.397
  516   2HB   ALA  68          2HB       ALA  68  12.862  10.768  -5.573
  517   3HB   ALA  68          1HB       ALA  68  12.445  10.799  -3.859
  518    H    ALA  69           HN       ALA  69  14.233   7.620  -5.218
  519    HA   ALA  69           HA       ALA  69  14.561   7.659  -7.973
  520   1HB   ALA  69          2HB       ALA  69  16.278   6.907  -6.376
  521   2HB   ALA  69          3HB       ALA  69  15.339   5.437  -6.028
  522   3HB   ALA  69          1HB       ALA  69  16.026   5.694  -7.645
  523    H    VAL  70           HN       VAL  70  12.767   5.199  -6.070
  524    HA   VAL  70           HA       VAL  70  12.237   3.470  -8.330
  525    HB   VAL  70           HB       VAL  70  10.874   3.731  -5.619
  526   1HG1  VAL  70          2HG22     VAL  70   9.417   2.524  -7.220
  527   2HG1  VAL  70          1HG21     VAL  70  10.757   1.422  -7.596
  528   3HG1  VAL  70          3HG23     VAL  70  10.064   1.470  -5.960
  529   1HG2  VAL  70          2HG12     VAL  70  13.321   3.128  -5.513
  530   2HG2  VAL  70          3HG13     VAL  70  12.289   1.766  -5.040
  531   3HG2  VAL  70          1HG11     VAL  70  13.019   1.811  -6.659
  532    H    ALA  71           HN       ALA  71  10.406   5.992  -6.593
  533    HA   ALA  71           HA       ALA  71   8.018   5.863  -8.152
  534   1HB   ALA  71          1HB       ALA  71   8.265   7.144  -6.034
  535   2HB   ALA  71          2HB       ALA  71   9.279   8.334  -6.878
  536   3HB   ALA  71          3HB       ALA  71   7.582   8.125  -7.348
  537    H    GLU  72           HN       GLU  72  11.012   7.763  -8.651
  538    HA   GLU  72           HA       GLU  72  10.325   9.067 -11.018
  539   1HB   GLU  72          1HB       GLU  72  12.646   8.760  -9.389
  540   2HB   GLU  72          2HB       GLU  72  13.150   8.161 -10.969
  541   1HG   GLU  72          1HG       GLU  72  12.308  10.232 -12.008
  542   2HG   GLU  72          2HG       GLU  72  11.781  10.796 -10.393
  543    H    ALA  73           HN       ALA  73  12.155   5.983 -10.662
  544    HA   ALA  73           HA       ALA  73  12.307   5.374 -13.389
  545   1HB   ALA  73          1HB       ALA  73  13.595   4.218 -11.614
  546   2HB   ALA  73          3HB       ALA  73  12.106   3.456 -11.012
  547   3HB   ALA  73          2HB       ALA  73  12.725   3.045 -12.625
  548    H    ALA  74           HN       ALA  74   9.743   4.554 -11.039
  549    HA   ALA  74           HA       ALA  74   8.144   2.991 -12.839
  550   1HB   ALA  74          3HB       ALA  74   8.021   2.825 -10.384
  551   2HB   ALA  74          1HB       ALA  74   7.408   4.488 -10.287
  552   3HB   ALA  74          2HB       ALA  74   6.441   3.222 -11.071
  553    H    GLY  75           HN       GLY  75   8.645   6.446 -12.597
  554   1HA   GLY  75          1HA       GLY  75   7.841   8.108 -13.930
  555   2HA   GLY  75          2HA       GLY  75   6.832   6.928 -14.789
  556    H    ILE  76           HN       ILE  76   6.909   7.810 -11.290
  557    HA   ILE  76           HA       ILE  76   3.997   8.078 -11.268
  558    HB   ILE  76           HB       ILE  76   6.094   8.763  -9.161
  559   1HG1  ILE  76          1HG11     ILE  76   6.112   6.381  -9.808
  560   2HG1  ILE  76          2HG12     ILE  76   5.572   6.619  -8.150
  561   1HG2  ILE  76          1HG21     ILE  76   3.060   8.539  -9.020
  562   2HG2  ILE  76          3HG23     ILE  76   4.114   8.516  -7.588
  563   3HG2  ILE  76          2HG22     ILE  76   4.068   9.940  -8.635
  564   1HD1  ILE  76          3HD13     ILE  76   3.744   6.083 -10.540
  565   2HD1  ILE  76          2HD12     ILE  76   4.323   4.884  -9.396
  566   3HD1  ILE  76          1HD11     ILE  76   3.261   6.181  -8.829
  567    H    THR  77           HN       THR  77   2.768   9.876 -11.276
  568    HA   THR  77           HA       THR  77   4.113  12.516 -11.747
  569    HB   THR  77           HB       THR  77   2.187  12.917 -13.305
  570    HG1  THR  77           HG1      THR  77   1.166  10.877 -14.001
  571   1HG2  THR  77          1HG21     THR  77   4.422  12.146 -14.134
  572   2HG2  THR  77          2HG22     THR  77   3.862  10.464 -14.029
  573   3HG2  THR  77          3HG23     THR  77   3.081  11.590 -15.153
  574    H    ALA  78           HN       ALA  78   0.691  11.729 -11.499
  575    HA   ALA  78           HA       ALA  78   0.345  13.888  -9.482
  576   1HB   ALA  78          1HB       ALA  78  -1.657  12.303 -11.134
  577   2HB   ALA  78          2HB       ALA  78  -2.043  13.641 -10.032
  578   3HB   ALA  78          3HB       ALA  78  -1.048  13.934 -11.473
  579    H    MET  79           HN       MET  79   1.241  12.806  -7.639
  580    HA   MET  79           HA       MET  79   0.333  10.325  -6.622
  581   1HB   MET  79          2HB       MET  79   1.404  12.751  -5.121
  582   2HB   MET  79          1HB       MET  79   1.121  11.157  -4.415
  583   1HG   MET  79          1HG       MET  79   3.400  11.158  -4.853
  584   2HG   MET  79          2HG       MET  79   2.687  10.182  -6.137
  585   1HE   MET  79          3HE       MET  79   3.454  13.973  -5.352
  586   2HE   MET  79          1HE       MET  79   5.046  13.166  -5.273
  587   3HE   MET  79          2HE       MET  79   4.693  14.314  -6.581
  588    HA   PRO  80           HA       PRO  80  -0.576   9.303  -4.440
  589   1HB   PRO  80          2HB       PRO  80  -3.464   8.473  -4.732
  590   2HB   PRO  80          1HB       PRO  80  -2.321   8.035  -3.436
  591   1HG   PRO  80          1HG       PRO  80  -4.204   9.919  -3.009
  592   2HG   PRO  80          2HG       PRO  80  -2.528  10.229  -2.463
  593   1HD   PRO  80          2HD       PRO  80  -3.873  11.195  -5.017
  594   2HD   PRO  80          1HD       PRO  80  -2.915  12.136  -3.847
  595    H    THR  81           HN       THR  81  -0.159   7.307  -5.626
  596    HA   THR  81           HA       THR  81  -1.611   6.945  -8.184
  597    HB   THR  81           HB       THR  81   1.380   7.357  -7.926
  598    HG1  THR  81           HG1      THR  81  -0.598   9.038  -8.463
  599   1HG2  THR  81          2HG22     THR  81  -0.323   6.414 -10.284
  600   2HG2  THR  81          3HG23     THR  81   1.343   7.010 -10.442
  601   3HG2  THR  81          1HG21     THR  81   1.013   5.543  -9.505
  602    H    PHE  82           HN       PHE  82  -2.324   4.989  -8.127
  603    HA   PHE  82           HA       PHE  82  -1.035   2.931  -6.458
  604   1HB   PHE  82          2HB       PHE  82  -3.696   2.933  -7.873
  605   2HB   PHE  82          1HB       PHE  82  -3.131   1.774  -6.680
  606    HD1  PHE  82           HD2      PHE  82  -2.583   2.632  -4.318
  607    HD2  PHE  82           HD1      PHE  82  -4.654   5.061  -7.215
  608    HE1  PHE  82           HE2      PHE  82  -3.241   4.236  -2.528
  609    HE2  PHE  82           HE1      PHE  82  -5.204   6.691  -5.451
  610    HZ   PHE  82           HZ       PHE  82  -4.482   6.272  -3.094
  611    H    HIS  83           HN       HIS  83   0.382   1.525  -7.501
  612    HA   HIS  83           HA       HIS  83  -0.119   0.890 -10.421
  613   1HB   HIS  83          1HB       HIS  83   2.369   0.877  -8.704
  614   2HB   HIS  83          2HB       HIS  83   2.238   0.012 -10.248
  615    HD2  HIS  83           HD2      HIS  83   0.552   3.391 -10.606
  616    HE1  HIS  83           HE1      HIS  83   4.439   3.666 -12.229
  617    HE2  HIS  83           HE2      HIS  83   2.172   4.808 -12.104
  618    H    VAL  84           HN       VAL  84  -0.619  -1.254 -10.949
  619    HA   VAL  84           HA       VAL  84  -0.681  -3.185  -8.675
  620    HB   VAL  84           HB       VAL  84  -2.082  -3.444 -11.349
  621   1HG1  VAL  84          2HG22     VAL  84  -1.709  -5.515  -9.997
  622   2HG1  VAL  84          3HG23     VAL  84  -2.466  -4.728  -8.597
  623   3HG1  VAL  84          1HG21     VAL  84  -3.426  -5.073 -10.050
  624   1HG2  VAL  84          2HG12     VAL  84  -3.134  -2.273  -8.736
  625   2HG2  VAL  84          3HG13     VAL  84  -2.991  -1.422 -10.291
  626   3HG2  VAL  84          1HG11     VAL  84  -4.140  -2.754 -10.119
  627    H    TYR  85           HN       TYR  85   1.173  -4.401  -8.599
  628    HA   TYR  85           HA       TYR  85   2.577  -5.031 -11.180
  629   1HB   TYR  85          1HB       TYR  85   3.657  -4.870  -8.379
  630   2HB   TYR  85          2HB       TYR  85   4.519  -5.532  -9.753
  631    HD1  TYR  85           HD1      TYR  85   5.303  -4.099 -11.599
  632    HD2  TYR  85           HD2      TYR  85   3.280  -2.471  -8.171
  633    HE1  TYR  85           HE1      TYR  85   6.190  -1.840 -12.144
  634    HE2  TYR  85           HE2      TYR  85   4.329  -0.268  -8.604
  635    HH   TYR  85           HH       TYR  85   5.002   1.034 -10.662
  636    H    LYS  86           HN       LYS  86   1.635  -6.912 -11.888
  637    HA   LYS  86           HA       LYS  86   1.428  -9.263 -10.027
  638   1HB   LYS  86          2HB       LYS  86   0.465  -8.711 -12.867
  639   2HB   LYS  86          1HB       LYS  86   0.379 -10.311 -12.112
  640   1HG   LYS  86          2HG       LYS  86  -0.995  -9.516 -10.315
  641   2HG   LYS  86          1HG       LYS  86  -0.937  -7.852 -10.928
  642   1HD   LYS  86          1HD       LYS  86  -2.125  -8.438 -12.933
  643   2HD   LYS  86          2HD       LYS  86  -1.969 -10.178 -12.627
  644   1HE   LYS  86          1HE       LYS  86  -3.435  -8.327 -10.718
  645   2HE   LYS  86          2HE       LYS  86  -4.247  -9.095 -12.091
  646   1HZ   LYS  86          1HZ       LYS  86  -2.855 -10.578  -9.964
  647   2HZ   LYS  86          2HZ       LYS  86  -4.493 -10.358 -10.094
  648   3HZ   LYS  86          3HZ       LYS  86  -3.672 -11.214 -11.234
  649    H    ASP  87           HN       ASP  87   2.064 -11.293 -11.876
  650    HA   ASP  87           HA       ASP  87   4.956 -11.125 -12.163
  651   1HB   ASP  87          1HB       ASP  87   4.683 -13.261 -13.350
  652   2HB   ASP  87          2HB       ASP  87   3.936 -13.110 -11.757
  653    H    GLY  88           HN       GLY  88   2.089 -10.958 -14.099
  654   1HA   GLY  88          1HA       GLY  88   3.357  -9.935 -16.553
  655   2HA   GLY  88          2HA       GLY  88   1.632  -9.826 -16.150
  656    H    VAL  89           HN       VAL  89   4.482  -8.702 -14.390
  657    HA   VAL  89           HA       VAL  89   4.536  -6.869 -12.871
  658    HB   VAL  89           HB       VAL  89   6.164  -5.604 -13.994
  659   1HG1  VAL  89          2HG12     VAL  89   6.330  -8.145 -13.261
  660   2HG1  VAL  89          1HG11     VAL  89   6.417  -8.467 -14.989
  661   3HG1  VAL  89          3HG13     VAL  89   7.640  -7.465 -14.223
  662   1HG2  VAL  89          1HG21     VAL  89   5.058  -5.291 -16.253
  663   2HG2  VAL  89          2HG22     VAL  89   6.698  -5.944 -16.382
  664   3HG2  VAL  89          3HG23     VAL  89   5.298  -7.011 -16.583
  665    H    LYS  90           HN       LYS  90   4.630  -4.292 -14.478
  666    HA   LYS  90           HA       LYS  90   2.476  -3.041 -13.142
  667   1HB   LYS  90          2HB       LYS  90   4.585  -2.000 -14.039
  668   2HB   LYS  90          1HB       LYS  90   3.889  -2.064 -15.664
  669   1HG   LYS  90          1HG       LYS  90   1.941  -0.685 -14.769
  670   2HG   LYS  90          2HG       LYS  90   2.813  -0.531 -13.241
  671   1HD   LYS  90          1HD       LYS  90   3.768   0.429 -15.982
  672   2HD   LYS  90          2HD       LYS  90   3.071   1.435 -14.706
  673   1HE   LYS  90          2HE       LYS  90   4.964   0.822 -13.196
  674   2HE   LYS  90          1HE       LYS  90   5.713  -0.082 -14.528
  675   1HZ   LYS  90          1HZ       LYS  90   5.761   1.969 -15.777
  676   2HZ   LYS  90          3HZ       LYS  90   5.159   2.800 -14.486
  677   3HZ   LYS  90          2HZ       LYS  90   6.624   2.075 -14.379
  678    H    ALA  91           HN       ALA  91   0.782  -4.566 -13.617
  679    HA   ALA  91           HA       ALA  91  -0.235  -4.930 -16.289
  680   1HB   ALA  91          1HB       ALA  91  -0.377  -6.652 -14.524
  681   2HB   ALA  91          3HB       ALA  91  -1.442  -5.599 -13.565
  682   3HB   ALA  91          2HB       ALA  91  -1.991  -6.232 -15.133
  683    H    ASP  92           HN       ASP  92  -0.946  -2.680 -13.666
  684    HA   ASP  92           HA       ASP  92  -2.756  -1.168 -15.353
  685   1HB   ASP  92          2HB       ASP  92  -4.038  -3.120 -14.167
  686   2HB   ASP  92          1HB       ASP  92  -3.882  -2.161 -12.698
  687    H    ASP  93           HN       ASP  93  -3.356   0.879 -14.192
  688    HA   ASP  93           HA       ASP  93  -1.788   1.555 -11.840
  689   1HB   ASP  93          1HB       ASP  93  -1.373   3.182 -14.365
  690   2HB   ASP  93          2HB       ASP  93  -0.608   3.441 -12.805
  691    H    LEU  94           HN       LEU  94  -2.485   3.604 -10.990
  692    HA   LEU  94           HA       LEU  94  -4.751   4.998 -12.285
  693   1HB   LEU  94          2HB       LEU  94  -5.828   3.127 -11.184
  694   2HB   LEU  94          1HB       LEU  94  -4.953   3.434  -9.685
  695    HG   LEU  94           HG       LEU  94  -6.157   5.565  -9.381
  696   1HD1  LEU  94          3HD23     LEU  94  -7.500   4.783 -12.006
  697   2HD1  LEU  94          2HD22     LEU  94  -8.145   6.015 -10.902
  698   3HD1  LEU  94          1HD21     LEU  94  -6.579   6.266 -11.670
  699   1HD2  LEU  94          1HD11     LEU  94  -7.042   3.384  -8.514
  700   2HD2  LEU  94          3HD13     LEU  94  -8.294   4.590  -8.804
  701   3HD2  LEU  94          2HD12     LEU  94  -8.071   3.269  -9.959
  702    H    VAL  95           HN       VAL  95  -4.046   7.053 -12.155
  703    HA   VAL  95           HA       VAL  95  -2.428   8.011  -9.902
  704    HB   VAL  95           HB       VAL  95  -2.310  10.082 -11.204
  705   1HG1  VAL  95          1HG11     VAL  95  -0.628   8.372 -11.593
  706   2HG1  VAL  95          3HG13     VAL  95  -1.641   7.600 -12.834
  707   3HG1  VAL  95          2HG12     VAL  95  -0.992   9.231 -13.093
  708   1HG2  VAL  95          3HG23     VAL  95  -4.535   9.996 -12.330
  709   2HG2  VAL  95          1HG21     VAL  95  -3.198  10.269 -13.454
  710   3HG2  VAL  95          2HG22     VAL  95  -3.949   8.669 -13.357
  711    H    GLY  96           HN       GLY  96  -3.024  10.099  -8.838
  712   1HA   GLY  96          1HA       GLY  96  -4.474  11.650  -7.953
  713   2HA   GLY  96          2HA       GLY  96  -5.800  11.017  -8.953
  714    H    ALA  97           HN       ALA  97  -6.624  11.603  -6.594
  715    HA   ALA  97           HA       ALA  97  -6.221   9.949  -4.386
  716   1HB   ALA  97          3HB       ALA  97  -8.762  11.370  -5.341
  717   2HB   ALA  97          1HB       ALA  97  -8.527  10.723  -3.710
  718   3HB   ALA  97          2HB       ALA  97  -7.499  12.043  -4.293
  719    H    SER  98           HN       SER  98  -8.712   9.691  -6.841
  720    HA   SER  98           HA       SER  98 -10.278   8.095  -7.367
  721   1HB   SER  98          2HB       SER  98  -7.571   6.859  -7.968
  722   2HB   SER  98          1HB       SER  98  -9.055   6.767  -8.956
  723    HG   SER  98           HG       SER  98  -7.259   8.466  -9.397
  724    H    GLN  99           HN       GLN  99  -9.263   7.262  -4.449
  725    HA   GLN  99           HA       GLN  99  -9.067   4.568  -4.221
  726   1HB   GLN  99          1HB       GLN  99 -10.085   4.721  -2.020
  727   2HB   GLN  99          2HB       GLN  99  -8.946   6.029  -2.317
  728   1HG   GLN  99          2HG       GLN  99 -11.992   6.265  -2.401
  729   2HG   GLN  99          1HG       GLN  99 -10.946   6.761  -1.079
  730   1HE2  GLN  99          1HE21     GLN  99 -11.761   9.605  -3.591
  731   2HE2  GLN  99          2HE22     GLN  99 -12.794   8.250  -3.148
  732    H    ASP 100           HN       ASP 100 -12.171   6.280  -4.756
  733    HA   ASP 100           HA       ASP 100 -13.899   4.082  -4.488
  734   1HB   ASP 100          2HB       ASP 100 -14.061   6.532  -6.297
  735   2HB   ASP 100          1HB       ASP 100 -15.377   5.370  -6.074
  736    H    LYS 101           HN       LYS 101 -11.776   4.948  -7.222
  737    HA   LYS 101           HA       LYS 101 -12.996   2.880  -8.948
  738   1HB   LYS 101          1HB       LYS 101 -12.190   5.092  -9.805
  739   2HB   LYS 101          2HB       LYS 101 -10.528   4.589  -9.447
  740   1HG   LYS 101          1HG       LYS 101 -10.861   2.590 -10.934
  741   2HG   LYS 101          2HG       LYS 101 -12.495   3.153 -11.306
  742   1HD   LYS 101          2HD       LYS 101  -9.904   4.642 -11.928
  743   2HD   LYS 101          1HD       LYS 101 -10.848   3.684 -13.074
  744   1HE   LYS 101          1HE       LYS 101 -12.804   5.229 -12.697
  745   2HE   LYS 101          2HE       LYS 101 -11.760   6.249 -11.687
  746   1HZ   LYS 101          3HZ       LYS 101 -10.330   6.553 -13.563
  747   2HZ   LYS 101          1HZ       LYS 101 -11.303   5.615 -14.509
  748   3HZ   LYS 101          2HZ       LYS 101 -11.865   7.043 -13.908
  749    H    LEU 102           HN       LEU 102 -10.079   3.495  -6.974
  750    HA   LEU 102           HA       LEU 102  -8.466   1.337  -7.584
  751   1HB   LEU 102          2HB       LEU 102  -8.071   3.122  -5.761
  752   2HB   LEU 102          1HB       LEU 102  -9.127   2.170  -4.732
  753    HG   LEU 102           HG       LEU 102  -7.592   0.209  -4.987
  754   1HD1  LEU 102          2HD22     LEU 102  -5.867   2.334  -6.325
  755   2HD1  LEU 102          1HD21     LEU 102  -5.200   0.864  -5.600
  756   3HD1  LEU 102          3HD23     LEU 102  -6.297   0.740  -6.984
  757   1HD2  LEU 102          1HD11     LEU 102  -7.621   1.837  -3.049
  758   2HD2  LEU 102          3HD13     LEU 102  -6.085   1.013  -3.353
  759   3HD2  LEU 102          2HD12     LEU 102  -6.308   2.716  -3.858
  760    H    LYS 103           HN       LYS 103 -11.176   1.373  -5.260
  761    HA   LYS 103           HA       LYS 103 -11.316  -1.207  -4.330
  762   1HB   LYS 103          1HB       LYS 103 -13.581   0.552  -5.363
  763   2HB   LYS 103          2HB       LYS 103 -13.803  -0.925  -4.431
  764   1HG   LYS 103          1HG       LYS 103 -12.671   0.030  -2.496
  765   2HG   LYS 103          2HG       LYS 103 -12.247   1.471  -3.403
  766   1HD   LYS 103          1HD       LYS 103 -14.148   1.978  -2.003
  767   2HD   LYS 103          2HD       LYS 103 -14.641   2.028  -3.698
  768   1HE   LYS 103          2HE       LYS 103 -16.334   0.948  -2.266
  769   2HE   LYS 103          1HE       LYS 103 -15.739  -0.155  -3.508
  770   1HZ   LYS 103          2HZ       LYS 103 -14.848  -0.097  -0.704
  771   2HZ   LYS 103          1HZ       LYS 103 -15.897  -1.187  -1.358
  772   3HZ   LYS 103          3HZ       LYS 103 -14.330  -1.155  -1.857
  773    H    ALA 104           HN       ALA 104 -12.636  -0.114  -7.459
  774    HA   ALA 104           HA       ALA 104 -13.657  -2.696  -8.252
  775   1HB   ALA 104          2HB       ALA 104 -14.620  -0.554  -9.041
  776   2HB   ALA 104          1HB       ALA 104 -13.109  -0.183  -9.900
  777   3HB   ALA 104          3HB       ALA 104 -14.088  -1.578 -10.389
  778    H    LEU 105           HN       LEU 105 -10.679  -0.792  -8.991
  779    HA   LEU 105           HA       LEU 105  -9.678  -2.647 -10.953
  780   1HB   LEU 105          1HB       LEU 105  -8.124  -0.855  -9.029
  781   2HB   LEU 105          2HB       LEU 105  -7.446  -1.745 -10.389
  782    HG   LEU 105           HG       LEU 105  -9.409   0.573 -10.509
  783   1HD1  LEU 105          3HD13     LEU 105  -7.001   1.086 -10.140
  784   2HD1  LEU 105          1HD11     LEU 105  -6.587   0.177 -11.607
  785   3HD1  LEU 105          2HD12     LEU 105  -7.569   1.649 -11.730
  786   1HD2  LEU 105          2HD22     LEU 105  -8.435  -1.226 -12.772
  787   2HD2  LEU 105          3HD23     LEU 105 -10.122  -0.918 -12.292
  788   3HD2  LEU 105          1HD21     LEU 105  -9.163   0.374 -13.013
  789    H    VAL 106           HN       VAL 106  -9.141  -2.481  -7.390
  790    HA   VAL 106           HA       VAL 106  -7.504  -4.810  -7.302
  791    HB   VAL 106           HB       VAL 106  -9.407  -3.772  -5.152
  792   1HG1  VAL 106          1HG21     VAL 106  -6.943  -5.584  -4.991
  793   2HG1  VAL 106          3HG23     VAL 106  -7.876  -4.979  -3.609
  794   3HG1  VAL 106          2HG22     VAL 106  -8.610  -6.124  -4.738
  795   1HG2  VAL 106          2HG12     VAL 106  -6.459  -3.247  -5.712
  796   2HG2  VAL 106          1HG11     VAL 106  -7.754  -2.056  -5.818
  797   3HG2  VAL 106          3HG13     VAL 106  -7.325  -2.730  -4.243
  798    H    ALA 107           HN       ALA 107 -11.035  -4.455  -6.958
  799    HA   ALA 107           HA       ALA 107 -11.724  -7.145  -6.600
  800   1HB   ALA 107          1HB       ALA 107 -13.382  -5.259  -6.586
  801   2HB   ALA 107          2HB       ALA 107 -13.284  -5.186  -8.352
  802   3HB   ALA 107          3HB       ALA 107 -13.899  -6.641  -7.563
  803    H    LYS 108           HN       LYS 108 -11.387  -5.451  -9.740
  804    HA   LYS 108           HA       LYS 108 -11.783  -7.639 -11.479
  805   1HB   LYS 108          2HB       LYS 108 -11.777  -5.354 -12.228
  806   2HB   LYS 108          1HB       LYS 108 -10.124  -5.088 -11.677
  807   1HG   LYS 108          2HG       LYS 108  -9.329  -6.775 -13.401
  808   2HG   LYS 108          1HG       LYS 108 -10.983  -6.796 -14.031
  809   1HD   LYS 108          2HD       LYS 108  -9.096  -4.396 -13.804
  810   2HD   LYS 108          1HD       LYS 108  -9.491  -5.281 -15.283
  811   1HE   LYS 108          1HE       LYS 108 -11.892  -4.574 -15.024
  812   2HE   LYS 108          2HE       LYS 108 -11.423  -3.596 -13.617
  813   1HZ   LYS 108          1HZ       LYS 108  -9.955  -2.364 -15.024
  814   2HZ   LYS 108          3HZ       LYS 108 -10.397  -3.254 -16.339
  815   3HZ   LYS 108          2HZ       LYS 108 -11.502  -2.293 -15.584
  816    H    HIS 109           HN       HIS 109  -8.659  -6.235 -10.408
  817    HA   HIS 109           HA       HIS 109  -7.078  -8.278 -11.627
  818   1HB   HIS 109          1HB       HIS 109  -6.529  -6.106  -9.574
  819   2HB   HIS 109          2HB       HIS 109  -5.286  -7.233 -10.112
  820    HD2  HIS 109           HD2      HIS 109  -7.363  -4.261 -11.640
  821    HE1  HIS 109           HE1      HIS 109  -4.575  -5.583 -14.509
  822    HE2  HIS 109           HE2      HIS 109  -6.264  -3.744 -13.932
  823    H    ALA 110           HN       ALA 110  -8.709  -8.271  -8.502
  824    HA   ALA 110           HA       ALA 110  -7.104 -10.467  -7.452
  825   1HB   ALA 110          1HB       ALA 110  -8.220  -8.826  -5.971
  826   2HB   ALA 110          2HB       ALA 110  -9.806  -9.344  -6.590
  827   3HB   ALA 110          3HB       ALA 110  -8.797 -10.472  -5.661
  828    H    ALA 111           HN       ALA 111  -9.429 -10.435  -9.970
  829    HA   ALA 111           HA       ALA 111 -10.703 -12.962  -9.241
  830   1HB   ALA 111          2HB       ALA 111 -11.802 -11.199 -10.606
  831   2HB   ALA 111          3HB       ALA 111 -10.610 -11.473 -11.896
  832   3HB   ALA 111          1HB       ALA 111 -11.736 -12.767 -11.435
  833    H    ALA 112           HN       ALA 112  -8.008 -13.478  -8.937
  834    HA   ALA 112           HA       ALA 112  -7.542 -15.717 -10.607
  835   1HB   ALA 112          2HB       ALA 112  -5.796 -13.253 -11.105
  836   2HB   ALA 112          1HB       ALA 112  -5.415 -14.903 -11.639
  837   3HB   ALA 112          3HB       ALA 112  -6.822 -14.064 -12.312
   
  No H/Q in entry =         837
  Start of MODEL   20
    1   1H    GLY   1          2HN       GLY   1  -1.642  -8.935   2.250
    2   2H    GLY   1          1HN       GLY   1  -2.819  -9.921   1.655
    3   3H    GLY   1          3HN       GLY   1  -2.953  -9.399   3.173
    4   1HA   GLY   1          1HA       GLY   1  -2.300 -11.622   3.333
    5   2HA   GLY   1          2HA       GLY   1  -1.015 -11.334   2.144
    6    H    GLY   2           HN       GLY   2  -2.153 -10.046   5.345
    7   1HA   GLY   2          1HA       GLY   2  -0.932  -9.541   7.239
    8   2HA   GLY   2          2HA       GLY   2   0.525 -10.237   6.499
    9    H    SER   3           HN       SER   3   1.185  -8.899   4.390
   10    HA   SER   3           HA       SER   3   1.974  -6.303   5.086
   11   1HB   SER   3          2HB       SER   3   1.631  -7.523   2.326
   12   2HB   SER   3          1HB       SER   3   2.744  -6.215   2.779
   13    HG   SER   3           HG       SER   3   3.993  -7.700   3.820
   14    H    VAL   4           HN       VAL   4   0.109  -5.093   5.767
   15    HA   VAL   4           HA       VAL   4  -1.215  -3.713   3.524
   16    HB   VAL   4           HB       VAL   4  -3.099  -3.429   5.094
   17   1HG1  VAL   4          3HG13     VAL   4  -3.162  -5.283   3.332
   18   2HG1  VAL   4          1HG11     VAL   4  -2.657  -6.411   4.597
   19   3HG1  VAL   4          2HG12     VAL   4  -4.206  -5.568   4.729
   20   1HG2  VAL   4          1HG21     VAL   4  -2.017  -3.836   7.211
   21   2HG2  VAL   4          3HG23     VAL   4  -3.516  -4.758   6.981
   22   3HG2  VAL   4          2HG22     VAL   4  -1.950  -5.575   6.824
   23    H    ILE   5           HN       ILE   5   1.289  -3.262   4.930
   24    HA   ILE   5           HA       ILE   5   0.759  -1.034   6.813
   25    HB   ILE   5           HB       ILE   5   3.207  -1.415   7.397
   26   1HG1  ILE   5          2HG12     ILE   5   4.265  -3.485   6.833
   27   2HG1  ILE   5          1HG11     ILE   5   2.939  -4.008   5.802
   28   1HG2  ILE   5          3HG23     ILE   5   1.317  -2.328   8.691
   29   2HG2  ILE   5          2HG22     ILE   5   1.312  -3.785   7.676
   30   3HG2  ILE   5          1HG21     ILE   5   2.712  -3.416   8.700
   31   1HD1  ILE   5          1HD11     ILE   5   4.667  -1.553   5.255
   32   2HD1  ILE   5          3HD13     ILE   5   4.985  -3.171   4.601
   33   3HD1  ILE   5          2HD12     ILE   5   3.508  -2.325   4.137
   34    H    VAL   6           HN       VAL   6   2.610   0.546   6.961
   35    HA   VAL   6           HA       VAL   6   2.952   1.952   4.393
   36    HB   VAL   6           HB       VAL   6   3.000   3.066   7.233
   37   1HG1  VAL   6          3HG23     VAL   6   2.813   4.438   4.514
   38   2HG1  VAL   6          1HG21     VAL   6   2.753   5.253   6.091
   39   3HG1  VAL   6          2HG22     VAL   6   4.232   4.428   5.581
   40   1HG2  VAL   6          2HG12     VAL   6   0.697   2.262   6.760
   41   2HG2  VAL   6          1HG11     VAL   6   0.800   4.022   6.867
   42   3HG2  VAL   6          3HG13     VAL   6   0.692   3.249   5.283
   43    H    ILE   7           HN       ILE   7   5.082   2.017   3.659
   44    HA   ILE   7           HA       ILE   7   7.203   2.446   5.563
   45    HB   ILE   7           HB       ILE   7   6.848  -0.020   5.850
   46   1HG1  ILE   7          2HG12     ILE   7   9.512   0.528   4.486
   47   2HG1  ILE   7          1HG11     ILE   7   9.090   1.148   6.092
   48   1HG2  ILE   7          3HG23     ILE   7   6.130  -0.425   3.419
   49   2HG2  ILE   7          2HG22     ILE   7   7.854  -0.342   3.000
   50   3HG2  ILE   7          1HG21     ILE   7   7.262  -1.596   4.097
   51   1HD1  ILE   7          3HD13     ILE   7   8.720  -1.149   6.910
   52   2HD1  ILE   7          2HD12     ILE   7   9.183  -1.795   5.321
   53   3HD1  ILE   7          1HD11     ILE   7  10.367  -0.910   6.295
   54    H    ASP   8           HN       ASP   8   9.219   2.942   4.516
   55    HA   ASP   8           HA       ASP   8   8.964   4.068   1.819
   56   1HB   ASP   8          2HB       ASP   8  11.267   4.882   2.349
   57   2HB   ASP   8          1HB       ASP   8  10.128   5.315   3.620
   58    H    SER   9           HN       SER   9   8.373   2.035   1.177
   59    HA   SER   9           HA       SER   9   9.577  -0.387   1.197
   60   1HB   SER   9          2HB       SER   9   7.951   0.791  -1.088
   61   2HB   SER   9          1HB       SER   9   8.090  -0.916  -0.617
   62    HG   SER   9           HG       SER   9   6.931   1.094   1.042
   63    H    LYS  10           HN       LYS  10  11.936   0.427   0.945
   64    HA   LYS  10           HA       LYS  10  12.860   0.031  -1.856
   65   1HB   LYS  10          1HB       LYS  10  13.767   1.732  -0.506
   66   2HB   LYS  10          2HB       LYS  10  14.386   0.609   0.720
   67   1HG   LYS  10          1HG       LYS  10  15.860  -0.417  -1.068
   68   2HG   LYS  10          2HG       LYS  10  15.181   0.733  -2.238
   69   1HD   LYS  10          2HD       LYS  10  16.054   2.628  -0.881
   70   2HD   LYS  10          1HD       LYS  10  16.687   1.489   0.315
   71   1HE   LYS  10          2HE       LYS  10  18.497   2.234  -1.137
   72   2HE   LYS  10          1HE       LYS  10  18.204   0.507  -1.392
   73   1HZ   LYS  10          2HZ       LYS  10  17.211   2.683  -3.104
   74   2HZ   LYS  10          3HZ       LYS  10  18.493   1.703  -3.438
   75   3HZ   LYS  10          1HZ       LYS  10  16.976   1.071  -3.361
   76    H    ALA  11           HN       ALA  11  14.629  -1.420   0.847
   77    HA   ALA  11           HA       ALA  11  14.809  -3.961  -0.408
   78   1HB   ALA  11          2HB       ALA  11  14.991  -3.263   2.563
   79   2HB   ALA  11          3HB       ALA  11  15.567  -4.762   1.806
   80   3HB   ALA  11          1HB       ALA  11  16.329  -3.214   1.391
   81    H    ALA  12           HN       ALA  12  12.526  -2.643   1.956
   82    HA   ALA  12           HA       ALA  12  11.008  -4.974   2.467
   83   1HB   ALA  12          1HB       ALA  12  10.189  -2.045   2.500
   84   2HB   ALA  12          2HB       ALA  12   9.253  -3.382   3.196
   85   3HB   ALA  12          3HB       ALA  12  10.853  -2.980   3.851
   86    H    TRP  13           HN       TRP  13  11.022  -2.825  -0.389
   87    HA   TRP  13           HA       TRP  13   8.392  -3.591  -1.370
   88   1HB   TRP  13          2HB       TRP  13   9.046  -1.684  -2.324
   89   2HB   TRP  13          1HB       TRP  13  10.747  -2.004  -2.362
   90    HD1  TRP  13           HD1      TRP  13  11.420  -3.821  -4.495
   91    HE1  TRP  13           HE1      TRP  13  10.772  -3.414  -6.943
   92    HE3  TRP  13           HE3      TRP  13   7.485  -0.651  -3.759
   93    HZ2  TRP  13           HZ2      TRP  13   8.955  -1.759  -8.381
   94    HZ3  TRP  13           HZ3      TRP  13   6.526   0.546  -5.654
   95    HH2  TRP  13           HH2      TRP  13   7.210  -0.007  -7.996
   96    H    ASP  14           HN       ASP  14  11.760  -4.634  -1.986
   97    HA   ASP  14           HA       ASP  14  11.132  -6.754  -3.783
   98   1HB   ASP  14          2HB       ASP  14  13.446  -6.562  -1.798
   99   2HB   ASP  14          1HB       ASP  14  13.342  -7.660  -3.175
  100    H    ALA  15           HN       ALA  15  11.609  -6.737  -0.265
  101    HA   ALA  15           HA       ALA  15  11.129  -9.466   0.225
  102   1HB   ALA  15          1HB       ALA  15  12.003  -7.805   1.888
  103   2HB   ALA  15          3HB       ALA  15  10.355  -7.156   2.055
  104   3HB   ALA  15          2HB       ALA  15  10.706  -8.828   2.529
  105    H    GLN  16           HN       GLN  16   8.769  -6.800   0.186
  106    HA   GLN  16           HA       GLN  16   6.458  -8.368   0.840
  107   1HB   GLN  16          2HB       GLN  16   6.981  -5.607  -0.109
  108   2HB   GLN  16          1HB       GLN  16   5.517  -6.304  -0.766
  109   1HG   GLN  16          2HG       GLN  16   5.117  -5.083   1.341
  110   2HG   GLN  16          1HG       GLN  16   4.569  -6.762   1.329
  111   1HE2  GLN  16          1HE21     GLN  16   7.960  -6.126   3.602
  112   2HE2  GLN  16          2HE22     GLN  16   7.930  -5.548   1.941
  113    H    LEU  17           HN       LEU  17   7.719  -7.253  -2.363
  114    HA   LEU  17           HA       LEU  17   5.860  -8.552  -4.001
  115   1HB   LEU  17          2HB       LEU  17   8.824  -7.948  -4.280
  116   2HB   LEU  17          1HB       LEU  17   7.952  -8.753  -5.570
  117    HG   LEU  17           HG       LEU  17   6.963  -6.115  -4.446
  118   1HD1  LEU  17          1HD21     LEU  17   8.943  -6.544  -6.728
  119   2HD1  LEU  17          2HD22     LEU  17   8.176  -5.003  -6.287
  120   3HD1  LEU  17          3HD23     LEU  17   9.301  -5.786  -5.163
  121   1HD2  LEU  17          1HD11     LEU  17   5.413  -7.434  -5.933
  122   2HD2  LEU  17          3HD13     LEU  17   5.930  -5.913  -6.674
  123   3HD2  LEU  17          2HD12     LEU  17   6.660  -7.446  -7.188
  124    H    ALA  18           HN       ALA  18   8.976  -9.870  -2.795
  125    HA   ALA  18           HA       ALA  18   8.717 -12.441  -3.876
  126   1HB   ALA  18          3HB       ALA  18  10.779 -11.538  -2.907
  127   2HB   ALA  18          1HB       ALA  18  10.066 -11.562  -1.283
  128   3HB   ALA  18          2HB       ALA  18  10.359 -13.088  -2.148
  129    H    LYS  19           HN       LYS  19   7.917 -11.551  -0.414
  130    HA   LYS  19           HA       LYS  19   6.831 -14.137   0.121
  131   1HB   LYS  19          1HB       LYS  19   5.969 -13.230   2.147
  132   2HB   LYS  19          2HB       LYS  19   7.556 -12.507   1.853
  133   1HG   LYS  19          2HG       LYS  19   6.438 -10.459   1.076
  134   2HG   LYS  19          1HG       LYS  19   4.853 -11.186   1.267
  135   1HD   LYS  19          1HD       LYS  19   5.220  -9.761   3.150
  136   2HD   LYS  19          2HD       LYS  19   5.158 -11.442   3.677
  137   1HE   LYS  19          1HE       LYS  19   6.914 -10.183   4.853
  138   2HE   LYS  19          2HE       LYS  19   7.627 -11.488   3.897
  139   1HZ   LYS  19          1HZ       LYS  19   7.466  -8.661   3.105
  140   2HZ   LYS  19          2HZ       LYS  19   8.815  -9.434   3.660
  141   3HZ   LYS  19          3HZ       LYS  19   8.151  -9.873   2.214
  142    H    GLY  20           HN       GLY  20   5.418 -11.279  -1.389
  143   1HA   GLY  20          1HA       GLY  20   2.695 -11.844  -1.122
  144   2HA   GLY  20          2HA       GLY  20   3.464 -10.928  -2.437
  145    H    LYS  21           HN       LYS  21   5.100 -13.371  -3.277
  146    HA   LYS  21           HA       LYS  21   4.879 -14.860  -5.014
  147   1HB   LYS  21          1HB       LYS  21   2.546 -15.825  -3.293
  148   2HB   LYS  21          2HB       LYS  21   3.322 -16.738  -4.597
  149   1HG   LYS  21          1HG       LYS  21   5.488 -16.655  -3.392
  150   2HG   LYS  21          2HG       LYS  21   4.727 -15.741  -2.080
  151   1HD   LYS  21          1HD       LYS  21   3.150 -17.618  -1.675
  152   2HD   LYS  21          2HD       LYS  21   3.950 -18.560  -2.954
  153   1HE   LYS  21          1HE       LYS  21   6.097 -18.434  -1.685
  154   2HE   LYS  21          2HE       LYS  21   5.288 -17.494  -0.416
  155   1HZ   LYS  21          1HZ       LYS  21   3.858 -19.363  -0.025
  156   2HZ   LYS  21          3HZ       LYS  21   4.607 -20.240  -1.204
  157   3HZ   LYS  21          2HZ       LYS  21   5.439 -19.796   0.148
  158    H    GLU  22           HN       GLU  22   4.191 -12.668  -5.836
  159    HA   GLU  22           HA       GLU  22   1.852 -11.568  -6.478
  160   1HB   GLU  22          2HB       GLU  22   4.083 -11.893  -8.490
  161   2HB   GLU  22          1HB       GLU  22   2.965 -10.526  -8.311
  162   1HG   GLU  22          2HG       GLU  22   4.751  -9.591  -7.458
  163   2HG   GLU  22          1HG       GLU  22   4.198 -10.310  -5.935
  164    H    GLU  23           HN       GLU  23   2.996 -14.461  -8.048
  165    HA   GLU  23           HA       GLU  23   2.368 -14.945 -10.465
  166   1HB   GLU  23          2HB       GLU  23   2.690 -16.688  -8.770
  167   2HB   GLU  23          1HB       GLU  23   1.048 -16.493  -8.175
  168   1HG   GLU  23          1HG       GLU  23   0.184 -17.227 -10.424
  169   2HG   GLU  23          2HG       GLU  23   1.857 -17.406 -10.977
  170    H    HIS  24           HN       HIS  24  -0.481 -15.193  -8.363
  171    HA   HIS  24           HA       HIS  24  -1.950 -13.330 -10.077
  172   1HB   HIS  24          1HB       HIS  24  -2.483 -15.578 -11.063
  173   2HB   HIS  24          2HB       HIS  24  -3.208 -16.042  -9.512
  174    HD2  HIS  24           HD2      HIS  24  -5.456 -14.401  -8.764
  175    HE1  HIS  24           HE1      HIS  24  -5.737 -12.358 -12.454
  176    HE2  HIS  24           HE2      HIS  24  -6.768 -12.591 -10.132
  177    H    LYS  25           HN       LYS  25  -1.198 -12.251  -8.095
  178    HA   LYS  25           HA       LYS  25  -3.582 -11.871  -6.545
  179   1HB   LYS  25          1HB       LYS  25  -2.341 -12.054  -4.310
  180   2HB   LYS  25          2HB       LYS  25  -2.998 -13.484  -5.091
  181   1HG   LYS  25          2HG       LYS  25  -0.602 -13.930  -5.994
  182   2HG   LYS  25          1HG       LYS  25  -0.082 -12.635  -4.921
  183   1HD   LYS  25          1HD       LYS  25   0.201 -14.849  -3.903
  184   2HD   LYS  25          2HD       LYS  25  -0.920 -13.856  -2.967
  185   1HE   LYS  25          2HE       LYS  25  -1.529 -16.313  -3.277
  186   2HE   LYS  25          1HE       LYS  25  -2.808 -15.172  -3.685
  187   1HZ   LYS  25          1HZ       LYS  25  -0.989 -16.419  -5.631
  188   2HZ   LYS  25          3HZ       LYS  25  -2.529 -16.919  -5.316
  189   3HZ   LYS  25          2HZ       LYS  25  -2.272 -15.437  -5.981
  190    HA   PRO  26           HA       PRO  26  -1.520  -8.112  -7.527
  191   1HB   PRO  26          2HB       PRO  26  -3.285  -6.257  -6.533
  192   2HB   PRO  26          1HB       PRO  26  -3.604  -7.229  -7.986
  193   1HG   PRO  26          1HG       PRO  26  -4.447  -7.816  -5.161
  194   2HG   PRO  26          2HG       PRO  26  -5.534  -7.778  -6.546
  195   1HD   PRO  26          2HD       PRO  26  -4.505 -10.088  -5.598
  196   2HD   PRO  26          1HD       PRO  26  -4.531  -9.842  -7.374
  197    H    ILE  27           HN       ILE  27   0.069  -7.003  -6.744
  198    HA   ILE  27           HA       ILE  27   0.391  -6.480  -3.824
  199    HB   ILE  27           HB       ILE  27   2.338  -6.646  -6.159
  200   1HG1  ILE  27          2HG12     ILE  27   3.604  -8.125  -4.717
  201   2HG1  ILE  27          1HG11     ILE  27   2.496  -7.886  -3.375
  202   1HG2  ILE  27          2HG22     ILE  27   2.762  -5.364  -3.426
  203   2HG2  ILE  27          3HG23     ILE  27   4.079  -5.829  -4.517
  204   3HG2  ILE  27          1HG21     ILE  27   2.940  -4.583  -5.012
  205   1HD1  ILE  27          2HD12     ILE  27   1.740  -9.161  -6.037
  206   2HD1  ILE  27          3HD13     ILE  27   2.254 -10.064  -4.593
  207   3HD1  ILE  27          1HD11     ILE  27   0.758  -9.138  -4.546
  208    H    VAL  28           HN       VAL  28  -0.734  -4.555  -3.502
  209    HA   VAL  28           HA       VAL  28  -1.017  -2.668  -5.772
  210    HB   VAL  28           HB       VAL  28  -2.704  -2.741  -3.248
  211   1HG1  VAL  28          1HG11     VAL  28  -3.081  -1.616  -6.080
  212   2HG1  VAL  28          2HG12     VAL  28  -4.287  -1.542  -4.793
  213   3HG1  VAL  28          3HG13     VAL  28  -2.754  -0.655  -4.629
  214   1HG2  VAL  28          3HG23     VAL  28  -2.953  -4.944  -4.371
  215   2HG2  VAL  28          1HG21     VAL  28  -4.404  -3.955  -4.503
  216   3HG2  VAL  28          2HG22     VAL  28  -3.311  -4.096  -5.896
  217    H    VAL  29           HN       VAL  29   0.220  -0.950  -5.648
  218    HA   VAL  29           HA       VAL  29   1.508  -0.184  -3.089
  219    HB   VAL  29           HB       VAL  29   2.430   0.100  -5.961
  220   1HG1  VAL  29          1HG11     VAL  29   3.280   1.882  -4.446
  221   2HG1  VAL  29          3HG13     VAL  29   3.824   0.637  -3.302
  222   3HG1  VAL  29          2HG12     VAL  29   4.540   0.753  -4.926
  223   1HG2  VAL  29          3HG23     VAL  29   3.138  -1.847  -3.727
  224   2HG2  VAL  29          2HG22     VAL  29   2.408  -2.239  -5.290
  225   3HG2  VAL  29          1HG21     VAL  29   4.079  -1.656  -5.223
  226    H    ASP  30           HN       ASP  30   0.396   1.447  -2.265
  227    HA   ASP  30           HA       ASP  30  -0.729   3.654  -3.863
  228   1HB   ASP  30          2HB       ASP  30  -1.955   2.764  -1.955
  229   2HB   ASP  30          1HB       ASP  30  -0.617   3.092  -0.874
  230    H    PHE  31           HN       PHE  31   1.012   4.693  -4.752
  231    HA   PHE  31           HA       PHE  31   3.290   5.605  -3.103
  232   1HB   PHE  31          2HB       PHE  31   2.443   6.099  -5.985
  233   2HB   PHE  31          1HB       PHE  31   3.773   6.914  -5.217
  234    HD1  PHE  31           HD2      PHE  31   5.880   5.782  -4.680
  235    HD2  PHE  31           HD1      PHE  31   2.626   3.675  -6.580
  236    HE1  PHE  31           HE2      PHE  31   7.471   4.094  -5.539
  237    HE2  PHE  31           HE1      PHE  31   4.263   2.081  -7.568
  238    HZ   PHE  31           HZ       PHE  31   6.687   2.356  -7.133
  239    H    THR  32           HN       THR  32   3.074   7.429  -1.871
  240    HA   THR  32           HA       THR  32   1.334   9.623  -2.735
  241    HB   THR  32           HB       THR  32  -0.204   8.208  -1.456
  242    HG1  THR  32           HG1      THR  32  -0.845   9.819  -0.089
  243   1HG2  THR  32          3HG23     THR  32   1.410   6.968  -0.033
  244   2HG2  THR  32          1HG21     THR  32   1.784   8.461   0.857
  245   3HG2  THR  32          2HG22     THR  32   0.160   7.753   0.940
  246    H    ALA  33           HN       ALA  33   1.732  11.480  -1.014
  247    HA   ALA  33           HA       ALA  33   4.658  11.449  -0.296
  248   1HB   ALA  33          1HB       ALA  33   3.066  13.731  -1.503
  249   2HB   ALA  33          2HB       ALA  33   4.718  13.833  -0.862
  250   3HB   ALA  33          3HB       ALA  33   4.381  12.814  -2.273
  251    H    THR  34           HN       THR  34   4.822  11.499   1.865
  252    HA   THR  34           HA       THR  34   2.831  11.727   3.746
  253    HB   THR  34           HB       THR  34   4.907  12.561   5.199
  254    HG1  THR  34           HG1      THR  34   6.687  11.571   3.519
  255   1HG2  THR  34          2HG22     THR  34   4.787   9.914   3.702
  256   2HG2  THR  34          1HG21     THR  34   5.822  10.240   5.119
  257   3HG2  THR  34          3HG23     THR  34   4.056  10.303   5.269
  258    H    TRP  35           HN       TRP  35   5.047  14.376   2.868
  259    HA   TRP  35           HA       TRP  35   3.847  16.356   4.492
  260   1HB   TRP  35          1HB       TRP  35   5.012  17.962   2.950
  261   2HB   TRP  35          2HB       TRP  35   6.017  16.711   3.668
  262    HD1  TRP  35           HD1      TRP  35   7.275  15.077   2.117
  263    HE1  TRP  35           HE1      TRP  35   7.815  15.102  -0.393
  264    HE3  TRP  35           HE3      TRP  35   3.704  18.404   0.533
  265    HZ2  TRP  35           HZ2      TRP  35   6.705  16.232  -2.793
  266    HZ3  TRP  35           HZ3      TRP  35   3.447  18.894  -1.877
  267    HH2  TRP  35           HH2      TRP  35   4.949  17.835  -3.546
  268    H    CYS  36           HN       CYS  36   2.739  15.137   1.345
  269    HA   CYS  36           HA       CYS  36   1.009  17.495   0.875
  270   1HB   CYS  36          1HB       CYS  36   1.825  16.422  -1.109
  271   2HB   CYS  36          2HB       CYS  36   1.321  14.839  -0.522
  272    H    GLY  37           HN       GLY  37   0.080  17.394   3.005
  273   1HA   GLY  37          1HA       GLY  37  -1.237  15.610   4.439
  274   2HA   GLY  37          2HA       GLY  37  -2.006  17.166   4.094
  275    HA   PRO  38           HA       PRO  38  -5.310  15.386   1.769
  276   1HB   PRO  38          1HB       PRO  38  -4.137  16.339  -0.857
  277   2HB   PRO  38          2HB       PRO  38  -5.824  16.472  -0.284
  278   1HG   PRO  38          2HG       PRO  38  -4.193  18.625  -0.118
  279   2HG   PRO  38          1HG       PRO  38  -5.204  18.190   1.293
  280   1HD   PRO  38          2HD       PRO  38  -2.280  17.563   0.832
  281   2HD   PRO  38          1HD       PRO  38  -3.072  18.204   2.300
  282    H    CYS  39           HN       CYS  39  -2.160  14.785   0.248
  283    HA   CYS  39           HA       CYS  39  -2.992  12.444  -1.266
  284   1HB   CYS  39          1HB       CYS  39  -0.169  13.155  -0.404
  285   2HB   CYS  39          2HB       CYS  39  -0.674  12.081  -1.685
  286    H    LYS  40           HN       LYS  40  -1.363  13.154   1.838
  287    HA   LYS  40           HA       LYS  40  -0.893  10.449   2.591
  288   1HB   LYS  40          1HB       LYS  40   0.257  12.373   3.593
  289   2HB   LYS  40          2HB       LYS  40  -1.259  12.922   4.327
  290   1HG   LYS  40          1HG       LYS  40  -1.374  10.911   5.725
  291   2HG   LYS  40          2HG       LYS  40  -0.014  10.191   4.862
  292   1HD   LYS  40          1HD       LYS  40   0.625  11.086   7.088
  293   2HD   LYS  40          2HD       LYS  40   1.542  11.801   5.759
  294   1HE   LYS  40          1HE       LYS  40   0.869  13.472   7.462
  295   2HE   LYS  40          2HE       LYS  40   0.266  13.848   5.849
  296   1HZ   LYS  40          2HZ       LYS  40  -1.285  12.571   8.001
  297   2HZ   LYS  40          3HZ       LYS  40  -1.402  14.148   7.537
  298   3HZ   LYS  40          1HZ       LYS  40  -1.856  12.951   6.501
  299    H    MET  41           HN       MET  41  -3.643  12.627   3.228
  300    HA   MET  41           HA       MET  41  -5.096  10.880   4.950
  301   1HB   MET  41          1HB       MET  41  -5.973  13.098   3.047
  302   2HB   MET  41          2HB       MET  41  -7.113  12.252   4.091
  303   1HG   MET  41          1HG       MET  41  -4.702  13.843   5.040
  304   2HG   MET  41          2HG       MET  41  -6.385  14.352   5.108
  305   1HE   MET  41          2HE       MET  41  -8.212  12.973   6.485
  306   2HE   MET  41          1HE       MET  41  -7.617  11.319   6.178
  307   3HE   MET  41          3HE       MET  41  -7.810  11.899   7.845
  308    H    ILE  42           HN       ILE  42  -4.594  10.467   1.532
  309    HA   ILE  42           HA       ILE  42  -6.961   8.751   1.226
  310    HB   ILE  42           HB       ILE  42  -4.561   9.439  -0.490
  311   1HG1  ILE  42          2HG12     ILE  42  -7.532   9.915  -0.962
  312   2HG1  ILE  42          1HG11     ILE  42  -6.594  11.039   0.018
  313   1HG2  ILE  42          3HG23     ILE  42  -6.856   7.530  -1.101
  314   2HG2  ILE  42          1HG21     ILE  42  -5.728   8.177  -2.314
  315   3HG2  ILE  42          2HG22     ILE  42  -5.122   7.140  -1.025
  316   1HD1  ILE  42          2HD12     ILE  42  -5.942  10.377  -2.861
  317   2HD1  ILE  42          1HD11     ILE  42  -6.775  11.829  -2.272
  318   3HD1  ILE  42          3HD13     ILE  42  -5.092  11.532  -1.810
  319    H    ALA  43           HN       ALA  43  -3.673   8.410   2.399
  320    HA   ALA  43           HA       ALA  43  -3.224   5.674   1.948
  321   1HB   ALA  43          3HB       ALA  43  -1.529   7.289   2.765
  322   2HB   ALA  43          2HB       ALA  43  -2.303   7.297   4.361
  323   3HB   ALA  43          1HB       ALA  43  -1.601   5.807   3.729
  324    HA   PRO  44           HA       PRO  44  -5.328   4.552   6.138
  325   1HB   PRO  44          1HB       PRO  44  -7.332   6.195   7.113
  326   2HB   PRO  44          2HB       PRO  44  -5.627   6.243   7.644
  327   1HG   PRO  44          1HG       PRO  44  -6.949   7.953   5.524
  328   2HG   PRO  44          2HG       PRO  44  -5.936   8.505   6.894
  329   1HD   PRO  44          2HD       PRO  44  -4.813   8.216   4.504
  330   2HD   PRO  44          1HD       PRO  44  -3.961   7.558   5.917
  331    H    LEU  45           HN       LEU  45  -7.182   6.439   3.756
  332    HA   LEU  45           HA       LEU  45  -9.531   4.777   3.767
  333   1HB   LEU  45          2HB       LEU  45  -8.301   6.827   1.972
  334   2HB   LEU  45          1HB       LEU  45  -9.304   5.650   1.148
  335    HG   LEU  45           HG       LEU  45 -10.421   7.785   1.896
  336   1HD1  LEU  45          1HD11     LEU  45 -11.733   5.764   1.358
  337   2HD1  LEU  45          3HD13     LEU  45 -11.637   5.234   3.049
  338   3HD1  LEU  45          2HD12     LEU  45 -12.500   6.725   2.633
  339   1HD2  LEU  45          1HD21     LEU  45  -9.295   7.988   4.109
  340   2HD2  LEU  45          2HD22     LEU  45 -11.062   8.127   4.193
  341   3HD2  LEU  45          3HD23     LEU  45 -10.275   6.636   4.718
  342    H    PHE  46           HN       PHE  46  -6.607   4.657   1.675
  343    HA   PHE  46           HA       PHE  46  -7.341   2.166   0.424
  344   1HB   PHE  46          2HB       PHE  46  -5.656   3.600  -0.524
  345   2HB   PHE  46          1HB       PHE  46  -4.700   3.555   0.941
  346    HD1  PHE  46           HD2      PHE  46  -6.112   1.207  -1.684
  347    HD2  PHE  46           HD1      PHE  46  -2.911   2.044   1.039
  348    HE1  PHE  46           HE2      PHE  46  -4.632  -0.302  -2.963
  349    HE2  PHE  46           HE1      PHE  46  -1.455   0.400  -0.152
  350    HZ   PHE  46           HZ       PHE  46  -2.234  -0.635  -2.240
  351    H    GLU  47           HN       GLU  47  -5.613   2.890   3.488
  352    HA   GLU  47           HA       GLU  47  -4.874   0.234   4.132
  353   1HB   GLU  47          2HB       GLU  47  -4.161   2.406   5.274
  354   2HB   GLU  47          1HB       GLU  47  -5.695   2.318   6.168
  355   1HG   GLU  47          1HG       GLU  47  -5.073   0.156   7.116
  356   2HG   GLU  47          2HG       GLU  47  -3.593   0.111   6.145
  357    H    THR  48           HN       THR  48  -7.953   2.002   4.529
  358    HA   THR  48           HA       THR  48  -9.289   0.043   6.119
  359    HB   THR  48           HB       THR  48 -10.557   1.894   4.048
  360    HG1  THR  48           HG1      THR  48  -9.140   2.964   5.626
  361   1HG2  THR  48          1HG21     THR  48 -11.625   0.716   6.635
  362   2HG2  THR  48          3HG23     THR  48 -12.464   1.865   5.575
  363   3HG2  THR  48          2HG22     THR  48 -12.106   0.228   4.990
  364    H    LEU  49           HN       LEU  49  -9.027   0.471   2.537
  365    HA   LEU  49           HA       LEU  49 -10.512  -1.877   1.859
  366   1HB   LEU  49          1HB       LEU  49  -9.833  -0.001   0.294
  367   2HB   LEU  49          2HB       LEU  49  -8.187  -0.655   0.304
  368    HG   LEU  49           HG       LEU  49  -9.167  -2.790  -0.671
  369   1HD1  LEU  49          1HD21     LEU  49 -11.645  -0.997  -0.742
  370   2HD1  LEU  49          2HD22     LEU  49 -11.445  -2.420  -1.775
  371   3HD1  LEU  49          3HD23     LEU  49 -11.506  -2.611  -0.013
  372   1HD2  LEU  49          2HD12     LEU  49  -8.091  -1.014  -2.059
  373   2HD2  LEU  49          1HD11     LEU  49  -9.423  -1.808  -2.917
  374   3HD2  LEU  49          3HD13     LEU  49  -9.655  -0.196  -2.210
  375    H    SER  50           HN       SER  50  -7.094  -1.291   2.605
  376    HA   SER  50           HA       SER  50  -6.029  -3.863   2.073
  377   1HB   SER  50          2HB       SER  50  -5.073  -2.124   4.341
  378   2HB   SER  50          1HB       SER  50  -4.233  -3.295   3.333
  379    HG   SER  50           HG       SER  50  -5.338  -1.008   2.134
  380    H    ASN  51           HN       ASN  51  -7.390  -2.600   5.120
  381    HA   ASN  51           HA       ASN  51  -7.218  -5.059   6.550
  382   1HB   ASN  51          1HB       ASN  51  -7.619  -2.675   7.424
  383   2HB   ASN  51          2HB       ASN  51  -9.313  -2.886   6.975
  384   1HD2  ASN  51          1HD21     ASN  51  -9.286  -5.731   9.590
  385   2HD2  ASN  51          2HD22     ASN  51  -9.344  -5.870   7.845
  386    H    ASP  52           HN       ASP  52  -9.788  -3.626   4.484
  387    HA   ASP  52           HA       ASP  52 -11.828  -5.476   5.009
  388   1HB   ASP  52          1HB       ASP  52 -12.075  -3.351   3.669
  389   2HB   ASP  52          2HB       ASP  52 -11.210  -4.128   2.337
  390    H    TYR  53           HN       TYR  53  -9.201  -5.654   2.562
  391    HA   TYR  53           HA       TYR  53 -10.202  -8.239   1.540
  392   1HB   TYR  53          1HB       TYR  53  -7.972  -6.360   0.975
  393   2HB   TYR  53          2HB       TYR  53  -7.823  -8.029   0.409
  394    HD1  TYR  53           HD2      TYR  53 -10.145  -5.059   0.262
  395    HD2  TYR  53           HD1      TYR  53  -8.767  -8.660  -1.665
  396    HE1  TYR  53           HE2      TYR  53 -11.730  -4.668  -1.576
  397    HE2  TYR  53           HE1      TYR  53 -10.224  -8.163  -3.578
  398    HH   TYR  53           HH       TYR  53 -12.190  -7.093  -4.175
  399    H    ALA  54           HN       ALA  54  -7.351  -7.106   3.373
  400    HA   ALA  54           HA       ALA  54  -5.874  -8.058   4.742
  401   1HB   ALA  54          1HB       ALA  54  -7.935  -8.500   6.029
  402   2HB   ALA  54          2HB       ALA  54  -8.075 -10.104   5.282
  403   3HB   ALA  54          3HB       ALA  54  -6.689  -9.724   6.318
  404    H    GLY  55           HN       GLY  55  -7.385 -10.824   3.093
  405   1HA   GLY  55          1HA       GLY  55  -5.147 -12.584   3.373
  406   2HA   GLY  55          2HA       GLY  55  -6.619 -12.839   2.430
  407    H    LYS  56           HN       LYS  56  -6.295 -13.138   0.309
  408    HA   LYS  56           HA       LYS  56  -3.953 -13.550  -0.905
  409   1HB   LYS  56          2HB       LYS  56  -6.310 -12.329  -2.405
  410   2HB   LYS  56          1HB       LYS  56  -5.010 -13.351  -3.039
  411   1HG   LYS  56          2HG       LYS  56  -5.901 -15.101  -1.264
  412   2HG   LYS  56          1HG       LYS  56  -7.383 -14.132  -1.338
  413   1HD   LYS  56          1HD       LYS  56  -5.954 -15.604  -3.592
  414   2HD   LYS  56          2HD       LYS  56  -7.556 -15.946  -2.939
  415   1HE   LYS  56          2HE       LYS  56  -6.751 -13.490  -4.590
  416   2HE   LYS  56          1HE       LYS  56  -7.704 -14.865  -5.136
  417   1HZ   LYS  56          2HZ       LYS  56  -9.392 -14.271  -3.562
  418   2HZ   LYS  56          1HZ       LYS  56  -8.509 -12.975  -3.044
  419   3HZ   LYS  56          3HZ       LYS  56  -9.063 -13.032  -4.599
  420    H    VAL  57           HN       VAL  57  -5.501 -10.319  -0.973
  421    HA   VAL  57           HA       VAL  57  -3.552  -9.282  -2.861
  422    HB   VAL  57           HB       VAL  57  -5.621  -7.927  -1.097
  423   1HG1  VAL  57          1HG11     VAL  57  -3.978  -6.847  -3.425
  424   2HG1  VAL  57          2HG12     VAL  57  -5.437  -6.057  -2.807
  425   3HG1  VAL  57          3HG13     VAL  57  -3.999  -6.249  -1.799
  426   1HG2  VAL  57          1HG21     VAL  57  -5.815  -8.991  -3.911
  427   2HG2  VAL  57          2HG22     VAL  57  -6.770  -9.443  -2.503
  428   3HG2  VAL  57          3HG23     VAL  57  -6.963  -7.829  -3.202
  429    H    ILE  58           HN       ILE  58  -1.754  -8.037  -2.459
  430    HA   ILE  58           HA       ILE  58  -0.911  -7.658   0.411
  431    HB   ILE  58           HB       ILE  58   0.596  -8.071  -2.178
  432   1HG1  ILE  58          2HG12     ILE  58   1.989  -9.519  -0.745
  433   2HG1  ILE  58          1HG11     ILE  58   0.996  -9.128   0.661
  434   1HG2  ILE  58          1HG21     ILE  58   1.631  -6.590   0.275
  435   2HG2  ILE  58          2HG22     ILE  58   2.678  -7.316  -0.956
  436   3HG2  ILE  58          3HG23     ILE  58   1.585  -6.008  -1.396
  437   1HD1  ILE  58          3HD13     ILE  58  -0.048 -10.500  -1.857
  438   2HD1  ILE  58          2HD12     ILE  58   0.488 -11.347  -0.392
  439   3HD1  ILE  58          1HD11     ILE  58  -0.916 -10.288  -0.316
  440    H    PHE  59           HN       PHE  59  -0.976  -5.549   1.136
  441    HA   PHE  59           HA       PHE  59  -1.365  -3.423  -0.939
  442   1HB   PHE  59          1HB       PHE  59  -2.517  -3.519   1.858
  443   2HB   PHE  59          2HB       PHE  59  -2.600  -2.155   0.768
  444    HD1  PHE  59           HD2      PHE  59  -3.605  -5.768   1.108
  445    HD2  PHE  59           HD1      PHE  59  -4.494  -1.909  -0.588
  446    HE1  PHE  59           HE2      PHE  59  -5.850  -6.528   0.541
  447    HE2  PHE  59           HE1      PHE  59  -6.666  -2.763  -1.402
  448    HZ   PHE  59           HZ       PHE  59  -7.393  -5.047  -0.810
  449    H    LEU  60           HN       LEU  60  -0.142  -1.691  -0.802
  450    HA   LEU  60           HA       LEU  60   1.935  -1.628   1.336
  451   1HB   LEU  60          2HB       LEU  60   2.005  -2.867  -1.205
  452   2HB   LEU  60          1HB       LEU  60   2.767  -1.349  -1.525
  453    HG   LEU  60           HG       LEU  60   3.430  -3.336   0.702
  454   1HD1  LEU  60          2HD12     LEU  60   4.683  -2.856  -2.034
  455   2HD1  LEU  60          3HD13     LEU  60   5.424  -3.854  -0.769
  456   3HD1  LEU  60          1HD11     LEU  60   3.855  -4.320  -1.461
  457   1HD2  LEU  60          3HD23     LEU  60   4.956  -0.894  -0.323
  458   2HD2  LEU  60          1HD21     LEU  60   4.201  -1.035   1.280
  459   3HD2  LEU  60          2HD22     LEU  60   5.590  -2.053   0.872
  460    H    LYS  61           HN       LYS  61   2.046   0.426   2.137
  461    HA   LYS  61           HA       LYS  61   1.331   2.715   0.311
  462   1HB   LYS  61          1HB       LYS  61   1.209   2.321   3.289
  463   2HB   LYS  61          2HB       LYS  61   1.130   3.930   2.552
  464   1HG   LYS  61          1HG       LYS  61  -0.886   3.457   1.447
  465   2HG   LYS  61          2HG       LYS  61  -0.691   1.707   1.612
  466   1HD   LYS  61          2HD       LYS  61  -1.123   3.535   4.001
  467   2HD   LYS  61          1HD       LYS  61  -2.467   2.844   3.112
  468   1HE   LYS  61          2HE       LYS  61  -0.296   1.166   4.454
  469   2HE   LYS  61          1HE       LYS  61  -1.869   1.538   5.142
  470   1HZ   LYS  61          1HZ       LYS  61  -2.875   0.420   3.261
  471   2HZ   LYS  61          3HZ       LYS  61  -1.383   0.030   2.676
  472   3HZ   LYS  61          2HZ       LYS  61  -1.879  -0.566   4.129
  473    H    VAL  62           HN       VAL  62   3.023   3.791  -0.510
  474    HA   VAL  62           HA       VAL  62   5.620   3.717   0.975
  475    HB   VAL  62           HB       VAL  62   5.765   2.176  -0.918
  476   1HG1  VAL  62          3HG23     VAL  62   3.993   3.176  -2.349
  477   2HG1  VAL  62          1HG21     VAL  62   5.127   4.514  -2.690
  478   3HG1  VAL  62          2HG22     VAL  62   5.526   2.860  -3.189
  479   1HG2  VAL  62          2HG12     VAL  62   7.784   3.580  -0.415
  480   2HG2  VAL  62          3HG13     VAL  62   7.642   3.141  -2.130
  481   3HG2  VAL  62          1HG11     VAL  62   7.228   4.774  -1.610
  482    H    ASP  63           HN       ASP  63   6.638   5.558   1.284
  483    HA   ASP  63           HA       ASP  63   5.249   8.032   0.557
  484   1HB   ASP  63          1HB       ASP  63   6.099   7.761   2.830
  485   2HB   ASP  63          2HB       ASP  63   7.753   7.599   2.215
  486    H    VAL  64           HN       VAL  64   5.583   8.649  -1.448
  487    HA   VAL  64           HA       VAL  64   7.676   8.229  -3.259
  488    HB   VAL  64           HB       VAL  64   5.691  10.515  -2.854
  489   1HG1  VAL  64          3HG13     VAL  64   7.505  10.049  -5.251
  490   2HG1  VAL  64          1HG11     VAL  64   6.085  11.115  -5.241
  491   3HG1  VAL  64          2HG12     VAL  64   7.464  11.482  -4.201
  492   1HG2  VAL  64          1HG21     VAL  64   4.802   8.204  -3.395
  493   2HG2  VAL  64          2HG22     VAL  64   4.418   9.432  -4.608
  494   3HG2  VAL  64          3HG23     VAL  64   5.729   8.267  -4.903
  495    H    ASP  65           HN       ASP  65   7.325  10.653  -0.651
  496    HA   ASP  65           HA       ASP  65   9.479  12.339  -1.469
  497   1HB   ASP  65          1HB       ASP  65   7.640  12.849   0.226
  498   2HB   ASP  65          2HB       ASP  65   8.534  11.851   1.384
  499    H    ALA  66           HN       ALA  66   9.358   9.281   0.340
  500    HA   ALA  66           HA       ALA  66  12.127   9.566   1.318
  501   1HB   ALA  66          1HB       ALA  66  10.433   8.534   2.765
  502   2HB   ALA  66          2HB       ALA  66  10.132   7.267   1.560
  503   3HB   ALA  66          3HB       ALA  66  11.719   7.386   2.349
  504    H    VAL  67           HN       VAL  67  10.424   6.969  -0.569
  505    HA   VAL  67           HA       VAL  67  13.075   6.307  -1.770
  506    HB   VAL  67           HB       VAL  67  11.949   4.370  -2.729
  507   1HG1  VAL  67          1HG11     VAL  67  11.840   4.659   0.276
  508   2HG1  VAL  67          3HG13     VAL  67  11.830   3.125  -0.613
  509   3HG1  VAL  67          2HG12     VAL  67  13.246   4.190  -0.694
  510   1HG2  VAL  67          3HG23     VAL  67   9.569   5.184  -2.684
  511   2HG2  VAL  67          2HG22     VAL  67   9.840   3.613  -1.914
  512   3HG2  VAL  67          1HG21     VAL  67   9.618   5.067  -0.910
  513    H    ALA  68           HN       ALA  68  12.727   8.636  -2.614
  514    HA   ALA  68           HA       ALA  68  11.154   9.260  -4.831
  515   1HB   ALA  68          2HB       ALA  68  14.085   9.971  -4.353
  516   2HB   ALA  68          1HB       ALA  68  12.981  10.802  -5.468
  517   3HB   ALA  68          3HB       ALA  68  12.673  10.849  -3.720
  518    H    ALA  69           HN       ALA  69  14.176   7.392  -4.712
  519    HA   ALA  69           HA       ALA  69  14.647   6.989  -7.457
  520   1HB   ALA  69          3HB       ALA  69  16.253   6.420  -5.691
  521   2HB   ALA  69          1HB       ALA  69  15.188   5.122  -5.106
  522   3HB   ALA  69          2HB       ALA  69  15.924   5.011  -6.719
  523    H    VAL  70           HN       VAL  70  12.670   5.000  -5.176
  524    HA   VAL  70           HA       VAL  70  11.997   3.001  -7.162
  525    HB   VAL  70           HB       VAL  70  10.625   3.710  -4.537
  526   1HG1  VAL  70          1HG21     VAL  70  10.425   1.210  -6.275
  527   2HG1  VAL  70          2HG22     VAL  70   9.715   1.413  -4.660
  528   3HG1  VAL  70          3HG23     VAL  70   9.133   2.395  -6.009
  529   1HG2  VAL  70          3HG13     VAL  70  13.021   2.988  -4.259
  530   2HG2  VAL  70          2HG12     VAL  70  11.876   1.791  -3.630
  531   3HG2  VAL  70          1HG11     VAL  70  12.660   1.531  -5.204
  532    H    ALA  71           HN       ALA  71  10.414   5.884  -5.798
  533    HA   ALA  71           HA       ALA  71   7.967   5.741  -7.159
  534   1HB   ALA  71          3HB       ALA  71   8.478   7.310  -5.334
  535   2HB   ALA  71          2HB       ALA  71   9.514   8.258  -6.418
  536   3HB   ALA  71          1HB       ALA  71   7.776   8.134  -6.739
  537    H    GLU  72           HN       GLU  72  10.933   7.563  -8.223
  538    HA   GLU  72           HA       GLU  72   9.744   8.286 -10.742
  539   1HB   GLU  72          1HB       GLU  72  11.850   9.211 -11.322
  540   2HB   GLU  72          2HB       GLU  72  11.546   9.558  -9.616
  541   1HG   GLU  72          2HG       GLU  72  13.055   7.569  -9.078
  542   2HG   GLU  72          1HG       GLU  72  13.491   7.522 -10.789
  543    H    ALA  73           HN       ALA  73  11.922   5.561  -9.770
  544    HA   ALA  73           HA       ALA  73  12.373   4.568 -12.389
  545   1HB   ALA  73          3HB       ALA  73  12.131   3.052  -9.748
  546   2HB   ALA  73          1HB       ALA  73  12.831   2.418 -11.251
  547   3HB   ALA  73          2HB       ALA  73  13.612   3.774 -10.421
  548    H    ALA  74           HN       ALA  74   9.754   3.854 -10.036
  549    HA   ALA  74           HA       ALA  74   8.328   2.009 -11.691
  550   1HB   ALA  74          3HB       ALA  74   7.430   3.806  -9.401
  551   2HB   ALA  74          2HB       ALA  74   6.472   2.482 -10.094
  552   3HB   ALA  74          1HB       ALA  74   8.006   2.133  -9.280
  553    H    GLY  75           HN       GLY  75   8.176   5.527 -11.280
  554   1HA   GLY  75          1HA       GLY  75   7.888   6.897 -13.262
  555   2HA   GLY  75          2HA       GLY  75   6.693   5.747 -13.877
  556    H    ILE  76           HN       ILE  76   7.047   7.301 -10.631
  557    HA   ILE  76           HA       ILE  76   4.192   8.072 -10.703
  558    HB   ILE  76           HB       ILE  76   6.401   8.110  -8.643
  559   1HG1  ILE  76          2HG12     ILE  76   4.857   6.806  -7.364
  560   2HG1  ILE  76          1HG11     ILE  76   3.515   7.148  -8.466
  561   1HG2  ILE  76          3HG23     ILE  76   3.744   9.597  -8.440
  562   2HG2  ILE  76          2HG22     ILE  76   4.780   9.191  -7.062
  563   3HG2  ILE  76          1HG21     ILE  76   5.374  10.297  -8.295
  564   1HD1  ILE  76          2HD12     ILE  76   5.951   5.471  -9.142
  565   2HD1  ILE  76          3HD13     ILE  76   4.344   4.854  -8.723
  566   3HD1  ILE  76          1HD11     ILE  76   4.551   5.763 -10.207
  567    H    THR  77           HN       THR  77   3.440  10.022 -11.247
  568    HA   THR  77           HA       THR  77   5.324  12.299 -11.677
  569    HB   THR  77           HB       THR  77   3.463  13.046 -13.230
  570    HG1  THR  77           HG1      THR  77   2.081  11.239 -13.890
  571   1HG2  THR  77          3HG23     THR  77   5.520  11.910 -14.076
  572   2HG2  THR  77          2HG22     THR  77   4.717  10.337 -13.899
  573   3HG2  THR  77          1HG21     THR  77   4.097  11.526 -15.062
  574    H    ALA  78           HN       ALA  78   1.840  11.920 -11.291
  575    HA   ALA  78           HA       ALA  78   1.753  13.971  -9.136
  576   1HB   ALA  78          1HB       ALA  78   0.157  14.154 -11.015
  577   2HB   ALA  78          3HB       ALA  78  -0.468  12.528 -10.652
  578   3HB   ALA  78          2HB       ALA  78  -0.687  13.849  -9.484
  579    H    MET  79           HN       MET  79   0.820  13.501  -7.095
  580    HA   MET  79           HA       MET  79   0.662  10.626  -6.356
  581   1HB   MET  79          2HB       MET  79   1.228  11.548  -4.021
  582   2HB   MET  79          1HB       MET  79   2.528  11.235  -5.159
  583   1HG   MET  79          1HG       MET  79   1.281  13.993  -4.767
  584   2HG   MET  79          2HG       MET  79   2.626  13.377  -3.813
  585   1HE   MET  79          3HE       MET  79   2.762  16.132  -5.235
  586   2HE   MET  79          1HE       MET  79   4.091  15.425  -4.278
  587   3HE   MET  79          2HE       MET  79   4.410  16.067  -5.908
  588    HA   PRO  80           HA       PRO  80  -0.233   9.565  -4.547
  589   1HB   PRO  80          2HB       PRO  80  -3.083   8.585  -4.665
  590   2HB   PRO  80          1HB       PRO  80  -1.807   8.153  -3.491
  591   1HG   PRO  80          2HG       PRO  80  -3.689   9.909  -2.769
  592   2HG   PRO  80          1HG       PRO  80  -1.988  10.310  -2.434
  593   1HD   PRO  80          2HD       PRO  80  -3.641  11.222  -4.836
  594   2HD   PRO  80          1HD       PRO  80  -2.702  12.236  -3.705
  595    H    THR  81           HN       THR  81  -0.321   7.346  -5.587
  596    HA   THR  81           HA       THR  81  -1.654   7.037  -8.151
  597    HB   THR  81           HB       THR  81   1.313   7.615  -7.927
  598    HG1  THR  81           HG1      THR  81   0.172   9.253  -8.819
  599   1HG2  THR  81          2HG22     THR  81   0.023   5.841 -10.048
  600   2HG2  THR  81          3HG23     THR  81   1.603   6.635 -10.219
  601   3HG2  THR  81          1HG21     THR  81   1.370   5.424  -8.950
  602    H    PHE  82           HN       PHE  82  -2.157   4.949  -8.378
  603    HA   PHE  82           HA       PHE  82  -1.143   3.025  -6.357
  604   1HB   PHE  82          1HB       PHE  82  -3.683   3.222  -7.986
  605   2HB   PHE  82          2HB       PHE  82  -3.265   1.851  -6.975
  606    HD1  PHE  82           HD1      PHE  82  -3.197   2.031  -4.515
  607    HD2  PHE  82           HD2      PHE  82  -4.234   5.440  -6.964
  608    HE1  PHE  82           HE1      PHE  82  -3.990   3.263  -2.512
  609    HE2  PHE  82           HE2      PHE  82  -4.851   6.700  -4.933
  610    HZ   PHE  82           HZ       PHE  82  -4.613   5.618  -2.680
  611    H    HIS  83           HN       HIS  83   0.360   1.543  -7.144
  612    HA   HIS  83           HA       HIS  83   0.035   0.597 -10.025
  613   1HB   HIS  83          1HB       HIS  83   2.450   0.810  -8.186
  614   2HB   HIS  83          2HB       HIS  83   2.422  -0.111  -9.704
  615    HD2  HIS  83           HD2      HIS  83   0.786   3.329 -10.162
  616    HE1  HIS  83           HE1      HIS  83   4.747   3.524 -11.596
  617    HE2  HIS  83           HE2      HIS  83   2.500   4.707 -11.581
  618    H    VAL  84           HN       VAL  84   0.006  -1.453 -10.529
  619    HA   VAL  84           HA       VAL  84  -0.342  -3.323  -8.235
  620    HB   VAL  84           HB       VAL  84  -1.629  -3.217 -11.001
  621   1HG1  VAL  84          2HG12     VAL  84  -1.643  -5.395  -8.925
  622   2HG1  VAL  84          3HG13     VAL  84  -2.764  -5.250 -10.323
  623   3HG1  VAL  84          1HG11     VAL  84  -1.030  -5.497 -10.601
  624   1HG2  VAL  84          1HG21     VAL  84  -2.546  -1.889  -9.063
  625   2HG2  VAL  84          2HG22     VAL  84  -3.621  -3.254  -9.532
  626   3HG2  VAL  84          3HG23     VAL  84  -2.555  -3.396  -8.101
  627    H    TYR  85           HN       TYR  85   1.182  -4.725  -8.038
  628    HA   TYR  85           HA       TYR  85   2.668  -5.447 -10.488
  629   1HB   TYR  85          1HB       TYR  85   3.679  -5.390  -7.605
  630   2HB   TYR  85          2HB       TYR  85   4.595  -6.012  -8.978
  631    HD1  TYR  85           HD1      TYR  85   3.169  -2.911  -7.481
  632    HD2  TYR  85           HD2      TYR  85   5.852  -4.586 -10.403
  633    HE1  TYR  85           HE1      TYR  85   4.089  -0.659  -7.957
  634    HE2  TYR  85           HE2      TYR  85   6.634  -2.310 -10.989
  635    HH   TYR  85           HH       TYR  85   4.933   0.598  -9.940
  636    H    LYS  86           HN       LYS  86   0.678  -6.830 -10.646
  637    HA   LYS  86           HA       LYS  86   0.681  -9.312  -9.077
  638   1HB   LYS  86          2HB       LYS  86  -1.344  -8.226 -10.294
  639   2HB   LYS  86          1HB       LYS  86  -0.612  -8.832 -11.786
  640   1HG   LYS  86          2HG       LYS  86  -0.645 -11.174 -10.632
  641   2HG   LYS  86          1HG       LYS  86  -1.590 -10.388  -9.364
  642   1HD   LYS  86          1HD       LYS  86  -3.258 -11.291 -10.753
  643   2HD   LYS  86          2HD       LYS  86  -3.171  -9.610 -11.286
  644   1HE   LYS  86          1HE       LYS  86  -3.241 -10.964 -13.260
  645   2HE   LYS  86          2HE       LYS  86  -1.570 -10.400 -13.140
  646   1HZ   LYS  86          2HZ       LYS  86  -1.041 -12.573 -12.146
  647   2HZ   LYS  86          1HZ       LYS  86  -2.613 -13.031 -12.349
  648   3HZ   LYS  86          3HZ       LYS  86  -1.673 -12.706 -13.659
  649    H    ASP  87           HN       ASP  87   1.519 -11.319  -9.980
  650    HA   ASP  87           HA       ASP  87   2.926 -12.681 -11.065
  651   1HB   ASP  87          1HB       ASP  87   1.886 -11.698 -13.177
  652   2HB   ASP  87          2HB       ASP  87   3.245 -10.591 -13.287
  653    H    GLY  88           HN       GLY  88   4.081  -9.383 -11.466
  654   1HA   GLY  88          1HA       GLY  88   6.148  -9.438  -9.579
  655   2HA   GLY  88          2HA       GLY  88   6.894 -10.056 -11.068
  656    H    VAL  89           HN       VAL  89   5.955  -8.667 -13.068
  657    HA   VAL  89           HA       VAL  89   7.122  -6.021 -12.704
  658    HB   VAL  89           HB       VAL  89   7.450  -7.484 -14.704
  659   1HG1  VAL  89          3HG13     VAL  89   5.132  -8.376 -14.942
  660   2HG1  VAL  89          1HG11     VAL  89   4.573  -6.766 -15.436
  661   3HG1  VAL  89          2HG12     VAL  89   5.736  -7.649 -16.436
  662   1HG2  VAL  89          2HG22     VAL  89   7.819  -5.011 -14.809
  663   2HG2  VAL  89          3HG23     VAL  89   7.424  -5.771 -16.360
  664   3HG2  VAL  89          1HG21     VAL  89   6.190  -4.838 -15.509
  665    H    LYS  90           HN       LYS  90   5.945  -4.039 -13.435
  666    HA   LYS  90           HA       LYS  90   3.491  -3.556 -12.128
  667   1HB   LYS  90          1HB       LYS  90   5.109  -1.835 -12.825
  668   2HB   LYS  90          2HB       LYS  90   4.660  -2.105 -14.517
  669   1HG   LYS  90          2HG       LYS  90   2.411  -1.297 -14.124
  670   2HG   LYS  90          1HG       LYS  90   2.600  -1.384 -12.371
  671   1HD   LYS  90          2HD       LYS  90   2.749   0.935 -13.149
  672   2HD   LYS  90          1HD       LYS  90   4.282   0.420 -12.416
  673   1HE   LYS  90          1HE       LYS  90   5.321   0.138 -14.588
  674   2HE   LYS  90          2HE       LYS  90   3.753   0.315 -15.397
  675   1HZ   LYS  90          3HZ       LYS  90   3.725   2.595 -14.580
  676   2HZ   LYS  90          2HZ       LYS  90   5.219   2.398 -13.898
  677   3HZ   LYS  90          1HZ       LYS  90   5.040   2.309 -15.530
  678    H    ALA  91           HN       ALA  91   1.761  -4.801 -12.565
  679    HA   ALA  91           HA       ALA  91   1.207  -5.934 -15.205
  680   1HB   ALA  91          1HB       ALA  91   0.792  -7.155 -13.063
  681   2HB   ALA  91          2HB       ALA  91  -0.409  -5.921 -12.626
  682   3HB   ALA  91          3HB       ALA  91  -0.700  -6.963 -14.022
  683    H    ASP  92           HN       ASP  92  -0.039  -3.391 -13.086
  684    HA   ASP  92           HA       ASP  92  -1.496  -2.059 -15.199
  685   1HB   ASP  92          1HB       ASP  92  -3.057  -3.910 -14.642
  686   2HB   ASP  92          2HB       ASP  92  -2.950  -3.492 -12.925
  687    H    ASP  93           HN       ASP  93  -2.658  -0.074 -14.063
  688    HA   ASP  93           HA       ASP  93  -1.842   0.537 -11.429
  689   1HB   ASP  93          2HB       ASP  93  -0.370   2.490 -11.891
  690   2HB   ASP  93          1HB       ASP  93   0.379   1.000 -12.425
  691    H    LEU  94           HN       LEU  94  -2.237   2.997 -11.058
  692    HA   LEU  94           HA       LEU  94  -4.278   4.269 -12.732
  693   1HB   LEU  94          2HB       LEU  94  -5.651   2.651 -11.686
  694   2HB   LEU  94          1HB       LEU  94  -4.872   2.853 -10.110
  695    HG   LEU  94           HG       LEU  94  -5.892   5.054  -9.829
  696   1HD1  LEU  94          2HD12     LEU  94  -7.039   4.524 -12.614
  697   2HD1  LEU  94          1HD11     LEU  94  -7.633   5.798 -11.526
  698   3HD1  LEU  94          3HD13     LEU  94  -5.983   5.870 -12.144
  699   1HD2  LEU  94          1HD21     LEU  94  -7.071   3.024  -9.130
  700   2HD2  LEU  94          3HD23     LEU  94  -8.206   4.287  -9.614
  701   3HD2  LEU  94          2HD22     LEU  94  -7.886   2.929 -10.708
  702    H    VAL  95           HN       VAL  95  -3.457   6.321 -12.660
  703    HA   VAL  95           HA       VAL  95  -2.001   7.304 -10.349
  704    HB   VAL  95           HB       VAL  95  -1.825   9.381 -11.629
  705   1HG1  VAL  95          1HG21     VAL  95  -0.236   7.537 -12.037
  706   2HG1  VAL  95          2HG22     VAL  95  -1.266   6.925 -13.348
  707   3HG1  VAL  95          3HG23     VAL  95  -0.502   8.520 -13.486
  708   1HG2  VAL  95          3HG13     VAL  95  -4.043   9.409 -12.749
  709   2HG2  VAL  95          2HG12     VAL  95  -2.711   9.593 -13.897
  710   3HG2  VAL  95          1HG11     VAL  95  -3.549   8.040 -13.767
  711    H    GLY  96           HN       GLY  96  -2.573   9.247  -9.112
  712   1HA   GLY  96          1HA       GLY  96  -3.966  10.856  -8.248
  713   2HA   GLY  96          2HA       GLY  96  -5.289  10.311  -9.298
  714    H    ALA  97           HN       ALA  97  -6.232  10.855  -7.039
  715    HA   ALA  97           HA       ALA  97  -6.026   9.032  -4.862
  716   1HB   ALA  97          2HB       ALA  97  -7.029  11.335  -4.776
  717   2HB   ALA  97          3HB       ALA  97  -8.414  10.753  -5.715
  718   3HB   ALA  97          1HB       ALA  97  -8.096  10.092  -4.099
  719    H    SER  98           HN       SER  98  -8.342   9.326  -7.490
  720    HA   SER  98           HA       SER  98 -10.107   7.986  -8.198
  721   1HB   SER  98          2HB       SER  98  -7.565   6.400  -8.700
  722   2HB   SER  98          1HB       SER  98  -8.979   6.549  -9.777
  723    HG   SER  98           HG       SER  98  -6.912   7.983 -10.029
  724    H    GLN  99           HN       GLN  99 -10.238   7.362  -5.484
  725    HA   GLN  99           HA       GLN  99  -9.712   4.722  -4.747
  726   1HB   GLN  99          1HB       GLN  99 -11.992   6.514  -3.775
  727   2HB   GLN  99          2HB       GLN  99 -11.418   5.031  -3.011
  728   1HG   GLN  99          1HG       GLN  99 -10.240   6.481  -1.762
  729   2HG   GLN  99          2HG       GLN  99  -9.050   6.266  -3.050
  730   1HE2  GLN  99          2HE22     GLN  99  -9.882   9.954  -2.172
  731   2HE2  GLN  99          1HE21     GLN  99  -9.677   8.574  -1.108
  732    H    ASP 100           HN       ASP 100 -12.633   6.003  -6.340
  733    HA   ASP 100           HA       ASP 100 -14.296   3.715  -6.080
  734   1HB   ASP 100          1HB       ASP 100 -15.581   4.680  -7.897
  735   2HB   ASP 100          2HB       ASP 100 -15.109   5.950  -6.766
  736    H    LYS 101           HN       LYS 101 -12.156   4.721  -8.767
  737    HA   LYS 101           HA       LYS 101 -12.549   2.278 -10.243
  738   1HB   LYS 101          1HB       LYS 101 -11.932   4.499 -11.171
  739   2HB   LYS 101          2HB       LYS 101 -10.310   4.330 -10.489
  740   1HG   LYS 101          1HG       LYS 101  -9.973   2.260 -11.834
  741   2HG   LYS 101          2HG       LYS 101 -11.609   2.401 -12.486
  742   1HD   LYS 101          2HD       LYS 101  -9.411   4.489 -12.857
  743   2HD   LYS 101          1HD       LYS 101  -9.794   3.209 -14.019
  744   1HE   LYS 101          1HE       LYS 101 -12.132   4.117 -14.203
  745   2HE   LYS 101          2HE       LYS 101 -11.663   5.467 -13.151
  746   1HZ   LYS 101          1HZ       LYS 101 -10.015   6.075 -14.751
  747   2HZ   LYS 101          3HZ       LYS 101 -10.453   4.829 -15.740
  748   3HZ   LYS 101          2HZ       LYS 101 -11.515   6.050 -15.432
  749    H    LEU 102           HN       LEU 102 -10.106   3.385  -7.858
  750    HA   LEU 102           HA       LEU 102  -8.262   1.306  -8.132
  751   1HB   LEU 102          1HB       LEU 102  -7.968   3.299  -6.651
  752   2HB   LEU 102          2HB       LEU 102  -9.168   2.636  -5.533
  753    HG   LEU 102           HG       LEU 102  -7.744   0.663  -5.108
  754   1HD1  LEU 102          2HD22     LEU 102  -5.798   2.180  -6.893
  755   2HD1  LEU 102          1HD21     LEU 102  -5.317   0.881  -5.777
  756   3HD1  LEU 102          3HD23     LEU 102  -6.392   0.522  -7.132
  757   1HD2  LEU 102          1HD11     LEU 102  -6.569   3.432  -4.669
  758   2HD2  LEU 102          2HD12     LEU 102  -7.725   2.584  -3.621
  759   3HD2  LEU 102          3HD13     LEU 102  -6.076   1.960  -3.807
  760    H    LYS 103           HN       LYS 103 -11.210   1.378  -6.012
  761    HA   LYS 103           HA       LYS 103 -10.971  -1.233  -4.981
  762   1HB   LYS 103          2HB       LYS 103 -13.374   0.457  -5.741
  763   2HB   LYS 103          1HB       LYS 103 -13.515  -1.086  -4.893
  764   1HG   LYS 103          2HG       LYS 103 -12.013  -0.245  -3.109
  765   2HG   LYS 103          1HG       LYS 103 -11.998   1.352  -3.851
  766   1HD   LYS 103          1HD       LYS 103 -14.511  -0.087  -2.839
  767   2HD   LYS 103          2HD       LYS 103 -13.544   1.051  -1.904
  768   1HE   LYS 103          1HE       LYS 103 -15.317   2.349  -2.662
  769   2HE   LYS 103          2HE       LYS 103 -13.976   2.801  -3.724
  770   1HZ   LYS 103          1HZ       LYS 103 -16.090   0.854  -4.381
  771   2HZ   LYS 103          3HZ       LYS 103 -16.098   2.436  -4.837
  772   3HZ   LYS 103          2HZ       LYS 103 -14.940   1.429  -5.412
  773    H    ALA 104           HN       ALA 104 -12.542  -0.152  -8.037
  774    HA   ALA 104           HA       ALA 104 -13.402  -2.721  -8.886
  775   1HB   ALA 104          2HB       ALA 104 -14.149  -0.571  -9.893
  776   2HB   ALA 104          3HB       ALA 104 -12.550  -0.373 -10.642
  777   3HB   ALA 104          1HB       ALA 104 -13.577  -1.737 -11.101
  778    H    LEU 105           HN       LEU 105 -10.252  -1.020  -9.424
  779    HA   LEU 105           HA       LEU 105  -9.170  -3.112 -11.079
  780   1HB   LEU 105          2HB       LEU 105  -7.754  -1.053  -9.347
  781   2HB   LEU 105          1HB       LEU 105  -6.966  -2.152 -10.478
  782    HG   LEU 105           HG       LEU 105  -8.930   0.066 -11.173
  783   1HD1  LEU 105          3HD13     LEU 105  -6.604   0.725 -10.652
  784   2HD1  LEU 105          2HD12     LEU 105  -6.005  -0.401 -11.888
  785   3HD1  LEU 105          1HD11     LEU 105  -7.006   0.982 -12.368
  786   1HD2  LEU 105          2HD22     LEU 105  -7.706  -2.041 -12.992
  787   2HD2  LEU 105          3HD23     LEU 105  -9.439  -1.704 -12.748
  788   3HD2  LEU 105          1HD21     LEU 105  -8.419  -0.522 -13.565
  789    H    VAL 106           HN       VAL 106  -8.837  -2.506  -7.518
  790    HA   VAL 106           HA       VAL 106  -7.203  -4.774  -7.030
  791    HB   VAL 106           HB       VAL 106  -9.351  -3.603  -5.191
  792   1HG1  VAL 106          3HG23     VAL 106  -6.963  -5.432  -4.642
  793   2HG1  VAL 106          1HG21     VAL 106  -7.969  -4.665  -3.394
  794   3HG1  VAL 106          2HG22     VAL 106  -8.672  -5.875  -4.472
  795   1HG2  VAL 106          2HG12     VAL 106  -6.354  -3.096  -5.459
  796   2HG2  VAL 106          3HG13     VAL 106  -7.632  -1.929  -5.806
  797   3HG2  VAL 106          1HG11     VAL 106  -7.377  -2.471  -4.145
  798    H    ALA 107           HN       ALA 107 -10.745  -4.490  -7.090
  799    HA   ALA 107           HA       ALA 107 -11.338  -7.216  -6.673
  800   1HB   ALA 107          3HB       ALA 107 -13.037  -5.424  -6.652
  801   2HB   ALA 107          1HB       ALA 107 -12.889  -5.245  -8.414
  802   3HB   ALA 107          2HB       ALA 107 -13.504  -6.758  -7.722
  803    H    LYS 108           HN       LYS 108 -10.775  -5.563  -9.833
  804    HA   LYS 108           HA       LYS 108 -11.130  -7.700 -11.593
  805   1HB   LYS 108          2HB       LYS 108 -10.722  -5.685 -12.634
  806   2HB   LYS 108          1HB       LYS 108  -9.445  -5.223 -11.557
  807   1HG   LYS 108          1HG       LYS 108  -7.847  -6.753 -12.651
  808   2HG   LYS 108          2HG       LYS 108  -9.071  -7.199 -13.828
  809   1HD   LYS 108          2HD       LYS 108  -7.915  -4.422 -13.298
  810   2HD   LYS 108          1HD       LYS 108  -7.490  -5.497 -14.633
  811   1HE   LYS 108          1HE       LYS 108  -9.869  -5.361 -15.453
  812   2HE   LYS 108          2HE       LYS 108 -10.199  -4.158 -14.189
  813   1HZ   LYS 108          1HZ       LYS 108  -8.507  -2.778 -15.133
  814   2HZ   LYS 108          3HZ       LYS 108  -8.210  -3.881 -16.321
  815   3HZ   LYS 108          2HZ       LYS 108  -9.672  -3.125 -16.246
  816    H    HIS 109           HN       HIS 109  -8.081  -6.799  -9.929
  817    HA   HIS 109           HA       HIS 109  -6.702  -9.110 -11.064
  818   1HB   HIS 109          1HB       HIS 109  -5.905  -7.120  -8.913
  819   2HB   HIS 109          2HB       HIS 109  -4.841  -8.349  -9.620
  820    HD2  HIS 109           HD2      HIS 109  -6.219  -4.821 -10.456
  821    HE1  HIS 109           HE1      HIS 109  -4.110  -6.139 -13.837
  822    HE2  HIS 109           HE2      HIS 109  -5.258  -4.141 -12.771
  823    H    ALA 110           HN       ALA 110  -7.940  -8.321  -7.799
  824    HA   ALA 110           HA       ALA 110  -6.945 -10.678  -6.513
  825   1HB   ALA 110          1HB       ALA 110  -7.582  -8.508  -5.401
  826   2HB   ALA 110          2HB       ALA 110  -9.284  -8.888  -5.725
  827   3HB   ALA 110          3HB       ALA 110  -8.334  -9.939  -4.657
  828    H    ALA 111           HN       ALA 111  -9.992  -9.940  -8.191
  829    HA   ALA 111           HA       ALA 111 -11.848 -11.121  -8.654
  830   1HB   ALA 111          1HB       ALA 111 -10.243 -12.717  -9.700
  831   2HB   ALA 111          2HB       ALA 111 -10.154 -13.623  -8.172
  832   3HB   ALA 111          3HB       ALA 111 -11.687 -13.516  -9.052
  833    H    ALA 112           HN       ALA 112 -11.737  -9.978  -6.170
  834    HA   ALA 112           HA       ALA 112 -13.600 -11.399  -4.615
  835   1HB   ALA 112          2HB       ALA 112 -10.744 -11.178  -3.534
  836   2HB   ALA 112          1HB       ALA 112 -12.178 -11.599  -2.574
  837   3HB   ALA 112          3HB       ALA 112 -11.619 -12.697  -3.849
   
  No H/Q in entry =         837
  Start of MODEL   21
    1   1H    GLY   1          1HN       GLY   1  -1.256 -13.359   0.647
    2   2H    GLY   1          3HN       GLY   1  -0.782 -12.745  -0.831
    3   3H    GLY   1          2HN       GLY   1   0.350 -13.445   0.161
    4   1HA   GLY   1          1HA       GLY   1   0.654 -11.187   0.260
    5   2HA   GLY   1          2HA       GLY   1  -1.096 -10.927   0.508
    6    H    GLY   2           HN       GLY   2  -1.352 -10.175   2.548
    7   1HA   GLY   2          1HA       GLY   2  -1.472 -10.789   4.884
    8   2HA   GLY   2          2HA       GLY   2   0.206 -11.358   4.819
    9    H    SER   3           HN       SER   3   1.688  -9.463   3.684
   10    HA   SER   3           HA       SER   3   1.893  -7.494   5.677
   11   1HB   SER   3          2HB       SER   3   3.230  -7.362   2.959
   12   2HB   SER   3          1HB       SER   3   3.830  -6.848   4.541
   13    HG   SER   3           HG       SER   3   3.788  -9.106   5.135
   14    H    VAL   4           HN       VAL   4  -0.302  -6.597   5.567
   15    HA   VAL   4           HA       VAL   4  -0.732  -4.435   3.568
   16    HB   VAL   4           HB       VAL   4  -2.338  -5.578   5.899
   17   1HG1  VAL   4          2HG22     VAL   4  -2.893  -3.107   4.228
   18   2HG1  VAL   4          3HG23     VAL   4  -4.172  -4.031   5.072
   19   3HG1  VAL   4          1HG21     VAL   4  -2.903  -3.248   5.991
   20   1HG2  VAL   4          1HG11     VAL   4  -2.755  -5.483   2.886
   21   2HG2  VAL   4          3HG13     VAL   4  -2.374  -6.922   3.851
   22   3HG2  VAL   4          2HG12     VAL   4  -3.932  -6.099   4.050
   23    H    ILE   5           HN       ILE   5   0.946  -2.899   4.006
   24    HA   ILE   5           HA       ILE   5   0.567  -1.364   6.468
   25    HB   ILE   5           HB       ILE   5   2.993  -1.417   7.077
   26   1HG1  ILE   5          1HG11     ILE   5   3.206  -3.869   5.281
   27   2HG1  ILE   5          2HG12     ILE   5   3.805  -2.266   4.832
   28   1HG2  ILE   5          2HG22     ILE   5   1.298  -2.845   8.271
   29   2HG2  ILE   5          1HG21     ILE   5   1.849  -4.223   7.283
   30   3HG2  ILE   5          3HG23     ILE   5   2.962  -3.400   8.383
   31   1HD1  ILE   5          3HD13     ILE   5   5.237  -2.250   6.895
   32   2HD1  ILE   5          2HD12     ILE   5   4.789  -3.954   7.156
   33   3HD1  ILE   5          1HD11     ILE   5   5.669  -3.480   5.698
   34    H    VAL   6           HN       VAL   6   2.107   0.496   6.516
   35    HA   VAL   6           HA       VAL   6   2.468   1.644   3.826
   36    HB   VAL   6           HB       VAL   6   2.727   3.762   4.928
   37   1HG1  VAL   6          3HG13     VAL   6   0.351   2.867   4.738
   38   2HG1  VAL   6          1HG11     VAL   6   0.462   2.372   6.433
   39   3HG1  VAL   6          2HG12     VAL   6   0.584   4.085   6.003
   40   1HG2  VAL   6          2HG22     VAL   6   2.711   2.280   7.597
   41   2HG2  VAL   6          3HG23     VAL   6   4.076   3.165   6.881
   42   3HG2  VAL   6          1HG21     VAL   6   2.632   4.040   7.398
   43    H    ILE   7           HN       ILE   7   4.726   2.329   3.235
   44    HA   ILE   7           HA       ILE   7   6.798   1.415   5.071
   45    HB   ILE   7           HB       ILE   7   5.962  -0.656   3.824
   46   1HG1  ILE   7          1HG11     ILE   7   8.115  -1.549   3.238
   47   2HG1  ILE   7          2HG12     ILE   7   8.866   0.044   3.231
   48   1HG2  ILE   7          3HG23     ILE   7   5.490   0.485   1.648
   49   2HG2  ILE   7          2HG22     ILE   7   7.239   0.672   1.389
   50   3HG2  ILE   7          1HG21     ILE   7   6.520  -0.942   1.475
   51   1HD1  ILE   7          3HD13     ILE   7   7.527  -1.223   5.671
   52   2HD1  ILE   7          2HD12     ILE   7   9.264  -1.303   5.339
   53   3HD1  ILE   7          1HD11     ILE   7   8.521   0.252   5.665
   54    H    ASP   8           HN       ASP   8   8.915   2.054   4.498
   55    HA   ASP   8           HA       ASP   8   9.105   4.143   2.394
   56   1HB   ASP   8          1HB       ASP   8  10.182   5.561   4.087
   57   2HB   ASP   8          2HB       ASP   8   8.585   5.088   4.668
   58    H    SER   9           HN       SER   9  10.106   1.385   2.209
   59    HA   SER   9           HA       SER   9  12.915   2.029   1.691
   60   1HB   SER   9          2HB       SER   9  12.135  -0.011   3.800
   61   2HB   SER   9          1HB       SER   9  13.708   0.004   2.980
   62    HG   SER   9           HG       SER   9  12.860   2.419   4.094
   63    H    LYS  10           HN       LYS  10  13.425   1.132  -0.167
   64    HA   LYS  10           HA       LYS  10  11.884  -0.551  -1.744
   65   1HB   LYS  10          1HB       LYS  10  13.748   0.765  -2.562
   66   2HB   LYS  10          2HB       LYS  10  14.912  -0.197  -1.639
   67   1HG   LYS  10          1HG       LYS  10  14.422  -2.198  -2.922
   68   2HG   LYS  10          2HG       LYS  10  13.083  -1.395  -3.763
   69   1HD   LYS  10          1HD       LYS  10  14.617   0.024  -4.977
   70   2HD   LYS  10          2HD       LYS  10  15.974  -0.433  -3.936
   71   1HE   LYS  10          2HE       LYS  10  15.975  -1.570  -6.189
   72   2HE   LYS  10          1HE       LYS  10  16.041  -2.671  -4.804
   73   1HZ   LYS  10          1HZ       LYS  10  13.576  -2.024  -6.255
   74   2HZ   LYS  10          3HZ       LYS  10  14.499  -3.367  -6.509
   75   3HZ   LYS  10          2HZ       LYS  10  13.771  -3.146  -5.052
   76    H    ALA  11           HN       ALA  11  14.485  -1.382   0.524
   77    HA   ALA  11           HA       ALA  11  14.761  -4.133  -0.020
   78   1HB   ALA  11          2HB       ALA  11  14.974  -2.714   2.681
   79   2HB   ALA  11          1HB       ALA  11  15.622  -4.323   2.296
   80   3HB   ALA  11          3HB       ALA  11  16.271  -2.888   1.478
   81    H    ALA  12           HN       ALA  12  12.560  -2.542   2.305
   82    HA   ALA  12           HA       ALA  12  11.286  -4.960   3.204
   83   1HB   ALA  12          1HB       ALA  12  10.408  -2.052   3.283
   84   2HB   ALA  12          2HB       ALA  12   9.626  -3.393   4.159
   85   3HB   ALA  12          3HB       ALA  12  11.294  -2.925   4.551
   86    H    TRP  13           HN       TRP  13  10.597  -2.576   0.617
   87    HA   TRP  13           HA       TRP  13   8.045  -3.581  -0.167
   88   1HB   TRP  13          2HB       TRP  13   8.355  -1.672  -1.270
   89   2HB   TRP  13          1HB       TRP  13  10.088  -1.758  -1.204
   90    HD1  TRP  13           HD1      TRP  13  11.265  -3.327  -3.226
   91    HE1  TRP  13           HE1      TRP  13  10.707  -3.394  -5.704
   92    HE3  TRP  13           HE3      TRP  13   6.636  -1.180  -3.039
   93    HZ2  TRP  13           HZ2      TRP  13   8.652  -2.410  -7.420
   94    HZ3  TRP  13           HZ3      TRP  13   5.583  -0.441  -5.142
   95    HH2  TRP  13           HH2      TRP  13   6.490  -1.157  -7.343
   96    H    ASP  14           HN       ASP  14  11.331  -4.481  -1.351
   97    HA   ASP  14           HA       ASP  14  10.371  -6.541  -3.101
   98   1HB   ASP  14          2HB       ASP  14  13.103  -6.180  -1.791
   99   2HB   ASP  14          1HB       ASP  14  12.706  -7.400  -3.018
  100    H    ALA  15           HN       ALA  15  11.619  -6.632   0.228
  101    HA   ALA  15           HA       ALA  15  11.495  -9.398   0.675
  102   1HB   ALA  15          2HB       ALA  15  12.458  -7.752   2.273
  103   2HB   ALA  15          1HB       ALA  15  10.817  -7.196   2.676
  104   3HB   ALA  15          3HB       ALA  15  11.314  -8.855   3.057
  105    H    GLN  16           HN       GLN  16   8.928  -6.975   1.171
  106    HA   GLN  16           HA       GLN  16   6.850  -8.759   1.980
  107   1HB   GLN  16          2HB       GLN  16   6.853  -6.021   0.697
  108   2HB   GLN  16          1HB       GLN  16   5.353  -6.891   1.073
  109   1HG   GLN  16          1HG       GLN  16   5.887  -7.100   3.383
  110   2HG   GLN  16          2HG       GLN  16   7.529  -6.484   3.167
  111   1HE2  GLN  16          1HE21     GLN  16   6.553  -3.056   2.725
  112   2HE2  GLN  16          2HE22     GLN  16   7.708  -4.289   2.179
  113    H    LEU  17           HN       LEU  17   7.654  -7.451  -1.288
  114    HA   LEU  17           HA       LEU  17   5.720  -8.782  -2.802
  115   1HB   LEU  17          1HB       LEU  17   8.408  -7.634  -3.270
  116   2HB   LEU  17          2HB       LEU  17   8.111  -9.017  -4.301
  117    HG   LEU  17           HG       LEU  17   5.952  -7.942  -5.026
  118   1HD1  LEU  17          1HD11     LEU  17   7.099  -5.522  -3.552
  119   2HD1  LEU  17          3HD13     LEU  17   5.701  -5.515  -4.632
  120   3HD1  LEU  17          2HD12     LEU  17   5.621  -6.401  -3.098
  121   1HD2  LEU  17          1HD21     LEU  17   7.999  -7.804  -6.386
  122   2HD2  LEU  17          2HD22     LEU  17   7.055  -6.311  -6.515
  123   3HD2  LEU  17          3HD23     LEU  17   8.511  -6.353  -5.496
  124    H    ALA  18           HN       ALA  18   8.900 -10.054  -1.773
  125    HA   ALA  18           HA       ALA  18   8.511 -12.645  -2.919
  126   1HB   ALA  18          2HB       ALA  18  10.708 -11.712  -2.379
  127   2HB   ALA  18          1HB       ALA  18  10.334 -11.741  -0.645
  128   3HB   ALA  18          3HB       ALA  18  10.462 -13.265  -1.550
  129    H    LYS  19           HN       LYS  19   8.442 -11.795   0.637
  130    HA   LYS  19           HA       LYS  19   7.593 -14.407   1.370
  131   1HB   LYS  19          2HB       LYS  19   7.227 -13.528   3.563
  132   2HB   LYS  19          1HB       LYS  19   8.681 -12.785   2.882
  133   1HG   LYS  19          2HG       LYS  19   7.288 -10.777   2.329
  134   2HG   LYS  19          1HG       LYS  19   5.893 -11.536   3.075
  135   1HD   LYS  19          2HD       LYS  19   6.749 -10.026   4.674
  136   2HD   LYS  19          1HD       LYS  19   7.142 -11.653   5.249
  137   1HE   LYS  19          1HE       LYS  19   9.480 -11.376   4.437
  138   2HE   LYS  19          2HE       LYS  19   9.061  -9.790   3.765
  139   1HZ   LYS  19          2HZ       LYS  19   8.592  -9.049   5.981
  140   2HZ   LYS  19          3HZ       LYS  19   8.972 -10.528   6.602
  141   3HZ   LYS  19          1HZ       LYS  19  10.135  -9.616   5.875
  142    H    GLY  20           HN       GLY  20   5.722 -11.580   0.353
  143   1HA   GLY  20          1HA       GLY  20   3.179 -12.224   1.269
  144   2HA   GLY  20          2HA       GLY  20   3.561 -11.349  -0.225
  145    H    LYS  21           HN       LYS  21   5.088 -13.850  -1.235
  146    HA   LYS  21           HA       LYS  21   4.721 -15.519  -2.640
  147   1HB   LYS  21          2HB       LYS  21   3.802 -16.359  -0.233
  148   2HB   LYS  21          1HB       LYS  21   2.267 -16.344  -1.076
  149   1HG   LYS  21          1HG       LYS  21   2.854 -18.423  -1.573
  150   2HG   LYS  21          2HG       LYS  21   3.699 -17.705  -2.934
  151   1HD   LYS  21          2HD       LYS  21   4.873 -18.603  -0.240
  152   2HD   LYS  21          1HD       LYS  21   5.046 -19.409  -1.798
  153   1HE   LYS  21          1HE       LYS  21   7.104 -18.345  -1.494
  154   2HE   LYS  21          2HE       LYS  21   6.257 -17.289  -2.628
  155   1HZ   LYS  21          1HZ       LYS  21   5.696 -15.906  -0.697
  156   2HZ   LYS  21          2HZ       LYS  21   6.555 -16.906   0.283
  157   3HZ   LYS  21          3HZ       LYS  21   7.310 -16.041  -0.903
  158    H    GLU  22           HN       GLU  22   3.815 -13.184  -3.587
  159    HA   GLU  22           HA       GLU  22   1.045 -13.254  -4.402
  160   1HB   GLU  22          1HB       GLU  22   3.419 -11.487  -5.188
  161   2HB   GLU  22          2HB       GLU  22   1.723 -11.128  -5.549
  162   1HG   GLU  22          1HG       GLU  22   2.865 -11.407  -2.730
  163   2HG   GLU  22          2HG       GLU  22   2.536  -9.902  -3.555
  164    H    GLU  23           HN       GLU  23   2.229 -15.567  -5.329
  165    HA   GLU  23           HA       GLU  23   3.354 -16.256  -7.529
  166   1HB   GLU  23          1HB       GLU  23   1.806 -17.684  -6.234
  167   2HB   GLU  23          2HB       GLU  23   0.415 -16.908  -7.000
  168   1HG   GLU  23          1HG       GLU  23   1.173 -17.788  -9.219
  169   2HG   GLU  23          2HG       GLU  23   2.564 -18.542  -8.424
  170    H    HIS  24           HN       HIS  24   0.033 -15.062  -7.977
  171    HA   HIS  24           HA       HIS  24   0.766 -13.567 -10.423
  172   1HB   HIS  24          2HB       HIS  24  -1.177 -14.603 -11.601
  173   2HB   HIS  24          1HB       HIS  24   0.001 -15.839 -11.147
  174    HD2  HIS  24           HD2      HIS  24  -3.592 -14.630 -10.127
  175    HE1  HIS  24           HE1      HIS  24  -2.733 -18.134  -7.920
  176    HE2  HIS  24           HE2      HIS  24  -4.530 -16.373  -8.417
  177    H    LYS  25           HN       LYS  25   0.119 -12.894  -7.622
  178    HA   LYS  25           HA       LYS  25  -2.711 -11.950  -7.763
  179   1HB   LYS  25          2HB       LYS  25  -0.903 -12.544  -5.413
  180   2HB   LYS  25          1HB       LYS  25  -2.497 -11.780  -5.266
  181   1HG   LYS  25          1HG       LYS  25  -3.604 -13.673  -6.307
  182   2HG   LYS  25          2HG       LYS  25  -2.062 -14.454  -6.680
  183   1HD   LYS  25          1HD       LYS  25  -1.545 -14.650  -4.268
  184   2HD   LYS  25          2HD       LYS  25  -3.110 -13.917  -3.870
  185   1HE   LYS  25          1HE       LYS  25  -2.733 -16.464  -5.524
  186   2HE   LYS  25          2HE       LYS  25  -3.118 -16.436  -3.791
  187   1HZ   LYS  25          2HZ       LYS  25  -5.124 -15.194  -4.393
  188   2HZ   LYS  25          1HZ       LYS  25  -4.817 -15.447  -5.989
  189   3HZ   LYS  25          3HZ       LYS  25  -5.088 -16.722  -5.006
  190    HA   PRO  26           HA       PRO  26  -1.277  -7.853  -7.966
  191   1HB   PRO  26          1HB       PRO  26  -3.321  -6.403  -6.774
  192   2HB   PRO  26          2HB       PRO  26  -3.365  -7.120  -8.405
  193   1HG   PRO  26          2HG       PRO  26  -4.646  -8.176  -5.892
  194   2HG   PRO  26          1HG       PRO  26  -5.224  -8.217  -7.546
  195   1HD   PRO  26          2HD       PRO  26  -4.009 -10.396  -6.374
  196   2HD   PRO  26          1HD       PRO  26  -3.970 -10.064  -8.125
  197    H    ILE  27           HN       ILE  27   0.160  -6.673  -7.080
  198    HA   ILE  27           HA       ILE  27   0.145  -6.244  -4.143
  199    HB   ILE  27           HB       ILE  27   2.425  -6.045  -4.097
  200   1HG1  ILE  27          2HG12     ILE  27   3.835  -6.026  -6.293
  201   2HG1  ILE  27          1HG11     ILE  27   2.352  -5.386  -7.005
  202   1HG2  ILE  27          3HG23     ILE  27   1.596  -8.366  -4.787
  203   2HG2  ILE  27          1HG21     ILE  27   2.198  -8.008  -6.414
  204   3HG2  ILE  27          2HG22     ILE  27   3.324  -8.041  -5.046
  205   1HD1  ILE  27          1HD11     ILE  27   3.854  -4.205  -4.618
  206   2HD1  ILE  27          2HD12     ILE  27   3.933  -3.602  -6.285
  207   3HD1  ILE  27          3HD13     ILE  27   2.422  -3.494  -5.364
  208    H    VAL  28           HN       VAL  28  -0.749  -4.332  -3.704
  209    HA   VAL  28           HA       VAL  28  -1.278  -2.450  -5.940
  210    HB   VAL  28           HB       VAL  28  -2.660  -2.607  -3.247
  211   1HG1  VAL  28          2HG12     VAL  28  -2.816  -0.505  -4.661
  212   2HG1  VAL  28          1HG11     VAL  28  -3.537  -1.479  -5.949
  213   3HG1  VAL  28          3HG13     VAL  28  -4.379  -1.313  -4.395
  214   1HG2  VAL  28          2HG22     VAL  28  -3.496  -3.961  -5.849
  215   2HG2  VAL  28          1HG21     VAL  28  -3.013  -4.793  -4.355
  216   3HG2  VAL  28          3HG23     VAL  28  -4.481  -3.827  -4.376
  217    H    VAL  29           HN       VAL  29   0.169  -0.800  -5.942
  218    HA   VAL  29           HA       VAL  29   1.498  -0.070  -3.396
  219    HB   VAL  29           HB       VAL  29   2.140   1.192  -6.057
  220   1HG1  VAL  29          3HG23     VAL  29   3.048   2.134  -3.940
  221   2HG1  VAL  29          2HG22     VAL  29   3.711   0.542  -3.524
  222   3HG1  VAL  29          1HG21     VAL  29   4.339   1.433  -4.913
  223   1HG2  VAL  29          2HG12     VAL  29   2.261  -1.240  -6.501
  224   2HG2  VAL  29          3HG13     VAL  29   3.845  -0.476  -6.469
  225   3HG2  VAL  29          1HG11     VAL  29   3.303  -1.418  -5.060
  226    H    ASP  30           HN       ASP  30   1.038   1.900  -2.451
  227    HA   ASP  30           HA       ASP  30  -0.644   3.883  -3.981
  228   1HB   ASP  30          2HB       ASP  30  -1.917   3.127  -2.085
  229   2HB   ASP  30          1HB       ASP  30  -0.597   3.384  -0.976
  230    H    PHE  31           HN       PHE  31   1.192   4.797  -4.991
  231    HA   PHE  31           HA       PHE  31   3.522   5.531  -3.338
  232   1HB   PHE  31          2HB       PHE  31   2.822   6.088  -6.232
  233   2HB   PHE  31          1HB       PHE  31   4.262   6.633  -5.428
  234    HD1  PHE  31           HD2      PHE  31   6.003   5.033  -4.621
  235    HD2  PHE  31           HD1      PHE  31   2.681   3.790  -7.076
  236    HE1  PHE  31           HE2      PHE  31   7.404   3.259  -5.620
  237    HE2  PHE  31           HE1      PHE  31   4.098   2.005  -8.062
  238    HZ   PHE  31           HZ       PHE  31   6.474   1.800  -7.432
  239    H    THR  32           HN       THR  32   2.888   6.983  -1.855
  240    HA   THR  32           HA       THR  32   1.892   9.630  -2.731
  241    HB   THR  32           HB       THR  32   0.695   7.837  -0.580
  242    HG1  THR  32           HG1      THR  32  -0.488   7.635  -2.356
  243   1HG2  THR  32          2HG22     THR  32   0.393  10.846  -0.941
  244   2HG2  THR  32          1HG21     THR  32  -0.741   9.835  -0.014
  245   3HG2  THR  32          3HG23     THR  32   0.932   9.997   0.525
  246    H    ALA  33           HN       ALA  33   2.629  11.308  -1.286
  247    HA   ALA  33           HA       ALA  33   5.181  10.593   0.075
  248   1HB   ALA  33          3HB       ALA  33   5.247  12.240  -1.782
  249   2HB   ALA  33          1HB       ALA  33   4.076  13.254  -0.919
  250   3HB   ALA  33          2HB       ALA  33   5.690  12.979  -0.239
  251    H    THR  34           HN       THR  34   5.653  12.413   1.851
  252    HA   THR  34           HA       THR  34   3.734  12.162   4.024
  253    HB   THR  34           HB       THR  34   5.626  13.656   5.035
  254    HG1  THR  34           HG1      THR  34   7.584  13.351   3.587
  255   1HG2  THR  34          2HG22     THR  34   6.300  10.909   3.880
  256   2HG2  THR  34          3HG23     THR  34   7.168  11.712   5.204
  257   3HG2  THR  34          1HG21     THR  34   5.477  11.219   5.420
  258    H    TRP  35           HN       TRP  35   5.430  14.775   2.406
  259    HA   TRP  35           HA       TRP  35   3.621  16.907   3.027
  260   1HB   TRP  35          2HB       TRP  35   4.830  18.030   1.068
  261   2HB   TRP  35          1HB       TRP  35   5.817  17.493   2.422
  262    HD1  TRP  35           HD1      TRP  35   7.714  15.806   1.983
  263    HE1  TRP  35           HE1      TRP  35   8.684  14.617  -0.053
  264    HE3  TRP  35           HE3      TRP  35   4.073  16.981  -1.436
  265    HZ2  TRP  35           HZ2      TRP  35   7.940  14.159  -2.802
  266    HZ3  TRP  35           HZ3      TRP  35   4.223  16.121  -3.743
  267    HH2  TRP  35           HH2      TRP  35   6.133  14.691  -4.438
  268    H    CYS  36           HN       CYS  36   2.057  17.856   1.792
  269    HA   CYS  36           HA       CYS  36   0.918  17.988  -0.470
  270   1HB   CYS  36          2HB       CYS  36   1.120  15.740  -1.282
  271   2HB   CYS  36          1HB       CYS  36   0.417  15.068   0.204
  272    H    GLY  37           HN       GLY  37  -0.120  15.942   2.239
  273   1HA   GLY  37          1HA       GLY  37  -1.411  16.655   4.099
  274   2HA   GLY  37          2HA       GLY  37  -2.066  18.000   3.167
  275    HA   PRO  38           HA       PRO  38  -5.800  15.701   2.469
  276   1HB   PRO  38          1HB       PRO  38  -5.383  16.322  -0.473
  277   2HB   PRO  38          2HB       PRO  38  -6.902  16.382   0.470
  278   1HG   PRO  38          2HG       PRO  38  -5.551  18.677   0.027
  279   2HG   PRO  38          1HG       PRO  38  -6.132  18.325   1.683
  280   1HD   PRO  38          1HD       PRO  38  -3.362  17.928   0.547
  281   2HD   PRO  38          2HD       PRO  38  -3.846  18.661   2.108
  282    H    CYS  39           HN       CYS  39  -3.233  15.009   0.138
  283    HA   CYS  39           HA       CYS  39  -3.896  12.558  -0.933
  284   1HB   CYS  39          2HB       CYS  39  -1.161  13.309   0.189
  285   2HB   CYS  39          1HB       CYS  39  -1.523  12.011  -0.943
  286    H    LYS  40           HN       LYS  40  -2.611  13.220   2.335
  287    HA   LYS  40           HA       LYS  40  -2.012  10.551   3.054
  288   1HB   LYS  40          2HB       LYS  40  -1.279  12.802   4.125
  289   2HB   LYS  40          1HB       LYS  40  -2.850  12.816   4.912
  290   1HG   LYS  40          2HG       LYS  40  -1.134  11.987   6.412
  291   2HG   LYS  40          1HG       LYS  40  -2.320  10.722   6.089
  292   1HD   LYS  40          1HD       LYS  40   0.028   9.911   6.150
  293   2HD   LYS  40          2HD       LYS  40  -0.778   9.547   4.629
  294   1HE   LYS  40          2HE       LYS  40   0.421  11.417   3.514
  295   2HE   LYS  40          1HE       LYS  40   1.133  11.909   5.057
  296   1HZ   LYS  40          1HZ       LYS  40   1.523   9.282   3.819
  297   2HZ   LYS  40          3HZ       LYS  40   2.512  10.567   3.556
  298   3HZ   LYS  40          2HZ       LYS  40   2.370   9.927   5.078
  299    H    MET  41           HN       MET  41  -5.056  12.339   3.035
  300    HA   MET  41           HA       MET  41  -6.465  10.658   4.948
  301   1HB   MET  41          2HB       MET  41  -7.552  12.463   2.732
  302   2HB   MET  41          1HB       MET  41  -8.449  11.834   4.118
  303   1HG   MET  41          2HG       MET  41  -7.020  13.102   5.664
  304   2HG   MET  41          1HG       MET  41  -6.072  13.737   4.312
  305   1HE   MET  41          2HE       MET  41  -6.332  16.154   5.204
  306   2HE   MET  41          1HE       MET  41  -7.902  16.903   5.583
  307   3HE   MET  41          3HE       MET  41  -7.305  15.550   6.571
  308    H    ILE  42           HN       ILE  42  -5.551  10.135   1.606
  309    HA   ILE  42           HA       ILE  42  -7.762   8.242   1.186
  310    HB   ILE  42           HB       ILE  42  -5.209   8.786  -0.384
  311   1HG1  ILE  42          1HG11     ILE  42  -6.822   9.589  -2.095
  312   2HG1  ILE  42          2HG12     ILE  42  -8.162   9.387  -0.961
  313   1HG2  ILE  42          2HG22     ILE  42  -7.529   6.871  -0.856
  314   2HG2  ILE  42          1HG21     ILE  42  -6.392   7.367  -2.121
  315   3HG2  ILE  42          3HG23     ILE  42  -5.805   6.465  -0.714
  316   1HD1  ILE  42          2HD12     ILE  42  -5.790  11.243  -0.519
  317   2HD1  ILE  42          3HD13     ILE  42  -7.304  11.747  -1.276
  318   3HD1  ILE  42          1HD11     ILE  42  -7.319  11.226   0.401
  319    H    ALA  43           HN       ALA  43  -4.548   8.222   2.638
  320    HA   ALA  43           HA       ALA  43  -3.845   5.544   2.388
  321   1HB   ALA  43          1HB       ALA  43  -2.394   7.288   3.352
  322   2HB   ALA  43          3HB       ALA  43  -3.355   7.298   4.840
  323   3HB   ALA  43          2HB       ALA  43  -2.480   5.838   4.374
  324    HA   PRO  44           HA       PRO  44  -6.265   4.280   6.356
  325   1HB   PRO  44          2HB       PRO  44  -8.519   5.757   7.049
  326   2HB   PRO  44          1HB       PRO  44  -6.906   5.918   7.798
  327   1HG   PRO  44          2HG       PRO  44  -8.071   7.569   5.551
  328   2HG   PRO  44          1HG       PRO  44  -7.240   8.154   7.022
  329   1HD   PRO  44          2HD       PRO  44  -5.870   7.965   4.743
  330   2HD   PRO  44          1HD       PRO  44  -5.127   7.361   6.242
  331    H    LEU  45           HN       LEU  45  -8.100   5.963   3.797
  332    HA   LEU  45           HA       LEU  45 -10.260   4.054   3.652
  333   1HB   LEU  45          1HB       LEU  45  -9.035   5.709   1.392
  334   2HB   LEU  45          2HB       LEU  45 -10.570   4.868   1.333
  335    HG   LEU  45           HG       LEU  45  -9.854   7.214   3.154
  336   1HD1  LEU  45          1HD11     LEU  45 -10.144   7.783   0.755
  337   2HD1  LEU  45          2HD12     LEU  45 -11.758   7.042   0.788
  338   3HD1  LEU  45          3HD13     LEU  45 -11.417   8.479   1.772
  339   1HD2  LEU  45          2HD22     LEU  45 -12.476   5.679   2.865
  340   2HD2  LEU  45          1HD21     LEU  45 -11.480   5.821   4.334
  341   3HD2  LEU  45          3HD23     LEU  45 -12.304   7.243   3.690
  342    H    PHE  46           HN       PHE  46  -7.211   4.318   1.862
  343    HA   PHE  46           HA       PHE  46  -7.411   1.962   0.297
  344   1HB   PHE  46          1HB       PHE  46  -5.865   3.771  -0.125
  345   2HB   PHE  46          2HB       PHE  46  -5.039   3.514   1.389
  346    HD1  PHE  46           HD1      PHE  46  -5.664   2.003  -1.921
  347    HD2  PHE  46           HD2      PHE  46  -3.223   1.990   1.612
  348    HE1  PHE  46           HE1      PHE  46  -3.948   0.679  -3.116
  349    HE2  PHE  46           HE2      PHE  46  -1.485   0.681   0.419
  350    HZ   PHE  46           HZ       PHE  46  -1.807   0.082  -1.974
  351    H    GLU  47           HN       GLU  47  -5.884   2.462   3.542
  352    HA   GLU  47           HA       GLU  47  -5.046  -0.210   3.940
  353   1HB   GLU  47          1HB       GLU  47  -5.790   2.034   5.844
  354   2HB   GLU  47          2HB       GLU  47  -5.120   0.490   6.378
  355   1HG   GLU  47          1HG       GLU  47  -3.084   0.803   5.130
  356   2HG   GLU  47          2HG       GLU  47  -3.711   2.227   4.303
  357    H    THR  48           HN       THR  48  -8.186   1.397   4.691
  358    HA   THR  48           HA       THR  48  -9.355  -0.799   6.068
  359    HB   THR  48           HB       THR  48 -10.755   1.232   4.265
  360    HG1  THR  48           HG1      THR  48  -9.513   2.204   5.924
  361   1HG2  THR  48          2HG22     THR  48 -11.766  -0.464   6.590
  362   2HG2  THR  48          1HG21     THR  48 -12.684   0.806   5.755
  363   3HG2  THR  48          3HG23     THR  48 -12.221  -0.666   4.882
  364    H    LEU  49           HN       LEU  49  -9.395   0.046   2.544
  365    HA   LEU  49           HA       LEU  49 -10.763  -2.311   1.691
  366   1HB   LEU  49          1HB       LEU  49 -10.229  -0.238   0.298
  367   2HB   LEU  49          2HB       LEU  49  -8.556  -0.814   0.214
  368    HG   LEU  49           HG       LEU  49  -9.444  -2.942  -0.850
  369   1HD1  LEU  49          2HD12     LEU  49 -12.001  -1.281  -0.780
  370   2HD1  LEU  49          3HD13     LEU  49 -11.739  -2.524  -2.010
  371   3HD1  LEU  49          1HD11     LEU  49 -11.771  -2.964  -0.294
  372   1HD2  LEU  49          3HD23     LEU  49  -9.837  -0.274  -2.246
  373   2HD2  LEU  49          1HD21     LEU  49  -8.327  -1.188  -2.095
  374   3HD2  LEU  49          2HD22     LEU  49  -9.664  -1.861  -3.038
  375    H    SER  50           HN       SER  50  -7.308  -1.631   2.165
  376    HA   SER  50           HA       SER  50  -6.214  -3.930   1.120
  377   1HB   SER  50          2HB       SER  50  -5.227  -2.555   3.647
  378   2HB   SER  50          1HB       SER  50  -4.311  -3.589   2.551
  379    HG   SER  50           HG       SER  50  -5.532  -1.203   1.634
  380    H    ASN  51           HN       ASN  51  -7.483  -3.453   4.405
  381    HA   ASN  51           HA       ASN  51  -6.763  -5.955   5.521
  382   1HB   ASN  51          1HB       ASN  51  -9.034  -4.022   6.090
  383   2HB   ASN  51          2HB       ASN  51  -8.928  -5.579   6.902
  384   1HD2  ASN  51          1HD21     ASN  51  -6.070  -2.774   7.822
  385   2HD2  ASN  51          2HD22     ASN  51  -6.945  -2.592   6.308
  386    H    ASP  52           HN       ASP  52  -9.364  -5.223   3.183
  387    HA   ASP  52           HA       ASP  52 -10.898  -7.603   3.736
  388   1HB   ASP  52          2HB       ASP  52 -10.757  -5.943   1.174
  389   2HB   ASP  52          1HB       ASP  52 -11.993  -7.123   1.599
  390    H    TYR  53           HN       TYR  53  -8.499  -6.794   1.162
  391    HA   TYR  53           HA       TYR  53  -8.572  -9.579   0.146
  392   1HB   TYR  53          1HB       TYR  53  -7.095  -7.179  -0.839
  393   2HB   TYR  53          2HB       TYR  53  -7.334  -8.727  -1.635
  394    HD1  TYR  53           HD1      TYR  53  -8.858  -5.512  -0.726
  395    HD2  TYR  53           HD2      TYR  53  -9.385  -9.256  -2.794
  396    HE1  TYR  53           HE1      TYR  53 -10.669  -4.525  -2.055
  397    HE2  TYR  53           HE2      TYR  53 -11.208  -8.251  -4.130
  398    HH   TYR  53           HH       TYR  53 -12.406  -4.925  -3.518
  399    H    ALA  54           HN       ALA  54  -6.663  -7.727   2.315
  400    HA   ALA  54           HA       ALA  54  -4.188  -8.058   2.427
  401   1HB   ALA  54          3HB       ALA  54  -5.591  -7.576   4.416
  402   2HB   ALA  54          1HB       ALA  54  -5.944  -9.292   4.608
  403   3HB   ALA  54          2HB       ALA  54  -4.283  -8.698   4.822
  404    H    GLY  55           HN       GLY  55  -5.944 -11.031   3.295
  405   1HA   GLY  55          1HA       GLY  55  -3.763 -12.732   3.657
  406   2HA   GLY  55          2HA       GLY  55  -5.365 -13.261   3.105
  407    H    LYS  56           HN       LYS  56  -5.501 -11.999   0.608
  408    HA   LYS  56           HA       LYS  56  -3.766 -13.844  -0.943
  409   1HB   LYS  56          2HB       LYS  56  -6.140 -12.096  -1.709
  410   2HB   LYS  56          1HB       LYS  56  -5.232 -13.160  -2.805
  411   1HG   LYS  56          1HG       LYS  56  -5.979 -15.129  -1.629
  412   2HG   LYS  56          2HG       LYS  56  -6.634 -14.164  -0.303
  413   1HD   LYS  56          2HD       LYS  56  -8.445 -14.944  -1.650
  414   2HD   LYS  56          1HD       LYS  56  -8.358 -13.190  -1.792
  415   1HE   LYS  56          2HE       LYS  56  -7.111 -15.057  -3.865
  416   2HE   LYS  56          1HE       LYS  56  -8.814 -14.610  -3.924
  417   1HZ   LYS  56          1HZ       LYS  56  -6.668 -12.622  -3.948
  418   2HZ   LYS  56          3HZ       LYS  56  -7.379 -13.249  -5.286
  419   3HZ   LYS  56          2HZ       LYS  56  -8.277 -12.380  -4.215
  420    H    VAL  57           HN       VAL  57  -4.808 -10.448  -0.992
  421    HA   VAL  57           HA       VAL  57  -2.849  -9.680  -3.046
  422    HB   VAL  57           HB       VAL  57  -5.167  -8.366  -1.607
  423   1HG1  VAL  57          1HG21     VAL  57  -3.714  -6.591  -2.478
  424   2HG1  VAL  57          3HG23     VAL  57  -3.858  -7.286  -4.095
  425   3HG1  VAL  57          2HG22     VAL  57  -5.293  -6.663  -3.273
  426   1HG2  VAL  57          2HG12     VAL  57  -4.938  -9.750  -4.305
  427   2HG2  VAL  57          1HG11     VAL  57  -6.009 -10.177  -2.970
  428   3HG2  VAL  57          3HG13     VAL  57  -6.304  -8.698  -3.881
  429    H    ILE  58           HN       ILE  58  -1.326  -7.969  -2.838
  430    HA   ILE  58           HA       ILE  58  -0.556  -7.342   0.019
  431    HB   ILE  58           HB       ILE  58   0.994  -7.592  -2.560
  432   1HG1  ILE  58          1HG11     ILE  58   0.727  -9.419  -0.880
  433   2HG1  ILE  58          2HG12     ILE  58   2.389  -9.026  -1.337
  434   1HG2  ILE  58          1HG21     ILE  58   1.878  -5.907  -0.187
  435   2HG2  ILE  58          3HG23     ILE  58   2.963  -6.549  -1.441
  436   3HG2  ILE  58          2HG22     ILE  58   1.682  -5.421  -1.890
  437   1HD1  ILE  58          2HD12     ILE  58   1.084  -8.123   1.271
  438   2HD1  ILE  58          3HD13     ILE  58   2.206  -9.478   1.075
  439   3HD1  ILE  58          1HD11     ILE  58   2.761  -7.838   0.750
  440    H    PHE  59           HN       PHE  59  -0.225  -5.191   0.660
  441    HA   PHE  59           HA       PHE  59  -1.070  -3.062  -1.234
  442   1HB   PHE  59          1HB       PHE  59  -2.146  -3.456   1.560
  443   2HB   PHE  59          2HB       PHE  59  -2.340  -2.000   0.601
  444    HD1  PHE  59           HD2      PHE  59  -3.158  -5.652   0.682
  445    HD2  PHE  59           HD1      PHE  59  -4.015  -1.817  -1.104
  446    HE1  PHE  59           HE2      PHE  59  -5.214  -6.543  -0.206
  447    HE2  PHE  59           HE1      PHE  59  -6.051  -2.761  -2.142
  448    HZ   PHE  59           HZ       PHE  59  -6.708  -5.101  -1.673
  449    H    LEU  60           HN       LEU  60   0.646  -1.779  -1.353
  450    HA   LEU  60           HA       LEU  60   2.401  -1.348   1.052
  451   1HB   LEU  60          1HB       LEU  60   3.060  -1.491  -1.913
  452   2HB   LEU  60          2HB       LEU  60   4.214  -1.085  -0.615
  453    HG   LEU  60           HG       LEU  60   2.813  -3.712  -1.158
  454   1HD1  LEU  60          2HD22     LEU  60   4.751  -3.164  -2.597
  455   2HD1  LEU  60          1HD21     LEU  60   5.758  -2.936  -1.153
  456   3HD1  LEU  60          3HD23     LEU  60   5.104  -4.539  -1.535
  457   1HD2  LEU  60          2HD12     LEU  60   4.623  -3.000   1.181
  458   2HD2  LEU  60          1HD11     LEU  60   2.940  -3.565   1.274
  459   3HD2  LEU  60          3HD13     LEU  60   4.194  -4.659   0.701
  460    H    LYS  61           HN       LYS  61   1.655   0.684   1.805
  461    HA   LYS  61           HA       LYS  61   1.360   2.836  -0.238
  462   1HB   LYS  61          2HB       LYS  61  -0.085   2.920   1.787
  463   2HB   LYS  61          1HB       LYS  61   1.379   3.138   2.765
  464   1HG   LYS  61          1HG       LYS  61   1.959   5.125   1.278
  465   2HG   LYS  61          2HG       LYS  61   0.334   4.993   0.598
  466   1HD   LYS  61          2HD       LYS  61  -0.627   5.280   2.868
  467   2HD   LYS  61          1HD       LYS  61   1.004   5.398   3.554
  468   1HE   LYS  61          1HE       LYS  61  -0.261   7.317   1.543
  469   2HE   LYS  61          2HE       LYS  61   0.043   7.632   3.257
  470   1HZ   LYS  61          1HZ       LYS  61   2.396   7.372   2.817
  471   2HZ   LYS  61          3HZ       LYS  61   2.102   7.176   1.209
  472   3HZ   LYS  61          2HZ       LYS  61   1.744   8.603   1.938
  473    H    VAL  62           HN       VAL  62   3.341   2.936  -1.246
  474    HA   VAL  62           HA       VAL  62   5.842   2.918   0.289
  475    HB   VAL  62           HB       VAL  62   5.188   3.265  -2.653
  476   1HG1  VAL  62          1HG11     VAL  62   7.903   3.364  -1.257
  477   2HG1  VAL  62          2HG12     VAL  62   7.679   3.130  -3.003
  478   3HG1  VAL  62          3HG13     VAL  62   7.183   4.649  -2.252
  479   1HG2  VAL  62          1HG21     VAL  62   5.054   0.974  -1.615
  480   2HG2  VAL  62          2HG22     VAL  62   6.350   1.123  -2.821
  481   3HG2  VAL  62          3HG23     VAL  62   6.740   1.145  -1.089
  482    H    ASP  63           HN       ASP  63   6.465   4.673   1.385
  483    HA   ASP  63           HA       ASP  63   5.378   7.285   0.952
  484   1HB   ASP  63          1HB       ASP  63   6.249   6.664   3.123
  485   2HB   ASP  63          2HB       ASP  63   7.869   6.420   2.448
  486    H    VAL  64           HN       VAL  64   5.654   8.102  -1.045
  487    HA   VAL  64           HA       VAL  64   7.855   7.877  -2.802
  488    HB   VAL  64           HB       VAL  64   5.735  10.030  -2.427
  489   1HG1  VAL  64          2HG22     VAL  64   7.730   9.762  -4.714
  490   2HG1  VAL  64          1HG21     VAL  64   6.257  10.753  -4.763
  491   3HG1  VAL  64          3HG23     VAL  64   7.542  11.153  -3.621
  492   1HG2  VAL  64          2HG12     VAL  64   5.029   7.709  -3.108
  493   2HG2  VAL  64          1HG11     VAL  64   4.670   8.949  -4.326
  494   3HG2  VAL  64          3HG13     VAL  64   6.066   7.863  -4.535
  495    H    ASP  65           HN       ASP  65   7.390  10.019  -0.004
  496    HA   ASP  65           HA       ASP  65   9.444  11.908  -0.670
  497   1HB   ASP  65          1HB       ASP  65   7.580  12.185   1.024
  498   2HB   ASP  65          2HB       ASP  65   8.463  11.081   2.095
  499    H    ALA  66           HN       ALA  66   9.473   8.637   0.643
  500    HA   ALA  66           HA       ALA  66  12.305   8.882   1.536
  501   1HB   ALA  66          1HB       ALA  66  10.235   6.692   1.953
  502   2HB   ALA  66          3HB       ALA  66  11.896   6.705   2.583
  503   3HB   ALA  66          2HB       ALA  66  10.728   7.922   3.137
  504    H    VAL  67           HN       VAL  67  10.269   6.476  -0.296
  505    HA   VAL  67           HA       VAL  67  12.790   5.470  -1.499
  506    HB   VAL  67           HB       VAL  67  10.017   4.371  -2.021
  507   1HG1  VAL  67          3HG23     VAL  67  12.049   3.678  -3.411
  508   2HG1  VAL  67          1HG21     VAL  67  12.790   3.072  -1.931
  509   3HG1  VAL  67          2HG22     VAL  67  11.279   2.347  -2.518
  510   1HG2  VAL  67          3HG13     VAL  67  11.945   3.679   0.241
  511   2HG2  VAL  67          1HG11     VAL  67  10.285   4.298   0.416
  512   3HG2  VAL  67          2HG12     VAL  67  10.560   2.682  -0.251
  513    H    ALA  68           HN       ALA  68  12.791   7.827  -2.335
  514    HA   ALA  68           HA       ALA  68  11.279   8.677  -4.540
  515   1HB   ALA  68          2HB       ALA  68  12.867  10.105  -3.318
  516   2HB   ALA  68          1HB       ALA  68  14.236   9.160  -3.945
  517   3HB   ALA  68          3HB       ALA  68  13.228  10.111  -5.056
  518    H    ALA  69           HN       ALA  69  14.222   6.647  -4.475
  519    HA   ALA  69           HA       ALA  69  14.772   6.434  -7.196
  520   1HB   ALA  69          2HB       ALA  69  15.061   4.305  -5.027
  521   2HB   ALA  69          1HB       ALA  69  15.879   4.305  -6.604
  522   3HB   ALA  69          3HB       ALA  69  16.235   5.579  -5.423
  523    H    VAL  70           HN       VAL  70  12.692   4.185  -5.279
  524    HA   VAL  70           HA       VAL  70  11.956   2.603  -7.572
  525    HB   VAL  70           HB       VAL  70  10.532   2.929  -4.894
  526   1HG1  VAL  70          3HG23     VAL  70  10.280   0.733  -6.993
  527   2HG1  VAL  70          2HG22     VAL  70   9.520   0.745  -5.388
  528   3HG1  VAL  70          1HG21     VAL  70   9.034   1.931  -6.604
  529   1HG2  VAL  70          1HG11     VAL  70  12.909   2.067  -4.740
  530   2HG2  VAL  70          3HG13     VAL  70  11.710   0.826  -4.328
  531   3HG2  VAL  70          2HG12     VAL  70  12.489   0.822  -5.927
  532    H    ALA  71           HN       ALA  71  10.412   5.318  -5.831
  533    HA   ALA  71           HA       ALA  71   8.022   5.439  -7.331
  534   1HB   ALA  71          3HB       ALA  71   8.472   6.754  -5.284
  535   2HB   ALA  71          2HB       ALA  71   9.607   7.782  -6.182
  536   3HB   ALA  71          1HB       ALA  71   7.887   7.781  -6.603
  537    H    GLU  72           HN       GLU  72  11.086   7.269  -8.055
  538    HA   GLU  72           HA       GLU  72  10.000   8.327 -10.499
  539   1HB   GLU  72          1HB       GLU  72  12.173   9.187 -10.945
  540   2HB   GLU  72          2HB       GLU  72  11.819   9.392  -9.227
  541   1HG   GLU  72          2HG       GLU  72  13.220   7.308  -8.809
  542   2HG   GLU  72          1HG       GLU  72  13.714   7.370 -10.504
  543    H    ALA  73           HN       ALA  73  12.045   5.418  -9.813
  544    HA   ALA  73           HA       ALA  73  12.479   4.699 -12.526
  545   1HB   ALA  73          2HB       ALA  73  13.671   3.669 -10.631
  546   2HB   ALA  73          3HB       ALA  73  12.162   2.914 -10.071
  547   3HB   ALA  73          1HB       ALA  73  12.874   2.433 -11.624
  548    H    ALA  74           HN       ALA  74   9.822   3.853 -10.285
  549    HA   ALA  74           HA       ALA  74   8.333   2.207 -12.091
  550   1HB   ALA  74          3HB       ALA  74   7.590   3.741  -9.575
  551   2HB   ALA  74          2HB       ALA  74   6.484   2.651 -10.435
  552   3HB   ALA  74          1HB       ALA  74   7.984   2.025  -9.730
  553    H    GLY  75           HN       GLY  75   8.439   5.688 -11.475
  554   1HA   GLY  75          1HA       GLY  75   8.076   7.261 -13.236
  555   2HA   GLY  75          2HA       GLY  75   6.911   6.167 -13.996
  556    H    ILE  76           HN       ILE  76   7.244   7.366 -10.624
  557    HA   ILE  76           HA       ILE  76   4.372   8.029 -10.543
  558    HB   ILE  76           HB       ILE  76   6.652   7.910  -8.557
  559   1HG1  ILE  76          2HG12     ILE  76   5.481   6.177  -7.554
  560   2HG1  ILE  76          1HG11     ILE  76   3.925   6.643  -8.255
  561   1HG2  ILE  76          1HG21     ILE  76   3.887   9.090  -8.066
  562   2HG2  ILE  76          2HG22     ILE  76   4.991   8.551  -6.786
  563   3HG2  ILE  76          3HG23     ILE  76   5.458   9.889  -7.832
  564   1HD1  ILE  76          3HD13     ILE  76   6.180   5.372  -9.816
  565   2HD1  ILE  76          1HD11     ILE  76   4.777   4.525  -9.168
  566   3HD1  ILE  76          2HD12     ILE  76   4.549   5.739 -10.421
  567    H    THR  77           HN       THR  77   3.534  10.053 -10.622
  568    HA   THR  77           HA       THR  77   5.311  12.431 -10.443
  569    HB   THR  77           HB       THR  77   4.114  13.341 -12.460
  570    HG1  THR  77           HG1      THR  77   3.199  11.620 -13.827
  571   1HG2  THR  77          3HG23     THR  77   6.409  12.315 -12.627
  572   2HG2  THR  77          1HG21     THR  77   5.650  10.774 -13.081
  573   3HG2  THR  77          2HG22     THR  77   5.465  12.195 -14.122
  574    H    ALA  78           HN       ALA  78   1.973  11.901 -11.434
  575    HA   ALA  78           HA       ALA  78   0.925  13.923  -9.638
  576   1HB   ALA  78          1HB       ALA  78  -0.457  11.843 -11.384
  577   2HB   ALA  78          3HB       ALA  78  -1.257  13.212 -10.580
  578   3HB   ALA  78          2HB       ALA  78  -0.047  13.508 -11.844
  579    H    MET  79           HN       MET  79   1.932  12.866  -7.672
  580    HA   MET  79           HA       MET  79   0.765  10.516  -6.575
  581   1HB   MET  79          1HB       MET  79   1.754  11.059  -4.525
  582   2HB   MET  79          2HB       MET  79   2.889  11.491  -5.800
  583   1HG   MET  79          1HG       MET  79   1.152  13.434  -4.211
  584   2HG   MET  79          2HG       MET  79   2.845  13.073  -3.918
  585   1HE   MET  79          1HE       MET  79   1.676  15.965  -4.118
  586   2HE   MET  79          3HE       MET  79   1.791  16.750  -5.712
  587   3HE   MET  79          2HE       MET  79   0.501  15.568  -5.398
  588    HA   PRO  80           HA       PRO  80  -0.507   9.611  -4.518
  589   1HB   PRO  80          1HB       PRO  80  -3.436   9.190  -5.162
  590   2HB   PRO  80          2HB       PRO  80  -2.506   8.554  -3.791
  591   1HG   PRO  80          1HG       PRO  80  -4.145  10.695  -3.451
  592   2HG   PRO  80          2HG       PRO  80  -2.481  10.791  -2.788
  593   1HD   PRO  80          2HD       PRO  80  -3.466  11.821  -5.486
  594   2HD   PRO  80          1HD       PRO  80  -2.581  12.723  -4.238
  595    H    THR  81           HN       THR  81   0.324   8.020  -5.833
  596    HA   THR  81           HA       THR  81  -0.992   7.532  -8.485
  597    HB   THR  81           HB       THR  81   1.934   7.652  -7.756
  598    HG1  THR  81           HG1      THR  81   0.321   9.481  -8.669
  599   1HG2  THR  81          3HG23     THR  81   0.554   6.638 -10.289
  600   2HG2  THR  81          2HG22     THR  81   2.267   7.085 -10.217
  601   3HG2  THR  81          1HG21     THR  81   1.673   5.740  -9.235
  602    H    PHE  82           HN       PHE  82  -2.142   5.762  -8.151
  603    HA   PHE  82           HA       PHE  82  -1.160   3.647  -6.389
  604   1HB   PHE  82          2HB       PHE  82  -3.737   3.999  -7.954
  605   2HB   PHE  82          1HB       PHE  82  -3.345   2.587  -6.983
  606    HD1  PHE  82           HD1      PHE  82  -3.164   2.708  -4.536
  607    HD2  PHE  82           HD2      PHE  82  -4.296   6.170  -6.859
  608    HE1  PHE  82           HE1      PHE  82  -3.933   3.877  -2.471
  609    HE2  PHE  82           HE2      PHE  82  -4.902   7.358  -4.773
  610    HZ   PHE  82           HZ       PHE  82  -4.502   6.222  -2.551
  611    H    HIS  83           HN       HIS  83  -0.263   1.724  -7.209
  612    HA   HIS  83           HA       HIS  83  -0.397   1.234 -10.178
  613   1HB   HIS  83          2HB       HIS  83   1.961   1.026  -8.335
  614   2HB   HIS  83          1HB       HIS  83   1.802   0.075  -9.818
  615    HD2  HIS  83           HD2      HIS  83   0.736   3.728 -10.400
  616    HE1  HIS  83           HE1      HIS  83   4.637   3.193 -11.905
  617    HE2  HIS  83           HE2      HIS  83   2.631   4.757 -11.869
  618    H    VAL  84           HN       VAL  84  -0.589  -0.988 -10.711
  619    HA   VAL  84           HA       VAL  84  -0.993  -2.869  -8.420
  620    HB   VAL  84           HB       VAL  84  -2.490  -3.032 -11.059
  621   1HG1  VAL  84          2HG22     VAL  84  -2.221  -5.114  -9.744
  622   2HG1  VAL  84          1HG21     VAL  84  -2.897  -4.302  -8.316
  623   3HG1  VAL  84          3HG23     VAL  84  -3.907  -4.575  -9.748
  624   1HG2  VAL  84          3HG13     VAL  84  -3.510  -1.798  -8.478
  625   2HG2  VAL  84          2HG12     VAL  84  -3.289  -0.966 -10.039
  626   3HG2  VAL  84          1HG11     VAL  84  -4.500  -2.243  -9.886
  627    H    TYR  85           HN       TYR  85   0.756  -4.278  -8.516
  628    HA   TYR  85           HA       TYR  85   1.662  -5.082 -11.260
  629   1HB   TYR  85          1HB       TYR  85   3.388  -5.239  -8.770
  630   2HB   TYR  85          2HB       TYR  85   3.779  -5.697 -10.392
  631    HD1  TYR  85           HD1      TYR  85   2.645  -2.649  -8.478
  632    HD2  TYR  85           HD2      TYR  85   5.296  -4.291 -11.452
  633    HE1  TYR  85           HE1      TYR  85   3.768  -0.453  -8.721
  634    HE2  TYR  85           HE2      TYR  85   6.369  -2.080 -11.715
  635    HH   TYR  85           HH       TYR  85   4.937   0.824 -10.359
  636    H    LYS  86           HN       LYS  86   1.270  -7.214 -11.733
  637    HA   LYS  86           HA       LYS  86   0.085  -8.893  -9.562
  638   1HB   LYS  86          1HB       LYS  86   0.274  -9.279 -12.565
  639   2HB   LYS  86          2HB       LYS  86  -0.303 -10.505 -11.415
  640   1HG   LYS  86          1HG       LYS  86  -2.022  -8.896 -10.558
  641   2HG   LYS  86          2HG       LYS  86  -1.458  -7.692 -11.714
  642   1HD   LYS  86          1HD       LYS  86  -3.433  -8.648 -12.611
  643   2HD   LYS  86          2HD       LYS  86  -2.093  -9.282 -13.583
  644   1HE   LYS  86          2HE       LYS  86  -2.188 -11.425 -12.344
  645   2HE   LYS  86          1HE       LYS  86  -3.401 -10.760 -11.236
  646   1HZ   LYS  86          2HZ       LYS  86  -3.766 -11.168 -14.116
  647   2HZ   LYS  86          1HZ       LYS  86  -4.378 -12.110 -12.908
  648   3HZ   LYS  86          3HZ       LYS  86  -4.890 -10.554 -13.075
  649    H    ASP  87           HN       ASP  87   1.509  -9.851  -8.333
  650    HA   ASP  87           HA       ASP  87   3.280 -10.915  -7.480
  651   1HB   ASP  87          2HB       ASP  87   3.097 -12.527  -9.375
  652   2HB   ASP  87          1HB       ASP  87   4.174 -11.536 -10.348
  653    H    GLY  88           HN       GLY  88   4.430  -9.436 -10.400
  654   1HA   GLY  88          1HA       GLY  88   5.740  -7.168  -9.124
  655   2HA   GLY  88          2HA       GLY  88   6.898  -8.390  -9.692
  656    H    VAL  89           HN       VAL  89   4.093  -8.388 -11.722
  657    HA   VAL  89           HA       VAL  89   5.574  -6.867 -13.807
  658    HB   VAL  89           HB       VAL  89   3.241  -8.820 -14.009
  659   1HG1  VAL  89          1HG21     VAL  89   5.052  -7.588 -16.137
  660   2HG1  VAL  89          2HG22     VAL  89   3.806  -8.820 -16.420
  661   3HG1  VAL  89          3HG23     VAL  89   3.336  -7.203 -15.883
  662   1HG2  VAL  89          1HG11     VAL  89   6.218  -9.249 -14.505
  663   2HG2  VAL  89          3HG13     VAL  89   5.232 -10.030 -13.248
  664   3HG2  VAL  89          2HG12     VAL  89   4.929 -10.388 -14.950
  665    H    LYS  90           HN       LYS  90   4.864  -4.762 -14.036
  666    HA   LYS  90           HA       LYS  90   2.634  -3.667 -12.704
  667   1HB   LYS  90          2HB       LYS  90   4.616  -2.419 -13.687
  668   2HB   LYS  90          1HB       LYS  90   3.826  -2.554 -15.267
  669   1HG   LYS  90          1HG       LYS  90   1.765  -1.473 -14.211
  670   2HG   LYS  90          2HG       LYS  90   2.714  -1.209 -12.746
  671   1HD   LYS  90          1HD       LYS  90   3.340  -0.078 -15.519
  672   2HD   LYS  90          2HD       LYS  90   2.529   0.782 -14.208
  673   1HE   LYS  90          1HE       LYS  90   4.558   0.544 -12.797
  674   2HE   LYS  90          2HE       LYS  90   5.401  -0.263 -14.131
  675   1HZ   LYS  90          2HZ       LYS  90   4.280   2.446 -14.252
  676   2HZ   LYS  90          1HZ       LYS  90   5.864   2.107 -13.992
  677   3HZ   LYS  90          3HZ       LYS  90   5.159   1.699 -15.426
  678    H    ALA  91           HN       ALA  91   0.579  -4.259 -12.998
  679    HA   ALA  91           HA       ALA  91  -0.384  -5.176 -15.658
  680   1HB   ALA  91          3HB       ALA  91  -0.626  -6.699 -13.733
  681   2HB   ALA  91          1HB       ALA  91  -1.573  -5.461 -12.870
  682   3HB   ALA  91          2HB       ALA  91  -2.200  -6.185 -14.368
  683    H    ASP  92           HN       ASP  92  -0.862  -2.683 -13.158
  684    HA   ASP  92           HA       ASP  92  -2.430  -1.105 -15.060
  685   1HB   ASP  92          2HB       ASP  92  -3.895  -2.904 -13.717
  686   2HB   ASP  92          1HB       ASP  92  -3.845  -1.689 -12.442
  687    H    ASP  93           HN       ASP  93  -3.286   0.955 -13.825
  688    HA   ASP  93           HA       ASP  93  -1.959   1.744 -11.464
  689   1HB   ASP  93          2HB       ASP  93  -0.623   3.630 -12.370
  690   2HB   ASP  93          1HB       ASP  93   0.027   2.073 -12.835
  691    H    LEU  94           HN       LEU  94  -2.392   4.056 -11.044
  692    HA   LEU  94           HA       LEU  94  -4.658   5.334 -12.398
  693   1HB   LEU  94          1HB       LEU  94  -5.851   3.517 -11.376
  694   2HB   LEU  94          2HB       LEU  94  -4.926   3.648  -9.890
  695    HG   LEU  94           HG       LEU  94  -6.066   5.882  -9.443
  696   1HD1  LEU  94          3HD23     LEU  94  -7.595   5.025 -11.937
  697   2HD1  LEU  94          2HD22     LEU  94  -8.144   6.292 -10.822
  698   3HD1  LEU  94          1HD21     LEU  94  -6.646   6.514 -11.737
  699   1HD2  LEU  94          3HD13     LEU  94  -7.828   3.439  -9.852
  700   2HD2  LEU  94          1HD11     LEU  94  -6.817   3.798  -8.436
  701   3HD2  LEU  94          2HD12     LEU  94  -8.194   4.833  -8.819
  702    H    VAL  95           HN       VAL  95  -4.261   7.497 -12.062
  703    HA   VAL  95           HA       VAL  95  -2.652   8.318  -9.719
  704    HB   VAL  95           HB       VAL  95  -2.388  10.427 -10.939
  705   1HG1  VAL  95          3HG13     VAL  95  -0.737   8.625 -11.182
  706   2HG1  VAL  95          2HG12     VAL  95  -1.629   7.967 -12.572
  707   3HG1  VAL  95          1HG11     VAL  95  -0.881   9.572 -12.672
  708   1HG2  VAL  95          1HG21     VAL  95  -4.494  10.403 -12.281
  709   2HG2  VAL  95          2HG22     VAL  95  -3.048  10.672 -13.262
  710   3HG2  VAL  95          3HG23     VAL  95  -3.830   9.086 -13.273
  711    H    GLY  96           HN       GLY  96  -3.236  10.189  -8.512
  712   1HA   GLY  96          1HA       GLY  96  -4.592  11.898  -7.713
  713   2HA   GLY  96          2HA       GLY  96  -5.904  11.400  -8.801
  714    H    ALA  97           HN       ALA  97  -6.726  11.984  -6.379
  715    HA   ALA  97           HA       ALA  97  -6.716   9.745  -4.503
  716   1HB   ALA  97          3HB       ALA  97  -8.348  12.323  -4.650
  717   2HB   ALA  97          2HB       ALA  97  -8.320  11.206  -3.277
  718   3HB   ALA  97          1HB       ALA  97  -6.842  12.082  -3.734
  719    H    SER  98           HN       SER  98  -7.502   8.809  -6.995
  720    HA   SER  98           HA       SER  98 -10.376   8.781  -7.368
  721   1HB   SER  98          1HB       SER  98  -8.158   7.117  -8.611
  722   2HB   SER  98          2HB       SER  98  -9.756   7.479  -9.311
  723    HG   SER  98           HG       SER  98  -7.517   8.866  -9.621
  724    H    GLN  99           HN       GLN  99 -10.163   7.974  -4.844
  725    HA   GLN  99           HA       GLN  99  -9.481   5.331  -4.239
  726   1HB   GLN  99          2HB       GLN  99 -10.827   5.611  -2.220
  727   2HB   GLN  99          1HB       GLN  99  -9.822   7.006  -2.584
  728   1HG   GLN  99          1HG       GLN  99 -11.752   8.035  -1.905
  729   2HG   GLN  99          2HG       GLN  99 -11.965   8.069  -3.651
  730   1HE2  GLN  99          1HE21     GLN  99 -14.279   5.507  -1.356
  731   2HE2  GLN  99          2HE22     GLN  99 -12.656   5.907  -0.807
  732    H    ASP 100           HN       ASP 100 -12.518   6.486  -5.682
  733    HA   ASP 100           HA       ASP 100 -14.033   4.084  -5.348
  734   1HB   ASP 100          2HB       ASP 100 -15.454   5.022  -7.092
  735   2HB   ASP 100          1HB       ASP 100 -15.037   6.268  -5.914
  736    H    LYS 101           HN       LYS 101 -12.031   5.338  -8.050
  737    HA   LYS 101           HA       LYS 101 -12.367   2.947  -9.629
  738   1HB   LYS 101          1HB       LYS 101 -11.862   5.198 -10.541
  739   2HB   LYS 101          2HB       LYS 101 -10.228   5.103  -9.873
  740   1HG   LYS 101          2HG       LYS 101  -9.681   3.217 -11.291
  741   2HG   LYS 101          1HG       LYS 101 -11.374   2.983 -11.751
  742   1HD   LYS 101          1HD       LYS 101 -11.425   5.045 -13.008
  743   2HD   LYS 101          2HD       LYS 101  -9.817   5.509 -12.436
  744   1HE   LYS 101          2HE       LYS 101  -8.847   3.489 -13.571
  745   2HE   LYS 101          1HE       LYS 101 -10.463   3.069 -14.167
  746   1HZ   LYS 101          1HZ       LYS 101 -10.490   5.142 -15.354
  747   2HZ   LYS 101          2HZ       LYS 101  -8.989   5.531 -14.795
  748   3HZ   LYS 101          3HZ       LYS 101  -9.187   4.236 -15.794
  749    H    LEU 102           HN       LEU 102 -10.010   4.001  -7.170
  750    HA   LEU 102           HA       LEU 102  -8.091   1.976  -7.549
  751   1HB   LEU 102          2HB       LEU 102  -7.967   3.964  -5.953
  752   2HB   LEU 102          1HB       LEU 102  -9.013   3.108  -4.847
  753    HG   LEU 102           HG       LEU 102  -6.497   3.144  -4.445
  754   1HD1  LEU 102          2HD12     LEU 102  -8.094   0.576  -4.257
  755   2HD1  LEU 102          3HD13     LEU 102  -6.505   0.803  -3.537
  756   3HD1  LEU 102          1HD11     LEU 102  -7.856   1.837  -3.032
  757   1HD2  LEU 102          2HD22     LEU 102  -5.806   2.487  -6.727
  758   2HD2  LEU 102          3HD23     LEU 102  -5.126   1.453  -5.460
  759   3HD2  LEU 102          1HD21     LEU 102  -6.466   0.857  -6.446
  760    H    LYS 103           HN       LYS 103 -10.938   2.042  -5.368
  761    HA   LYS 103           HA       LYS 103 -10.898  -0.618  -4.486
  762   1HB   LYS 103          2HB       LYS 103 -13.196   1.292  -5.066
  763   2HB   LYS 103          1HB       LYS 103 -13.422  -0.288  -4.318
  764   1HG   LYS 103          1HG       LYS 103 -12.055   0.277  -2.444
  765   2HG   LYS 103          2HG       LYS 103 -11.520   1.796  -3.174
  766   1HD   LYS 103          2HD       LYS 103 -13.875   2.619  -3.151
  767   2HD   LYS 103          1HD       LYS 103 -14.384   1.128  -2.339
  768   1HE   LYS 103          1HE       LYS 103 -12.387   3.185  -1.264
  769   2HE   LYS 103          2HE       LYS 103 -14.072   3.006  -0.745
  770   1HZ   LYS 103          1HZ       LYS 103 -13.537   0.798   0.014
  771   2HZ   LYS 103          3HZ       LYS 103 -11.962   0.993  -0.430
  772   3HZ   LYS 103          2HZ       LYS 103 -12.601   1.929   0.761
  773    H    ALA 104           HN       ALA 104 -12.553   0.676  -7.417
  774    HA   ALA 104           HA       ALA 104 -13.561  -1.779  -8.351
  775   1HB   ALA 104          2HB       ALA 104 -14.151   0.452  -9.271
  776   2HB   ALA 104          3HB       ALA 104 -12.549   0.557 -10.034
  777   3HB   ALA 104          1HB       ALA 104 -13.690  -0.702 -10.539
  778    H    LEU 105           HN       LEU 105 -10.360  -0.275  -9.158
  779    HA   LEU 105           HA       LEU 105  -9.533  -2.415 -10.876
  780   1HB   LEU 105          1HB       LEU 105  -7.926  -0.394  -9.254
  781   2HB   LEU 105          2HB       LEU 105  -7.212  -1.545 -10.386
  782    HG   LEU 105           HG       LEU 105  -9.149   0.691 -11.106
  783   1HD1  LEU 105          1HD11     LEU 105  -6.802   1.346 -10.578
  784   2HD1  LEU 105          2HD12     LEU 105  -6.221   0.205 -11.806
  785   3HD1  LEU 105          3HD13     LEU 105  -7.204   1.602 -12.288
  786   1HD2  LEU 105          2HD22     LEU 105  -7.960  -1.528 -12.807
  787   2HD2  LEU 105          1HD21     LEU 105  -9.672  -1.077 -12.639
  788   3HD2  LEU 105          3HD23     LEU 105  -8.561   0.000 -13.487
  789    H    VAL 106           HN       VAL 106  -8.931  -1.860  -7.352
  790    HA   VAL 106           HA       VAL 106  -7.322  -4.176  -6.999
  791    HB   VAL 106           HB       VAL 106  -9.265  -2.804  -5.099
  792   1HG1  VAL 106          3HG23     VAL 106  -8.801  -5.139  -4.327
  793   2HG1  VAL 106          2HG22     VAL 106  -7.063  -4.834  -4.471
  794   3HG1  VAL 106          1HG21     VAL 106  -8.037  -3.937  -3.285
  795   1HG2  VAL 106          1HG11     VAL 106  -7.320  -1.423  -5.905
  796   2HG2  VAL 106          3HG13     VAL 106  -7.195  -1.808  -4.181
  797   3HG2  VAL 106          2HG12     VAL 106  -6.230  -2.702  -5.381
  798    H    ALA 107           HN       ALA 107 -10.841  -3.770  -6.682
  799    HA   ALA 107           HA       ALA 107 -11.510  -6.458  -6.138
  800   1HB   ALA 107          2HB       ALA 107 -13.131  -4.568  -6.054
  801   2HB   ALA 107          3HB       ALA 107 -13.119  -4.480  -7.826
  802   3HB   ALA 107          1HB       ALA 107 -13.742  -5.929  -7.016
  803    H    LYS 108           HN       LYS 108 -11.263  -4.911  -9.371
  804    HA   LYS 108           HA       LYS 108 -11.795  -7.166 -10.971
  805   1HB   LYS 108          1HB       LYS 108 -11.631  -4.930 -11.836
  806   2HB   LYS 108          2HB       LYS 108  -9.957  -4.757 -11.362
  807   1HG   LYS 108          2HG       LYS 108  -9.267  -6.512 -12.992
  808   2HG   LYS 108          1HG       LYS 108 -10.951  -6.618 -13.542
  809   1HD   LYS 108          2HD       LYS 108  -9.123  -4.160 -13.605
  810   2HD   LYS 108          1HD       LYS 108  -9.491  -5.213 -14.976
  811   1HE   LYS 108          1HE       LYS 108 -11.920  -4.583 -14.765
  812   2HE   LYS 108          2HE       LYS 108 -11.477  -3.425 -13.492
  813   1HZ   LYS 108          2HZ       LYS 108 -10.073  -2.319 -15.060
  814   2HZ   LYS 108          3HZ       LYS 108 -10.492  -3.379 -16.251
  815   3HZ   LYS 108          1HZ       LYS 108 -11.628  -2.377 -15.603
  816    H    HIS 109           HN       HIS 109  -8.596  -5.869 -10.182
  817    HA   HIS 109           HA       HIS 109  -7.136  -8.049 -11.308
  818   1HB   HIS 109          1HB       HIS 109  -6.375  -5.861  -9.336
  819   2HB   HIS 109          2HB       HIS 109  -5.227  -7.056  -9.957
  820    HD2  HIS 109           HD2      HIS 109  -7.278  -3.987 -11.373
  821    HE1  HIS 109           HE1      HIS 109  -4.538  -5.279 -14.279
  822    HE2  HIS 109           HE2      HIS 109  -6.199  -3.456 -13.682
  823    H    ALA 110           HN       ALA 110  -8.431  -7.636  -8.017
  824    HA   ALA 110           HA       ALA 110  -6.897  -9.812  -6.881
  825   1HB   ALA 110          2HB       ALA 110  -7.811  -7.942  -5.544
  826   2HB   ALA 110          1HB       ALA 110  -9.462  -8.475  -5.945
  827   3HB   ALA 110          3HB       ALA 110  -8.399  -9.516  -4.977
  828    H    ALA 111           HN       ALA 111  -9.418  -9.993  -9.198
  829    HA   ALA 111           HA       ALA 111 -10.813 -12.256  -8.000
  830   1HB   ALA 111          2HB       ALA 111 -11.871 -10.659  -9.574
  831   2HB   ALA 111          3HB       ALA 111 -10.779 -11.215 -10.861
  832   3HB   ALA 111          1HB       ALA 111 -11.961 -12.334 -10.150
  833    H    ALA 112           HN       ALA 112  -8.196 -13.042  -7.691
  834    HA   ALA 112           HA       ALA 112  -8.027 -15.485  -9.092
  835   1HB   ALA 112          3HB       ALA 112  -7.198 -14.047 -10.980
  836   2HB   ALA 112          2HB       ALA 112  -5.981 -13.352  -9.884
  837   3HB   ALA 112          1HB       ALA 112  -5.930 -15.079 -10.312
   
  No H/Q in entry =         837
  Start of MODEL   22
    1   1H    GLY   1          2HN       GLY   1   0.572 -13.555   2.795
    2   2H    GLY   1          1HN       GLY   1  -0.649 -13.493   1.684
    3   3H    GLY   1          3HN       GLY   1   0.984 -13.581   1.177
    4   1HA   GLY   1          1HA       GLY   1   1.393 -11.433   1.853
    5   2HA   GLY   1          2HA       GLY   1  -0.236 -11.363   1.129
    6    H    GLY   2           HN       GLY   2  -1.095  -9.719   2.539
    7   1HA   GLY   2          1HA       GLY   2  -2.465  -9.322   4.421
    8   2HA   GLY   2          2HA       GLY   2  -1.590 -10.550   5.354
    9    H    SER   3           HN       SER   3   0.765  -8.714   3.749
   10    HA   SER   3           HA       SER   3   1.555  -7.328   6.072
   11   1HB   SER   3          1HB       SER   3   2.703  -6.582   3.412
   12   2HB   SER   3          2HB       SER   3   3.480  -7.099   4.908
   13    HG   SER   3           HG       SER   3   3.637  -8.688   3.263
   14    H    VAL   4           HN       VAL   4  -0.728  -6.317   6.199
   15    HA   VAL   4           HA       VAL   4  -1.227  -3.887   4.621
   16    HB   VAL   4           HB       VAL   4  -2.498  -5.093   7.127
   17   1HG1  VAL   4          2HG22     VAL   4  -3.081  -2.550   5.601
   18   2HG1  VAL   4          1HG21     VAL   4  -4.379  -3.433   6.457
   19   3HG1  VAL   4          3HG23     VAL   4  -2.996  -2.802   7.343
   20   1HG2  VAL   4          2HG12     VAL   4  -3.372  -5.052   4.209
   21   2HG2  VAL   4          3HG13     VAL   4  -2.865  -6.464   5.149
   22   3HG2  VAL   4          1HG11     VAL   4  -4.346  -5.610   5.584
   23    H    ILE   5           HN       ILE   5   0.805  -2.751   5.010
   24    HA   ILE   5           HA       ILE   5   0.932  -1.447   7.673
   25    HB   ILE   5           HB       ILE   5   3.367  -1.842   7.841
   26   1HG1  ILE   5          2HG12     ILE   5   3.143  -4.085   5.803
   27   2HG1  ILE   5          1HG11     ILE   5   3.555  -2.454   5.285
   28   1HG2  ILE   5          1HG21     ILE   5   1.745  -3.284   9.075
   29   2HG2  ILE   5          2HG22     ILE   5   1.862  -4.491   7.774
   30   3HG2  ILE   5          3HG23     ILE   5   3.285  -4.079   8.740
   31   1HD1  ILE   5          3HD13     ILE   5   5.435  -2.417   6.957
   32   2HD1  ILE   5          1HD11     ILE   5   5.100  -4.130   7.301
   33   3HD1  ILE   5          2HD12     ILE   5   5.621  -3.628   5.685
   34    H    VAL   6           HN       VAL   6   2.607   0.245   7.729
   35    HA   VAL   6           HA       VAL   6   2.903   1.619   5.161
   36    HB   VAL   6           HB       VAL   6   1.291   2.814   6.614
   37   1HG1  VAL   6          3HG23     VAL   6   2.041   2.014   8.838
   38   2HG1  VAL   6          2HG22     VAL   6   3.514   3.000   8.691
   39   3HG1  VAL   6          1HG21     VAL   6   1.925   3.776   8.759
   40   1HG2  VAL   6          1HG11     VAL   6   2.840   4.111   5.168
   41   2HG2  VAL   6          3HG13     VAL   6   2.365   4.998   6.630
   42   3HG2  VAL   6          2HG12     VAL   6   3.973   4.255   6.529
   43    H    ILE   7           HN       ILE   7   4.975   2.215   4.614
   44    HA   ILE   7           HA       ILE   7   7.030   2.053   6.668
   45    HB   ILE   7           HB       ILE   7   6.472  -0.341   5.953
   46   1HG1  ILE   7          2HG12     ILE   7   9.344   0.011   5.265
   47   2HG1  ILE   7          1HG11     ILE   7   8.832   0.721   6.804
   48   1HG2  ILE   7          3HG23     ILE   7   6.177   0.104   3.526
   49   2HG2  ILE   7          2HG22     ILE   7   7.912   0.453   3.376
   50   3HG2  ILE   7          1HG21     ILE   7   7.368  -1.168   3.842
   51   1HD1  ILE   7          3HD13     ILE   7   8.196  -2.138   6.032
   52   2HD1  ILE   7          2HD12     ILE   7   9.578  -1.636   7.040
   53   3HD1  ILE   7          1HD11     ILE   7   7.918  -1.347   7.594
   54    H    ASP   8           HN       ASP   8   9.157   2.540   5.861
   55    HA   ASP   8           HA       ASP   8   9.117   4.422   3.566
   56   1HB   ASP   8          1HB       ASP   8  10.464   5.859   5.065
   57   2HB   ASP   8          2HB       ASP   8   9.013   5.382   5.943
   58    H    SER   9           HN       SER   9  10.242   1.477   4.116
   59    HA   SER   9           HA       SER   9  13.073   2.062   3.299
   60   1HB   SER   9          1HB       SER   9  12.046  -0.189   5.034
   61   2HB   SER   9          2HB       SER   9  13.723   0.121   4.542
   62    HG   SER   9           HG       SER   9  12.136   1.977   6.053
   63    H    LYS  10           HN       LYS  10  13.263   1.570   1.243
   64    HA   LYS  10           HA       LYS  10  11.813  -0.047  -0.428
   65   1HB   LYS  10          2HB       LYS  10  13.825  -0.135  -1.784
   66   2HB   LYS  10          1HB       LYS  10  13.534   1.485  -1.088
   67   1HG   LYS  10          1HG       LYS  10  15.311   0.961   0.646
   68   2HG   LYS  10          2HG       LYS  10  15.679  -0.519  -0.258
   69   1HD   LYS  10          2HD       LYS  10  15.847   2.324  -1.347
   70   2HD   LYS  10          1HD       LYS  10  17.203   1.338  -0.782
   71   1HE   LYS  10          2HE       LYS  10  16.645  -0.376  -2.549
   72   2HE   LYS  10          1HE       LYS  10  15.415   0.734  -3.185
   73   1HZ   LYS  10          2HZ       LYS  10  17.143   2.337  -3.552
   74   2HZ   LYS  10          3HZ       LYS  10  18.284   1.297  -2.975
   75   3HZ   LYS  10          1HZ       LYS  10  17.460   0.933  -4.353
   76    H    ALA  11           HN       ALA  11  14.456  -0.989   1.653
   77    HA   ALA  11           HA       ALA  11  14.846  -3.679   0.945
   78   1HB   ALA  11          2HB       ALA  11  16.288  -2.452   2.532
   79   2HB   ALA  11          1HB       ALA  11  14.976  -2.437   3.734
   80   3HB   ALA  11          3HB       ALA  11  15.716  -3.974   3.240
   81    H    ALA  12           HN       ALA  12  12.314  -2.273   3.081
   82    HA   ALA  12           HA       ALA  12  11.348  -4.881   3.972
   83   1HB   ALA  12          1HB       ALA  12  11.074  -2.822   5.332
   84   2HB   ALA  12          3HB       ALA  12   9.999  -2.152   4.079
   85   3HB   ALA  12          2HB       ALA  12   9.538  -3.629   4.954
   86    H    TRP  13           HN       TRP  13  10.549  -2.482   1.467
   87    HA   TRP  13           HA       TRP  13   8.162  -3.680   0.436
   88   1HB   TRP  13          2HB       TRP  13   8.431  -1.648  -0.492
   89   2HB   TRP  13          1HB       TRP  13  10.165  -1.669  -0.410
   90    HD1  TRP  13           HD1      TRP  13  11.444  -3.086  -2.484
   91    HE1  TRP  13           HE1      TRP  13  10.902  -3.019  -4.981
   92    HE3  TRP  13           HE3      TRP  13   6.687  -1.197  -2.246
   93    HZ2  TRP  13           HZ2      TRP  13   8.781  -2.172  -6.655
   94    HZ3  TRP  13           HZ3      TRP  13   5.523  -0.596  -4.330
   95    HH2  TRP  13           HH2      TRP  13   6.504  -1.141  -6.546
   96    H    ASP  14           HN       ASP  14  11.595  -4.114  -0.433
   97    HA   ASP  14           HA       ASP  14  11.281  -6.146  -2.361
   98   1HB   ASP  14          2HB       ASP  14  13.358  -4.795  -1.838
   99   2HB   ASP  14          1HB       ASP  14  13.603  -5.821  -0.429
  100    H    ALA  15           HN       ALA  15  12.048  -6.389   1.087
  101    HA   ALA  15           HA       ALA  15  12.128  -9.159   1.384
  102   1HB   ALA  15          1HB       ALA  15  12.702  -7.567   3.190
  103   2HB   ALA  15          2HB       ALA  15  10.982  -7.168   3.394
  104   3HB   ALA  15          3HB       ALA  15  11.562  -8.806   3.750
  105    H    GLN  16           HN       GLN  16   9.241  -7.102   1.840
  106    HA   GLN  16           HA       GLN  16   7.333  -9.184   2.234
  107   1HB   GLN  16          1HB       GLN  16   7.111  -6.369   1.109
  108   2HB   GLN  16          2HB       GLN  16   5.703  -7.410   1.380
  109   1HG   GLN  16          1HG       GLN  16   6.120  -7.599   3.718
  110   2HG   GLN  16          2HG       GLN  16   7.717  -6.854   3.602
  111   1HE2  GLN  16          1HE21     GLN  16   6.502  -3.501   3.221
  112   2HE2  GLN  16          2HE22     GLN  16   7.775  -4.616   2.697
  113    H    LEU  17           HN       LEU  17   8.406  -7.555  -0.766
  114    HA   LEU  17           HA       LEU  17   6.829  -8.893  -2.619
  115   1HB   LEU  17          2HB       LEU  17   9.323  -7.350  -2.647
  116   2HB   LEU  17          1HB       LEU  17   9.425  -8.657  -3.815
  117    HG   LEU  17           HG       LEU  17   6.982  -6.892  -3.623
  118   1HD1  LEU  17          3HD23     LEU  17   8.866  -5.365  -3.957
  119   2HD1  LEU  17          2HD22     LEU  17   9.441  -6.342  -5.331
  120   3HD1  LEU  17          1HD21     LEU  17   7.890  -5.483  -5.431
  121   1HD2  LEU  17          1HD11     LEU  17   6.827  -8.998  -4.980
  122   2HD2  LEU  17          3HD13     LEU  17   6.721  -7.567  -6.019
  123   3HD2  LEU  17          2HD12     LEU  17   8.232  -8.488  -5.926
  124    H    ALA  18           HN       ALA  18   9.398 -10.276  -0.720
  125    HA   ALA  18           HA       ALA  18   9.288 -12.808  -2.322
  126   1HB   ALA  18          3HB       ALA  18  11.221 -11.907  -0.146
  127   2HB   ALA  18          2HB       ALA  18  11.261 -13.450  -1.022
  128   3HB   ALA  18          1HB       ALA  18  11.521 -11.925  -1.892
  129    H    LYS  19           HN       LYS  19   9.438 -11.915   1.189
  130    HA   LYS  19           HA       LYS  19   8.561 -14.501   1.984
  131   1HB   LYS  19          2HB       LYS  19   8.527 -13.656   4.199
  132   2HB   LYS  19          1HB       LYS  19   9.933 -12.971   3.371
  133   1HG   LYS  19          2HG       LYS  19   8.592 -10.870   3.022
  134   2HG   LYS  19          1HG       LYS  19   7.289 -11.549   3.973
  135   1HD   LYS  19          1HD       LYS  19  10.144 -10.958   4.895
  136   2HD   LYS  19          2HD       LYS  19   8.701 -10.027   5.304
  137   1HE   LYS  19          1HE       LYS  19   9.349 -12.877   6.192
  138   2HE   LYS  19          2HE       LYS  19   9.321 -11.422   7.190
  139   1HZ   LYS  19          3HZ       LYS  19   6.973 -11.237   6.754
  140   2HZ   LYS  19          2HZ       LYS  19   6.999 -12.617   5.851
  141   3HZ   LYS  19          1HZ       LYS  19   7.338 -12.681   7.461
  142    H    GLY  20           HN       GLY  20   6.608 -11.737   0.983
  143   1HA   GLY  20          1HA       GLY  20   4.266 -12.412   2.505
  144   2HA   GLY  20          2HA       GLY  20   4.366 -11.395   1.063
  145    H    LYS  21           HN       LYS  21   5.752 -14.021  -0.194
  146    HA   LYS  21           HA       LYS  21   5.100 -15.675  -1.596
  147   1HB   LYS  21          2HB       LYS  21   2.793 -16.133   0.359
  148   2HB   LYS  21          1HB       LYS  21   3.381 -17.245  -0.885
  149   1HG   LYS  21          2HG       LYS  21   5.619 -17.287   0.226
  150   2HG   LYS  21          1HG       LYS  21   4.988 -16.215   1.489
  151   1HD   LYS  21          2HD       LYS  21   3.300 -17.921   2.119
  152   2HD   LYS  21          1HD       LYS  21   3.903 -18.990   0.840
  153   1HE   LYS  21          1HE       LYS  21   4.837 -19.663   3.001
  154   2HE   LYS  21          2HE       LYS  21   6.129 -19.076   1.942
  155   1HZ   LYS  21          1HZ       LYS  21   4.825 -17.529   4.076
  156   2HZ   LYS  21          3HZ       LYS  21   6.317 -18.223   4.161
  157   3HZ   LYS  21          2HZ       LYS  21   6.043 -16.985   3.111
  158    H    GLU  22           HN       GLU  22   4.809 -13.739  -2.876
  159    HA   GLU  22           HA       GLU  22   2.214 -12.592  -3.291
  160   1HB   GLU  22          1HB       GLU  22   4.613 -12.228  -5.088
  161   2HB   GLU  22          2HB       GLU  22   3.340 -11.075  -4.659
  162   1HG   GLU  22          1HG       GLU  22   5.618 -11.987  -2.836
  163   2HG   GLU  22          2HG       GLU  22   5.488 -10.488  -3.735
  164    H    GLU  23           HN       GLU  23   3.228 -15.498  -4.346
  165    HA   GLU  23           HA       GLU  23   3.372 -16.295  -6.695
  166   1HB   GLU  23          1HB       GLU  23   2.509 -17.685  -4.832
  167   2HB   GLU  23          2HB       GLU  23   0.887 -17.036  -5.068
  168   1HG   GLU  23          1HG       GLU  23   1.085 -19.255  -6.065
  169   2HG   GLU  23          2HG       GLU  23   0.804 -18.064  -7.337
  170    H    HIS  24           HN       HIS  24   0.050 -15.225  -5.944
  171    HA   HIS  24           HA       HIS  24  -0.165 -13.798  -8.483
  172   1HB   HIS  24          1HB       HIS  24  -0.832 -16.125  -9.087
  173   2HB   HIS  24          2HB       HIS  24  -2.066 -16.092  -7.821
  174    HD2  HIS  24           HD2      HIS  24  -4.341 -14.638  -8.420
  175    HE1  HIS  24           HE1      HIS  24  -3.206 -13.598 -12.367
  176    HE2  HIS  24           HE2      HIS  24  -5.139 -13.558 -10.713
  177    H    LYS  25           HN       LYS  25   0.172 -12.596  -6.239
  178    HA   LYS  25           HA       LYS  25  -2.506 -11.977  -5.051
  179   1HB   LYS  25          2HB       LYS  25   0.191 -11.518  -3.781
  180   2HB   LYS  25          1HB       LYS  25  -1.397 -11.480  -3.007
  181   1HG   LYS  25          1HG       LYS  25   0.048 -13.950  -4.077
  182   2HG   LYS  25          2HG       LYS  25  -0.075 -13.445  -2.396
  183   1HD   LYS  25          1HD       LYS  25  -2.491 -13.823  -2.412
  184   2HD   LYS  25          2HD       LYS  25  -2.481 -14.164  -4.140
  185   1HE   LYS  25          2HE       LYS  25  -2.568 -16.238  -2.780
  186   2HE   LYS  25          1HE       LYS  25  -1.148 -16.171  -3.831
  187   1HZ   LYS  25          1HZ       LYS  25  -1.158 -15.519  -0.968
  188   2HZ   LYS  25          3HZ       LYS  25  -0.619 -16.926  -1.632
  189   3HZ   LYS  25          2HZ       LYS  25   0.168 -15.518  -1.954
  190    HA   PRO  26           HA       PRO  26  -1.548  -7.915  -6.753
  191   1HB   PRO  26          1HB       PRO  26  -3.579  -6.425  -5.743
  192   2HB   PRO  26          2HB       PRO  26  -3.845  -7.677  -6.991
  193   1HG   PRO  26          1HG       PRO  26  -4.161  -7.969  -4.000
  194   2HG   PRO  26          2HG       PRO  26  -5.375  -8.368  -5.241
  195   1HD   PRO  26          2HD       PRO  26  -3.718 -10.268  -4.220
  196   2HD   PRO  26          1HD       PRO  26  -4.084 -10.277  -5.967
  197    H    ILE  27           HN       ILE  27   0.261  -6.998  -6.007
  198    HA   ILE  27           HA       ILE  27   0.501  -6.221  -3.187
  199    HB   ILE  27           HB       ILE  27   2.383  -5.757  -5.511
  200   1HG1  ILE  27          2HG12     ILE  27   2.726  -7.810  -3.307
  201   2HG1  ILE  27          1HG11     ILE  27   1.931  -8.219  -4.828
  202   1HG2  ILE  27          2HG22     ILE  27   2.638  -4.159  -3.614
  203   2HG2  ILE  27          3HG23     ILE  27   2.818  -5.525  -2.501
  204   3HG2  ILE  27          1HG21     ILE  27   4.036  -5.221  -3.756
  205   1HD1  ILE  27          3HD13     ILE  27   3.943  -7.513  -6.090
  206   2HD1  ILE  27          2HD12     ILE  27   4.770  -7.187  -4.548
  207   3HD1  ILE  27          1HD11     ILE  27   4.259  -8.832  -4.951
  208    H    VAL  28           HN       VAL  28  -0.820  -4.531  -2.779
  209    HA   VAL  28           HA       VAL  28  -1.470  -2.575  -4.926
  210    HB   VAL  28           HB       VAL  28  -2.758  -2.634  -2.185
  211   1HG1  VAL  28          3HG13     VAL  28  -2.989  -0.686  -3.822
  212   2HG1  VAL  28          1HG11     VAL  28  -3.803  -1.797  -4.927
  213   3HG1  VAL  28          2HG12     VAL  28  -4.523  -1.451  -3.342
  214   1HG2  VAL  28          1HG21     VAL  28  -3.594  -4.270  -4.612
  215   2HG2  VAL  28          2HG22     VAL  28  -3.123  -4.904  -3.017
  216   3HG2  VAL  28          3HG23     VAL  28  -4.606  -3.963  -3.184
  217    H    VAL  29           HN       VAL  29  -0.151  -0.787  -4.926
  218    HA   VAL  29           HA       VAL  29   1.332  -0.176  -2.405
  219    HB   VAL  29           HB       VAL  29   2.095   0.934  -5.087
  220   1HG1  VAL  29          3HG23     VAL  29   2.987   1.812  -2.895
  221   2HG1  VAL  29          1HG21     VAL  29   3.615   0.194  -2.543
  222   3HG1  VAL  29          2HG22     VAL  29   4.236   1.119  -3.923
  223   1HG2  VAL  29          1HG11     VAL  29   2.921  -1.776  -4.012
  224   2HG2  VAL  29          2HG12     VAL  29   1.943  -1.469  -5.469
  225   3HG2  VAL  29          3HG13     VAL  29   3.616  -0.924  -5.418
  226    H    ASP  30           HN       ASP  30   0.529   1.465  -1.293
  227    HA   ASP  30           HA       ASP  30  -0.896   3.750  -2.629
  228   1HB   ASP  30          1HB       ASP  30  -2.116   2.903  -0.818
  229   2HB   ASP  30          2HB       ASP  30  -0.708   2.771   0.233
  230    H    PHE  31           HN       PHE  31   1.005   4.529  -3.656
  231    HA   PHE  31           HA       PHE  31   3.408   5.223  -2.069
  232   1HB   PHE  31          1HB       PHE  31   2.508   5.734  -4.922
  233   2HB   PHE  31          2HB       PHE  31   3.995   6.344  -4.270
  234    HD1  PHE  31           HD2      PHE  31   5.749   4.617  -3.394
  235    HD2  PHE  31           HD1      PHE  31   2.430   3.576  -5.939
  236    HE1  PHE  31           HE2      PHE  31   7.180   2.991  -4.588
  237    HE2  PHE  31           HE1      PHE  31   3.876   1.945  -7.124
  238    HZ   PHE  31           HZ       PHE  31   6.273   1.743  -6.553
  239    H    THR  32           HN       THR  32   3.007   6.956  -0.587
  240    HA   THR  32           HA       THR  32   1.857   9.425  -1.555
  241    HB   THR  32           HB       THR  32  -0.131   7.817  -1.375
  242    HG1  THR  32           HG1      THR  32  -1.376   9.363  -0.467
  243   1HG2  THR  32          2HG22     THR  32   0.369   8.021   1.645
  244   2HG2  THR  32          1HG21     THR  32  -1.044   7.375   0.851
  245   3HG2  THR  32          3HG23     THR  32   0.531   6.572   0.653
  246    H    ALA  33           HN       ALA  33   0.798  10.285   0.803
  247    HA   ALA  33           HA       ALA  33   1.184  11.305   2.780
  248   1HB   ALA  33          1HB       ALA  33   1.178   8.944   3.525
  249   2HB   ALA  33          3HB       ALA  33   2.940   8.866   3.339
  250   3HB   ALA  33          2HB       ALA  33   2.199   9.937   4.545
  251    H    THR  34           HN       THR  34   4.002  10.659   4.128
  252    HA   THR  34           HA       THR  34   5.725  11.971   4.666
  253    HB   THR  34           HB       THR  34   7.346  12.387   2.934
  254    HG1  THR  34           HG1      THR  34   5.170  12.013   1.151
  255   1HG2  THR  34          2HG22     THR  34   6.861  10.065   3.712
  256   2HG2  THR  34          3HG23     THR  34   5.802   9.827   2.303
  257   3HG2  THR  34          1HG21     THR  34   7.532  10.102   2.078
  258    H    TRP  35           HN       TRP  35   5.707  14.035   1.903
  259    HA   TRP  35           HA       TRP  35   5.214  16.361   3.596
  260   1HB   TRP  35          1HB       TRP  35   5.569  17.622   1.556
  261   2HB   TRP  35          2HB       TRP  35   6.827  16.409   1.763
  262    HD1  TRP  35           HD1      TRP  35   7.102  14.624  -0.126
  263    HE1  TRP  35           HE1      TRP  35   6.058  14.287  -2.469
  264    HE3  TRP  35           HE3      TRP  35   3.238  17.980   0.177
  265    HZ2  TRP  35           HZ2      TRP  35   3.853  15.308  -3.976
  266    HZ3  TRP  35           HZ3      TRP  35   1.654  18.226  -1.706
  267    HH2  TRP  35           HH2      TRP  35   1.949  16.896  -3.782
  268    H    CYS  36           HN       CYS  36   3.201  14.291   1.540
  269    HA   CYS  36           HA       CYS  36   1.195  16.337   1.028
  270   1HB   CYS  36          1HB       CYS  36   1.538  14.500  -0.516
  271   2HB   CYS  36          2HB       CYS  36   1.065  13.330   0.728
  272    H    GLY  37           HN       GLY  37   0.972  17.072   3.244
  273   1HA   GLY  37          1HA       GLY  37  -0.059  15.812   5.441
  274   2HA   GLY  37          2HA       GLY  37  -0.588  17.427   4.942
  275    HA   PRO  38           HA       PRO  38  -4.664  16.192   3.826
  276   1HB   PRO  38          1HB       PRO  38  -4.012  16.120   0.864
  277   2HB   PRO  38          2HB       PRO  38  -5.442  16.833   1.667
  278   1HG   PRO  38          1HG       PRO  38  -3.413  18.452   0.911
  279   2HG   PRO  38          2HG       PRO  38  -4.106  18.642   2.550
  280   1HD   PRO  38          1HD       PRO  38  -1.586  17.173   1.747
  281   2HD   PRO  38          2HD       PRO  38  -1.833  18.314   3.102
  282    H    CYS  39           HN       CYS  39  -2.222  14.342   2.036
  283    HA   CYS  39           HA       CYS  39  -3.859  12.131   1.286
  284   1HB   CYS  39          2HB       CYS  39  -0.873  12.159   1.858
  285   2HB   CYS  39          1HB       CYS  39  -1.797  10.862   1.138
  286    H    LYS  40           HN       LYS  40  -2.455  13.054   4.401
  287    HA   LYS  40           HA       LYS  40  -2.381  10.462   5.604
  288   1HB   LYS  40          2HB       LYS  40  -2.970  13.145   6.905
  289   2HB   LYS  40          1HB       LYS  40  -2.436  11.681   7.730
  290   1HG   LYS  40          2HG       LYS  40  -0.798  13.237   5.678
  291   2HG   LYS  40          1HG       LYS  40  -0.637  13.344   7.430
  292   1HD   LYS  40          1HD       LYS  40  -0.035  10.891   7.456
  293   2HD   LYS  40          2HD       LYS  40  -0.065  10.908   5.683
  294   1HE   LYS  40          1HE       LYS  40   1.739  12.605   7.479
  295   2HE   LYS  40          2HE       LYS  40   2.245  11.213   6.516
  296   1HZ   LYS  40          2HZ       LYS  40   1.586  12.459   4.549
  297   2HZ   LYS  40          1HZ       LYS  40   1.211  13.760   5.478
  298   3HZ   LYS  40          3HZ       LYS  40   2.766  13.235   5.402
  299    H    MET  41           HN       MET  41  -5.099  12.466   4.636
  300    HA   MET  41           HA       MET  41  -7.029  11.095   6.411
  301   1HB   MET  41          2HB       MET  41  -7.453  12.915   4.002
  302   2HB   MET  41          1HB       MET  41  -8.661  12.455   5.204
  303   1HG   MET  41          2HG       MET  41  -6.182  14.152   5.776
  304   2HG   MET  41          1HG       MET  41  -7.806  14.736   5.474
  305   1HE   MET  41          1HE       MET  41  -5.276  13.988   8.032
  306   2HE   MET  41          3HE       MET  41  -6.143  13.366   9.452
  307   3HE   MET  41          2HE       MET  41  -5.844  12.297   8.071
  308    H    ILE  42           HN       ILE  42  -5.717  10.780   3.168
  309    HA   ILE  42           HA       ILE  42  -7.836   8.952   2.270
  310    HB   ILE  42           HB       ILE  42  -5.158   9.661   0.991
  311   1HG1  ILE  42          2HG12     ILE  42  -7.947  10.812   0.473
  312   2HG1  ILE  42          1HG11     ILE  42  -6.676  11.657   1.364
  313   1HG2  ILE  42          2HG22     ILE  42  -7.704   8.350  -0.066
  314   2HG2  ILE  42          3HG23     ILE  42  -6.311   8.776  -1.075
  315   3HG2  ILE  42          1HG21     ILE  42  -6.142   7.544   0.164
  316   1HD1  ILE  42          2HD12     ILE  42  -5.205  11.598  -0.622
  317   2HD1  ILE  42          1HD11     ILE  42  -6.552  10.911  -1.561
  318   3HD1  ILE  42          3HD13     ILE  42  -6.702  12.519  -0.843
  319    H    ALA  43           HN       ALA  43  -4.559   8.839   3.580
  320    HA   ALA  43           HA       ALA  43  -3.800   6.263   3.210
  321   1HB   ALA  43          1HB       ALA  43  -3.501   8.066   5.659
  322   2HB   ALA  43          2HB       ALA  43  -2.654   6.524   5.525
  323   3HB   ALA  43          3HB       ALA  43  -2.360   7.810   4.335
  324    HA   PRO  44           HA       PRO  44  -6.171   4.457   7.011
  325   1HB   PRO  44          2HB       PRO  44  -8.405   5.751   7.969
  326   2HB   PRO  44          1HB       PRO  44  -6.757   5.993   8.618
  327   1HG   PRO  44          1HG       PRO  44  -8.170   7.651   6.510
  328   2HG   PRO  44          2HG       PRO  44  -7.364   8.243   7.999
  329   1HD   PRO  44          2HD       PRO  44  -5.994   8.292   5.721
  330   2HD   PRO  44          1HD       PRO  44  -5.195   7.636   7.173
  331    H    LEU  45           HN       LEU  45  -8.037   6.425   4.703
  332    HA   LEU  45           HA       LEU  45 -10.222   4.631   4.357
  333   1HB   LEU  45          2HB       LEU  45  -9.014   6.855   2.744
  334   2HB   LEU  45          1HB       LEU  45  -9.866   5.620   1.834
  335    HG   LEU  45           HG       LEU  45 -11.823   5.943   3.463
  336   1HD1  LEU  45          3HD23     LEU  45 -10.552   7.044   5.298
  337   2HD1  LEU  45          2HD22     LEU  45 -10.281   8.445   4.236
  338   3HD1  LEU  45          1HD21     LEU  45 -11.924   8.018   4.745
  339   1HD2  LEU  45          3HD13     LEU  45 -10.933   8.319   1.771
  340   2HD2  LEU  45          1HD11     LEU  45 -11.843   6.897   1.209
  341   3HD2  LEU  45          2HD12     LEU  45 -12.588   8.028   2.352
  342    H    PHE  46           HN       PHE  46  -7.132   4.802   2.499
  343    HA   PHE  46           HA       PHE  46  -7.605   2.384   1.002
  344   1HB   PHE  46          2HB       PHE  46  -5.892   3.934   0.354
  345   2HB   PHE  46          1HB       PHE  46  -5.108   3.824   1.910
  346    HD1  PHE  46           HD2      PHE  46  -3.753   1.753   2.475
  347    HD2  PHE  46           HD1      PHE  46  -5.499   2.285  -1.425
  348    HE1  PHE  46           HE2      PHE  46  -2.037   0.248   1.485
  349    HE2  PHE  46           HE1      PHE  46  -3.826   0.781  -2.388
  350    HZ   PHE  46           HZ       PHE  46  -1.959  -0.108  -0.973
  351    H    GLU  47           HN       GLU  47  -6.149   2.975   4.218
  352    HA   GLU  47           HA       GLU  47  -5.285   0.373   4.764
  353   1HB   GLU  47          2HB       GLU  47  -4.866   2.548   6.039
  354   2HB   GLU  47          1HB       GLU  47  -6.391   2.213   6.894
  355   1HG   GLU  47          1HG       GLU  47  -5.492   0.088   7.714
  356   2HG   GLU  47          2HG       GLU  47  -4.026   0.291   6.740
  357    H    THR  48           HN       THR  48  -8.675   1.702   5.228
  358    HA   THR  48           HA       THR  48  -9.603  -0.557   6.649
  359    HB   THR  48           HB       THR  48 -11.814   0.016   5.866
  360    HG1  THR  48           HG1      THR  48 -10.538   1.893   4.158
  361   1HG2  THR  48          1HG21     THR  48 -10.759   1.366   7.680
  362   2HG2  THR  48          3HG23     THR  48 -10.276   2.568   6.467
  363   3HG2  THR  48          2HG22     THR  48 -11.990   2.252   6.753
  364    H    LEU  49           HN       LEU  49  -9.692   0.021   3.111
  365    HA   LEU  49           HA       LEU  49 -10.651  -2.557   2.386
  366   1HB   LEU  49          2HB       LEU  49  -8.832  -0.637   0.871
  367   2HB   LEU  49          1HB       LEU  49  -9.376  -2.160   0.198
  368    HG   LEU  49           HG       LEU  49 -10.662  -0.241  -0.597
  369   1HD1  LEU  49          3HD13     LEU  49 -11.646  -2.452  -0.688
  370   2HD1  LEU  49          2HD12     LEU  49 -12.303  -2.290   0.956
  371   3HD1  LEU  49          1HD11     LEU  49 -12.902  -1.255  -0.340
  372   1HD2  LEU  49          1HD21     LEU  49 -10.695   1.097   1.505
  373   2HD2  LEU  49          3HD23     LEU  49 -12.280   0.917   0.742
  374   3HD2  LEU  49          2HD22     LEU  49 -11.892  -0.047   2.172
  375    H    SER  50           HN       SER  50  -7.329  -1.388   2.957
  376    HA   SER  50           HA       SER  50  -5.926  -3.747   2.314
  377   1HB   SER  50          2HB       SER  50  -5.263  -2.030   4.741
  378   2HB   SER  50          1HB       SER  50  -4.196  -2.989   3.738
  379    HG   SER  50           HG       SER  50  -5.619  -0.762   2.710
  380    H    ASN  51           HN       ASN  51  -7.325  -2.829   5.486
  381    HA   ASN  51           HA       ASN  51  -6.711  -5.243   6.836
  382   1HB   ASN  51          1HB       ASN  51  -7.497  -2.987   7.772
  383   2HB   ASN  51          2HB       ASN  51  -9.142  -3.492   7.380
  384   1HD2  ASN  51          2HD22     ASN  51  -8.485  -6.334   9.921
  385   2HD2  ASN  51          1HD21     ASN  51  -8.571  -6.455   8.177
  386    H    ASP  52           HN       ASP  52  -9.576  -4.265   4.906
  387    HA   ASP  52           HA       ASP  52 -11.227  -6.480   5.475
  388   1HB   ASP  52          1HB       ASP  52 -11.992  -4.431   4.327
  389   2HB   ASP  52          2HB       ASP  52 -11.019  -4.847   2.904
  390    H    TYR  53           HN       TYR  53  -8.977  -6.046   2.678
  391    HA   TYR  53           HA       TYR  53  -9.478  -8.791   1.781
  392   1HB   TYR  53          1HB       TYR  53  -7.723  -6.506   0.854
  393   2HB   TYR  53          2HB       TYR  53  -7.647  -8.123   0.152
  394    HD1  TYR  53           HD2      TYR  53  -9.950  -5.215   0.621
  395    HD2  TYR  53           HD1      TYR  53  -9.182  -8.923  -1.439
  396    HE1  TYR  53           HE2      TYR  53 -11.762  -4.708  -0.968
  397    HE2  TYR  53           HE1      TYR  53 -10.987  -8.403  -3.035
  398    HH   TYR  53           HH       TYR  53 -12.790  -7.016  -3.487
  399    H    ALA  54           HN       ALA  54  -7.099  -7.296   3.853
  400    HA   ALA  54           HA       ALA  54  -4.779  -8.312   3.897
  401   1HB   ALA  54          2HB       ALA  54  -5.862  -7.269   5.860
  402   2HB   ALA  54          3HB       ALA  54  -6.656  -8.803   6.244
  403   3HB   ALA  54          1HB       ALA  54  -4.886  -8.673   6.326
  404    H    GLY  55           HN       GLY  55  -3.906 -10.137   3.036
  405   1HA   GLY  55          1HA       GLY  55  -3.339 -12.402   4.232
  406   2HA   GLY  55          2HA       GLY  55  -4.984 -12.826   3.724
  407    H    LYS  56           HN       LYS  56  -5.484 -12.346   1.380
  408    HA   LYS  56           HA       LYS  56  -3.403 -13.626  -0.292
  409   1HB   LYS  56          2HB       LYS  56  -6.296 -12.909  -0.911
  410   2HB   LYS  56          1HB       LYS  56  -5.243 -13.982  -1.855
  411   1HG   LYS  56          1HG       LYS  56  -5.038 -15.487   0.115
  412   2HG   LYS  56          2HG       LYS  56  -6.371 -14.594   0.874
  413   1HD   LYS  56          2HD       LYS  56  -6.482 -15.822  -1.942
  414   2HD   LYS  56          1HD       LYS  56  -7.000 -16.631  -0.482
  415   1HE   LYS  56          2HE       LYS  56  -8.676 -14.813  -0.057
  416   2HE   LYS  56          1HE       LYS  56  -8.172 -14.023  -1.565
  417   1HZ   LYS  56          3HZ       LYS  56  -9.336 -16.703  -1.359
  418   2HZ   LYS  56          1HZ       LYS  56 -10.108 -15.342  -1.875
  419   3HZ   LYS  56          2HZ       LYS  56  -8.859 -15.963  -2.752
  420    H    VAL  57           HN       VAL  57  -3.193 -10.724   0.593
  421    HA   VAL  57           HA       VAL  57  -2.846  -9.412  -2.010
  422    HB   VAL  57           HB       VAL  57  -4.100  -7.446  -1.226
  423   1HG1  VAL  57          2HG22     VAL  57  -5.284  -9.317  -2.536
  424   2HG1  VAL  57          3HG23     VAL  57  -6.020  -9.792  -0.997
  425   3HG1  VAL  57          1HG21     VAL  57  -6.308  -8.174  -1.669
  426   1HG2  VAL  57          3HG13     VAL  57  -4.896  -9.208   1.155
  427   2HG2  VAL  57          1HG11     VAL  57  -3.893  -7.752   1.241
  428   3HG2  VAL  57          2HG12     VAL  57  -5.582  -7.626   0.814
  429    H    ILE  58           HN       ILE  58  -1.460  -7.442  -1.698
  430    HA   ILE  58           HA       ILE  58  -0.226  -7.253   1.044
  431    HB   ILE  58           HB       ILE  58   1.367  -7.305  -1.549
  432   1HG1  ILE  58          2HG12     ILE  58   2.364  -9.361  -0.191
  433   2HG1  ILE  58          1HG11     ILE  58   0.765  -9.425   0.504
  434   1HG2  ILE  58          2HG22     ILE  58   2.222  -5.881   0.372
  435   2HG2  ILE  58          3HG23     ILE  58   2.266  -7.359   1.343
  436   3HG2  ILE  58          1HG21     ILE  58   3.291  -7.209  -0.099
  437   1HD1  ILE  58          2HD12     ILE  58  -0.146  -9.643  -1.909
  438   2HD1  ILE  58          3HD13     ILE  58   1.528  -9.654  -2.451
  439   3HD1  ILE  58          1HD11     ILE  58   0.926 -10.951  -1.403
  440    H    PHE  59           HN       PHE  59  -1.307  -5.402   1.566
  441    HA   PHE  59           HA       PHE  59  -1.382  -3.128  -0.323
  442   1HB   PHE  59          2HB       PHE  59  -2.666  -3.742   2.303
  443   2HB   PHE  59          1HB       PHE  59  -2.600  -2.103   1.689
  444    HD1  PHE  59           HD2      PHE  59  -3.560  -5.535   0.378
  445    HD2  PHE  59           HD1      PHE  59  -4.423  -1.312   0.451
  446    HE1  PHE  59           HE2      PHE  59  -5.819  -5.946  -0.544
  447    HE2  PHE  59           HE1      PHE  59  -6.695  -1.743  -0.279
  448    HZ   PHE  59           HZ       PHE  59  -7.481  -4.104  -0.600
  449    H    LEU  60           HN       LEU  60   0.674  -2.354  -0.455
  450    HA   LEU  60           HA       LEU  60   2.309  -1.822   1.973
  451   1HB   LEU  60          1HB       LEU  60   2.855  -1.558  -1.011
  452   2HB   LEU  60          2HB       LEU  60   4.043  -1.262   0.276
  453    HG   LEU  60           HG       LEU  60   2.732  -3.897  -0.482
  454   1HD1  LEU  60          1HD21     LEU  60   4.495  -3.069  -2.019
  455   2HD1  LEU  60          2HD22     LEU  60   5.623  -2.947  -0.652
  456   3HD1  LEU  60          3HD23     LEU  60   5.006  -4.532  -1.157
  457   1HD2  LEU  60          1HD11     LEU  60   4.717  -3.244   1.748
  458   2HD2  LEU  60          2HD12     LEU  60   3.100  -3.958   1.944
  459   3HD2  LEU  60          3HD13     LEU  60   4.386  -4.888   1.164
  460    H    LYS  61           HN       LYS  61   1.844   0.152   2.994
  461    HA   LYS  61           HA       LYS  61   1.168   2.484   1.249
  462   1HB   LYS  61          2HB       LYS  61   1.237   2.338   4.267
  463   2HB   LYS  61          1HB       LYS  61   0.643   3.650   3.255
  464   1HG   LYS  61          2HG       LYS  61  -1.180   2.275   2.477
  465   2HG   LYS  61          1HG       LYS  61  -0.455   0.810   3.144
  466   1HD   LYS  61          1HD       LYS  61  -2.315   1.524   4.557
  467   2HD   LYS  61          2HD       LYS  61  -0.782   1.554   5.431
  468   1HE   LYS  61          1HE       LYS  61  -2.173   3.558   5.910
  469   2HE   LYS  61          2HE       LYS  61  -0.626   3.993   5.175
  470   1HZ   LYS  61          1HZ       LYS  61  -1.823   4.101   3.031
  471   2HZ   LYS  61          2HZ       LYS  61  -3.245   3.870   3.847
  472   3HZ   LYS  61          3HZ       LYS  61  -2.315   5.194   4.139
  473    H    VAL  62           HN       VAL  62   2.862   3.444   0.357
  474    HA   VAL  62           HA       VAL  62   5.548   3.115   1.665
  475    HB   VAL  62           HB       VAL  62   4.690   3.261  -1.229
  476   1HG1  VAL  62          3HG13     VAL  62   7.485   3.580  -0.062
  477   2HG1  VAL  62          1HG11     VAL  62   7.145   3.180  -1.758
  478   3HG1  VAL  62          2HG12     VAL  62   6.645   4.745  -1.110
  479   1HG2  VAL  62          3HG23     VAL  62   4.719   1.070  -0.022
  480   2HG2  VAL  62          1HG21     VAL  62   5.967   1.149  -1.283
  481   3HG2  VAL  62          2HG22     VAL  62   6.416   1.350   0.422
  482    H    ASP  63           HN       ASP  63   6.411   4.746   2.608
  483    HA   ASP  63           HA       ASP  63   5.629   7.520   2.112
  484   1HB   ASP  63          2HB       ASP  63   7.710   6.159   3.855
  485   2HB   ASP  63          1HB       ASP  63   7.652   7.907   3.679
  486    H    VAL  64           HN       VAL  64   5.965   7.469  -0.108
  487    HA   VAL  64           HA       VAL  64   8.012   6.890  -1.739
  488    HB   VAL  64           HB       VAL  64   7.351   8.864  -3.138
  489   1HG1  VAL  64          1HG11     VAL  64   5.155   7.148  -1.918
  490   2HG1  VAL  64          3HG13     VAL  64   4.956   8.155  -3.351
  491   3HG1  VAL  64          2HG12     VAL  64   6.146   6.838  -3.359
  492   1HG2  VAL  64          2HG22     VAL  64   5.590   9.609  -0.755
  493   2HG2  VAL  64          3HG23     VAL  64   6.850  10.609  -1.519
  494   3HG2  VAL  64          1HG21     VAL  64   5.403  10.185  -2.415
  495    H    ASP  65           HN       ASP  65   8.027   9.968   0.123
  496    HA   ASP  65           HA       ASP  65  10.343  11.073  -0.977
  497   1HB   ASP  65          2HB       ASP  65   8.779  12.204   0.622
  498   2HB   ASP  65          1HB       ASP  65   9.477  11.240   1.943
  499    H    ALA  66           HN       ALA  66  10.048   8.583   1.560
  500    HA   ALA  66           HA       ALA  66  12.948   8.558   2.106
  501   1HB   ALA  66          2HB       ALA  66  11.307   8.116   3.910
  502   2HB   ALA  66          1HB       ALA  66  10.700   6.714   3.000
  503   3HB   ALA  66          3HB       ALA  66  12.370   6.723   3.616
  504    H    VAL  67           HN       VAL  67  10.436   6.496   0.590
  505    HA   VAL  67           HA       VAL  67  12.429   4.620  -0.521
  506    HB   VAL  67           HB       VAL  67   9.392   4.835  -0.691
  507   1HG1  VAL  67          1HG21     VAL  67  11.258   2.801  -1.888
  508   2HG1  VAL  67          3HG23     VAL  67   9.672   2.289  -1.276
  509   3HG1  VAL  67          2HG22     VAL  67   9.734   3.529  -2.513
  510   1HG2  VAL  67          1HG11     VAL  67  11.296   3.078   0.925
  511   2HG2  VAL  67          3HG13     VAL  67  10.218   4.348   1.546
  512   3HG2  VAL  67          2HG12     VAL  67   9.539   2.860   0.892
  513    H    ALA  68           HN       ALA  68  13.204   6.976  -1.298
  514    HA   ALA  68           HA       ALA  68  12.083   8.301  -3.457
  515   1HB   ALA  68          2HB       ALA  68  13.874   9.196  -2.050
  516   2HB   ALA  68          3HB       ALA  68  15.024   8.006  -2.693
  517   3HB   ALA  68          1HB       ALA  68  14.346   9.257  -3.758
  518    H    ALA  69           HN       ALA  69  14.793   5.921  -3.696
  519    HA   ALA  69           HA       ALA  69  15.108   5.997  -6.458
  520   1HB   ALA  69          3HB       ALA  69  16.640   4.831  -4.926
  521   2HB   ALA  69          1HB       ALA  69  15.410   3.589  -4.601
  522   3HB   ALA  69          2HB       ALA  69  16.112   3.745  -6.225
  523    H    VAL  70           HN       VAL  70  12.993   3.775  -4.621
  524    HA   VAL  70           HA       VAL  70  11.951   2.384  -6.902
  525    HB   VAL  70           HB       VAL  70  10.800   2.819  -4.150
  526   1HG1  VAL  70          3HG23     VAL  70   9.070   1.979  -5.698
  527   2HG1  VAL  70          1HG21     VAL  70  10.139   0.636  -6.154
  528   3HG1  VAL  70          2HG22     VAL  70   9.509   0.763  -4.496
  529   1HG2  VAL  70          2HG12     VAL  70  12.551   0.572  -5.197
  530   2HG2  VAL  70          3HG13     VAL  70  13.002   1.775  -3.967
  531   3HG2  VAL  70          1HG11     VAL  70  11.747   0.584  -3.611
  532    H    ALA  71           HN       ALA  71  10.690   5.130  -4.912
  533    HA   ALA  71           HA       ALA  71   8.280   5.553  -6.310
  534   1HB   ALA  71          2HB       ALA  71   8.874   6.685  -4.203
  535   2HB   ALA  71          1HB       ALA  71  10.124   7.629  -5.037
  536   3HB   ALA  71          3HB       ALA  71   8.417   7.864  -5.443
  537    H    GLU  72           HN       GLU  72  11.547   6.888  -7.009
  538    HA   GLU  72           HA       GLU  72  10.911   8.363  -9.294
  539   1HB   GLU  72          2HB       GLU  72  13.267   7.648  -7.846
  540   2HB   GLU  72          1HB       GLU  72  13.549   7.020  -9.467
  541   1HG   GLU  72          1HG       GLU  72  12.970   9.227 -10.406
  542   2HG   GLU  72          2HG       GLU  72  12.663   9.820  -8.745
  543    H    ALA  73           HN       ALA  73  12.185   4.998  -9.091
  544    HA   ALA  73           HA       ALA  73  12.115   4.461 -11.841
  545   1HB   ALA  73          3HB       ALA  73  13.240   3.030 -10.154
  546   2HB   ALA  73          1HB       ALA  73  11.662   2.525  -9.513
  547   3HB   ALA  73          2HB       ALA  73  12.137   2.072 -11.164
  548    H    ALA  74           HN       ALA  74   9.548   4.076  -9.399
  549    HA   ALA  74           HA       ALA  74   7.589   2.986 -11.269
  550   1HB   ALA  74          2HB       ALA  74   7.481   3.887  -8.381
  551   2HB   ALA  74          3HB       ALA  74   6.097   3.206  -9.268
  552   3HB   ALA  74          1HB       ALA  74   7.560   2.243  -9.015
  553    H    GLY  75           HN       GLY  75   8.845   6.092 -11.144
  554   1HA   GLY  75          1HA       GLY  75   8.129   8.088 -11.933
  555   2HA   GLY  75          2HA       GLY  75   6.891   7.174 -12.815
  556    H    ILE  76           HN       ILE  76   7.277   7.575  -9.257
  557    HA   ILE  76           HA       ILE  76   4.481   8.194  -8.923
  558    HB   ILE  76           HB       ILE  76   6.940   8.213  -7.184
  559   1HG1  ILE  76          1HG11     ILE  76   5.660   6.685  -5.860
  560   2HG1  ILE  76          2HG12     ILE  76   4.144   7.093  -6.679
  561   1HG2  ILE  76          1HG21     ILE  76   4.315   9.503  -6.322
  562   2HG2  ILE  76          2HG22     ILE  76   5.659   9.055  -5.255
  563   3HG2  ILE  76          3HG23     ILE  76   5.897  10.313  -6.449
  564   1HD1  ILE  76          3HD13     ILE  76   6.494   5.781  -8.060
  565   2HD1  ILE  76          1HD11     ILE  76   5.162   4.876  -7.330
  566   3HD1  ILE  76          2HD12     ILE  76   4.845   5.943  -8.698
  567    H    THR  77           HN       THR  77   3.425  10.101  -8.800
  568    HA   THR  77           HA       THR  77   4.853  12.684  -8.848
  569    HB   THR  77           HB       THR  77   3.407  13.350 -10.863
  570    HG1  THR  77           HG1      THR  77   3.432  10.549 -11.344
  571   1HG2  THR  77          3HG23     THR  77   5.879  12.967 -11.051
  572   2HG2  THR  77          2HG22     THR  77   5.557  11.280 -11.505
  573   3HG2  THR  77          1HG21     THR  77   4.976  12.597 -12.532
  574    H    ALA  78           HN       ALA  78   1.623  11.781  -9.901
  575    HA   ALA  78           HA       ALA  78   0.332  13.636  -8.079
  576   1HB   ALA  78          2HB       ALA  78  -0.730  11.518  -9.981
  577   2HB   ALA  78          1HB       ALA  78  -1.747  12.683  -9.097
  578   3HB   ALA  78          3HB       ALA  78  -0.562  13.255 -10.289
  579    H    MET  79           HN       MET  79   1.283  12.744  -6.083
  580    HA   MET  79           HA       MET  79   0.424  10.225  -5.021
  581   1HB   MET  79          2HB       MET  79   1.245  12.750  -3.572
  582   2HB   MET  79          1HB       MET  79   1.115  11.133  -2.835
  583   1HG   MET  79          2HG       MET  79   2.990  10.313  -3.930
  584   2HG   MET  79          1HG       MET  79   2.934  11.511  -5.218
  585   1HE   MET  79          2HE       MET  79   3.537  11.137  -1.340
  586   2HE   MET  79          3HE       MET  79   4.249  12.718  -0.970
  587   3HE   MET  79          1HE       MET  79   2.544  12.606  -1.449
  588    HA   PRO  80           HA       PRO  80  -0.716   9.209  -3.161
  589   1HB   PRO  80          2HB       PRO  80  -3.511   8.242  -3.552
  590   2HB   PRO  80          1HB       PRO  80  -2.476   8.047  -2.121
  591   1HG   PRO  80          1HG       PRO  80  -4.589   9.780  -2.194
  592   2HG   PRO  80          2HG       PRO  80  -3.085  10.224  -1.338
  593   1HD   PRO  80          2HD       PRO  80  -3.972  11.022  -4.120
  594   2HD   PRO  80          1HD       PRO  80  -3.262  12.041  -2.841
  595    H    THR  81           HN       THR  81   0.124   7.688  -4.537
  596    HA   THR  81           HA       THR  81  -1.103   7.300  -7.244
  597    HB   THR  81           HB       THR  81   1.743   7.269  -6.271
  598    HG1  THR  81           HG1      THR  81   0.254   9.143  -7.299
  599   1HG2  THR  81          1HG21     THR  81   0.602   6.345  -8.942
  600   2HG2  THR  81          3HG23     THR  81   2.317   6.716  -8.662
  601   3HG2  THR  81          2HG22     THR  81   1.553   5.384  -7.780
  602    H    PHE  82           HN       PHE  82  -2.218   5.456  -7.286
  603    HA   PHE  82           HA       PHE  82  -1.655   3.328  -5.282
  604   1HB   PHE  82          1HB       PHE  82  -4.113   3.967  -6.907
  605   2HB   PHE  82          2HB       PHE  82  -3.922   2.545  -5.894
  606    HD1  PHE  82           HD1      PHE  82  -3.140   3.029  -3.396
  607    HD2  PHE  82           HD2      PHE  82  -5.194   5.868  -5.922
  608    HE1  PHE  82           HE1      PHE  82  -3.834   4.333  -1.400
  609    HE2  PHE  82           HE2      PHE  82  -5.925   7.113  -3.913
  610    HZ   PHE  82           HZ       PHE  82  -5.097   6.407  -1.651
  611    H    HIS  83           HN       HIS  83  -0.248   1.781  -6.194
  612    HA   HIS  83           HA       HIS  83  -0.711   1.070  -9.098
  613   1HB   HIS  83          2HB       HIS  83   1.743   0.861  -7.349
  614   2HB   HIS  83          1HB       HIS  83   1.544   0.015  -8.891
  615    HD2  HIS  83           HD2      HIS  83   0.194   3.559  -9.269
  616    HE1  HIS  83           HE1      HIS  83   4.147   3.498 -10.740
  617    HE2  HIS  83           HE2      HIS  83   2.004   4.850 -10.655
  618    H    VAL  84           HN       VAL  84  -0.522  -1.184  -9.643
  619    HA   VAL  84           HA       VAL  84  -1.001  -3.059  -7.366
  620    HB   VAL  84           HB       VAL  84  -2.455  -3.215 -10.030
  621   1HG1  VAL  84          1HG21     VAL  84  -2.816  -4.607  -7.337
  622   2HG1  VAL  84          2HG22     VAL  84  -3.824  -4.852  -8.775
  623   3HG1  VAL  84          3HG23     VAL  84  -2.124  -5.345  -8.797
  624   1HG2  VAL  84          2HG12     VAL  84  -3.515  -2.145  -7.384
  625   2HG2  VAL  84          1HG11     VAL  84  -3.323  -1.218  -8.891
  626   3HG2  VAL  84          3HG13     VAL  84  -4.494  -2.539  -8.814
  627    H    TYR  85           HN       TYR  85   0.821  -4.300  -7.376
  628    HA   TYR  85           HA       TYR  85   1.963  -5.194 -10.009
  629   1HB   TYR  85          1HB       TYR  85   3.266  -5.003  -7.283
  630   2HB   TYR  85          2HB       TYR  85   4.006  -5.730  -8.689
  631    HD1  TYR  85           HD2      TYR  85   2.711  -2.573  -7.240
  632    HD2  TYR  85           HD1      TYR  85   5.129  -4.328 -10.333
  633    HE1  TYR  85           HE2      TYR  85   3.648  -0.338  -7.787
  634    HE2  TYR  85           HE1      TYR  85   6.011  -2.084 -10.914
  635    HH   TYR  85           HH       TYR  85   4.526   0.865  -9.647
  636    H    LYS  86           HN       LYS  86   1.150  -7.202 -10.524
  637    HA   LYS  86           HA       LYS  86   0.051  -8.900  -8.309
  638   1HB   LYS  86          2HB       LYS  86  -0.195  -9.056 -11.326
  639   2HB   LYS  86          1HB       LYS  86  -0.630 -10.382 -10.232
  640   1HG   LYS  86          1HG       LYS  86  -2.209  -8.946  -9.007
  641   2HG   LYS  86          2HG       LYS  86  -1.755  -7.561 -10.005
  642   1HD   LYS  86          1HD       LYS  86  -3.852  -8.426 -10.775
  643   2HD   LYS  86          2HD       LYS  86  -2.642  -8.760 -12.023
  644   1HE   LYS  86          1HE       LYS  86  -2.551 -11.125 -11.262
  645   2HE   LYS  86          2HE       LYS  86  -3.677 -10.749  -9.938
  646   1HZ   LYS  86          1HZ       LYS  86  -4.295 -10.516 -12.798
  647   2HZ   LYS  86          2HZ       LYS  86  -4.827 -11.700 -11.773
  648   3HZ   LYS  86          3HZ       LYS  86  -5.324 -10.178 -11.547
  649    H    ASP  87           HN       ASP  87   1.592  -9.972  -7.314
  650    HA   ASP  87           HA       ASP  87   3.282 -11.375  -6.844
  651   1HB   ASP  87          1HB       ASP  87   2.499 -12.814  -8.695
  652   2HB   ASP  87          2HB       ASP  87   3.528 -11.964  -9.836
  653    H    GLY  88           HN       GLY  88   4.080  -9.813  -9.848
  654   1HA   GLY  88          1HA       GLY  88   6.237  -8.185  -8.654
  655   2HA   GLY  88          2HA       GLY  88   6.769  -9.417  -9.816
  656    H    VAL  89           HN       VAL  89   4.520  -9.268 -11.647
  657    HA   VAL  89           HA       VAL  89   5.453  -7.002 -13.165
  658    HB   VAL  89           HB       VAL  89   4.866  -9.118 -14.221
  659   1HG1  VAL  89          1HG11     VAL  89   2.956  -9.870 -12.856
  660   2HG1  VAL  89          2HG12     VAL  89   1.955  -8.550 -13.498
  661   3HG1  VAL  89          3HG13     VAL  89   2.545  -9.827 -14.570
  662   1HG2  VAL  89          3HG23     VAL  89   4.746  -7.003 -15.513
  663   2HG2  VAL  89          1HG21     VAL  89   3.639  -8.244 -16.120
  664   3HG2  VAL  89          2HG22     VAL  89   3.005  -6.897 -15.161
  665    H    LYS  90           HN       LYS  90   4.599  -5.047 -13.496
  666    HA   LYS  90           HA       LYS  90   2.668  -3.963 -11.677
  667   1HB   LYS  90          2HB       LYS  90   4.590  -2.742 -12.781
  668   2HB   LYS  90          1HB       LYS  90   3.655  -2.756 -14.281
  669   1HG   LYS  90          1HG       LYS  90   1.812  -1.509 -13.121
  670   2HG   LYS  90          2HG       LYS  90   2.697  -1.606 -11.602
  671   1HD   LYS  90          2HD       LYS  90   2.967   0.591 -12.592
  672   2HD   LYS  90          1HD       LYS  90   4.521  -0.231 -12.484
  673   1HE   LYS  90          1HE       LYS  90   4.153   1.026 -14.627
  674   2HE   LYS  90          2HE       LYS  90   4.546  -0.681 -14.870
  675   1HZ   LYS  90          1HZ       LYS  90   1.827   0.438 -14.902
  676   2HZ   LYS  90          3HZ       LYS  90   2.724   0.088 -16.245
  677   3HZ   LYS  90          2HZ       LYS  90   2.247  -1.120 -15.231
  678    H    ALA  91           HN       ALA  91   0.635  -4.751 -11.796
  679    HA   ALA  91           HA       ALA  91  -0.578  -5.558 -14.344
  680   1HB   ALA  91          1HB       ALA  91  -0.767  -6.927 -12.271
  681   2HB   ALA  91          3HB       ALA  91  -1.679  -5.604 -11.505
  682   3HB   ALA  91          2HB       ALA  91  -2.338  -6.440 -12.929
  683    H    ASP  92           HN       ASP  92  -0.785  -2.908 -11.972
  684    HA   ASP  92           HA       ASP  92  -2.319  -1.378 -13.932
  685   1HB   ASP  92          2HB       ASP  92  -3.829  -2.933 -12.207
  686   2HB   ASP  92          1HB       ASP  92  -3.753  -1.426 -11.306
  687    H    ASP  93           HN       ASP  93  -3.054   0.767 -12.979
  688    HA   ASP  93           HA       ASP  93  -1.248   1.947 -10.996
  689   1HB   ASP  93          2HB       ASP  93  -1.439   3.030 -13.824
  690   2HB   ASP  93          1HB       ASP  93  -0.608   3.786 -12.475
  691    H    LEU  94           HN       LEU  94  -2.058   4.078 -10.447
  692    HA   LEU  94           HA       LEU  94  -4.443   5.244 -11.490
  693   1HB   LEU  94          1HB       LEU  94  -5.546   3.314 -10.472
  694   2HB   LEU  94          2HB       LEU  94  -4.600   3.475  -9.013
  695    HG   LEU  94           HG       LEU  94  -5.823   5.675  -8.563
  696   1HD1  LEU  94          2HD12     LEU  94  -7.327   4.736 -11.051
  697   2HD1  LEU  94          1HD11     LEU  94  -7.931   5.990  -9.955
  698   3HD1  LEU  94          3HD13     LEU  94  -6.452   6.262 -10.875
  699   1HD2  LEU  94          1HD21     LEU  94  -6.512   3.535  -7.548
  700   2HD2  LEU  94          2HD22     LEU  94  -7.889   4.593  -7.869
  701   3HD2  LEU  94          3HD23     LEU  94  -7.565   3.214  -8.939
  702    H    VAL  95           HN       VAL  95  -4.880   7.276 -10.226
  703    HA   VAL  95           HA       VAL  95  -2.870   7.996  -8.218
  704    HB   VAL  95           HB       VAL  95  -2.403  10.101  -9.439
  705   1HG1  VAL  95          1HG21     VAL  95  -0.805   8.218  -9.547
  706   2HG1  VAL  95          2HG22     VAL  95  -1.579   7.646 -11.042
  707   3HG1  VAL  95          3HG23     VAL  95  -0.767   9.218 -11.006
  708   1HG2  VAL  95          1HG11     VAL  95  -4.372  10.161 -10.952
  709   2HG2  VAL  95          2HG12     VAL  95  -2.847  10.309 -11.836
  710   3HG2  VAL  95          3HG13     VAL  95  -3.724   8.769 -11.847
  711    H    GLY  96           HN       GLY  96  -3.412   9.974  -7.133
  712   1HA   GLY  96          1HA       GLY  96  -4.769  11.696  -6.372
  713   2HA   GLY  96          2HA       GLY  96  -5.939  11.356  -7.664
  714    H    ALA  97           HN       ALA  97  -7.215  11.872  -5.501
  715    HA   ALA  97           HA       ALA  97  -7.524   9.678  -3.616
  716   1HB   ALA  97          3HB       ALA  97  -7.844  12.121  -3.072
  717   2HB   ALA  97          1HB       ALA  97  -9.283  12.125  -4.104
  718   3HB   ALA  97          2HB       ALA  97  -9.240  11.110  -2.646
  719    H    SER  98           HN       SER  98  -7.860   8.597  -6.159
  720    HA   SER  98           HA       SER  98 -10.676   8.558  -6.966
  721   1HB   SER  98          2HB       SER  98  -8.289   6.928  -7.902
  722   2HB   SER  98          1HB       SER  98  -9.840   7.153  -8.750
  723    HG   SER  98           HG       SER  98  -7.638   8.764  -8.720
  724    H    GLN  99           HN       GLN  99 -10.965   7.857  -4.534
  725    HA   GLN  99           HA       GLN  99 -10.313   5.292  -3.606
  726   1HB   GLN  99          1HB       GLN  99 -12.886   6.802  -2.960
  727   2HB   GLN  99          2HB       GLN  99 -12.071   5.581  -1.971
  728   1HG   GLN  99          1HG       GLN  99 -11.146   8.413  -2.582
  729   2HG   GLN  99          2HG       GLN  99 -11.544   7.711  -1.029
  730   1HE2  GLN  99          1HE21     GLN  99  -8.399   5.853  -0.831
  731   2HE2  GLN  99          2HE22     GLN  99 -10.105   5.660  -0.458
  732    H    ASP 100           HN       ASP 100 -13.111   6.244  -5.575
  733    HA   ASP 100           HA       ASP 100 -14.538   3.765  -5.469
  734   1HB   ASP 100          1HB       ASP 100 -15.690   4.594  -7.440
  735   2HB   ASP 100          2HB       ASP 100 -15.515   5.906  -6.269
  736    H    LYS 101           HN       LYS 101 -12.146   5.070  -7.796
  737    HA   LYS 101           HA       LYS 101 -12.114   2.716  -9.404
  738   1HB   LYS 101          2HB       LYS 101 -11.378   5.066 -10.065
  739   2HB   LYS 101          1HB       LYS 101  -9.912   4.797  -9.127
  740   1HG   LYS 101          2HG       LYS 101  -9.584   4.423 -11.542
  741   2HG   LYS 101          1HG       LYS 101  -9.227   2.974 -10.597
  742   1HD   LYS 101          1HD       LYS 101 -10.412   2.506 -12.707
  743   2HD   LYS 101          2HD       LYS 101 -11.301   1.919 -11.307
  744   1HE   LYS 101          1HE       LYS 101 -12.818   3.897 -11.430
  745   2HE   LYS 101          2HE       LYS 101 -11.858   4.554 -12.769
  746   1HZ   LYS 101          1HZ       LYS 101 -12.473   2.637 -14.050
  747   2HZ   LYS 101          3HZ       LYS 101 -13.352   2.027 -12.794
  748   3HZ   LYS 101          2HZ       LYS 101 -13.812   3.435 -13.516
  749    H    LEU 102           HN       LEU 102 -10.114   3.796  -6.637
  750    HA   LEU 102           HA       LEU 102  -8.216   1.705  -6.615
  751   1HB   LEU 102          1HB       LEU 102  -7.935   3.556  -5.106
  752   2HB   LEU 102          2HB       LEU 102  -9.524   3.310  -4.397
  753    HG   LEU 102           HG       LEU 102  -8.782   1.141  -3.413
  754   1HD1  LEU 102          2HD22     LEU 102  -6.859   0.697  -4.940
  755   2HD1  LEU 102          1HD21     LEU 102  -6.022   2.113  -4.276
  756   3HD1  LEU 102          3HD23     LEU 102  -6.375   0.711  -3.239
  757   1HD2  LEU 102          2HD12     LEU 102  -8.913   3.296  -2.192
  758   2HD2  LEU 102          1HD11     LEU 102  -7.695   2.189  -1.567
  759   3HD2  LEU 102          3HD13     LEU 102  -7.202   3.585  -2.568
  760    H    LYS 103           HN       LYS 103 -11.448   1.842  -4.950
  761    HA   LYS 103           HA       LYS 103 -11.443  -0.782  -3.939
  762   1HB   LYS 103          1HB       LYS 103 -13.691   1.017  -4.941
  763   2HB   LYS 103          2HB       LYS 103 -13.964  -0.532  -4.144
  764   1HG   LYS 103          1HG       LYS 103 -12.917   0.209  -2.112
  765   2HG   LYS 103          2HG       LYS 103 -12.357   1.708  -2.864
  766   1HD   LYS 103          1HD       LYS 103 -14.687   2.448  -3.213
  767   2HD   LYS 103          2HD       LYS 103 -15.295   0.912  -2.575
  768   1HE   LYS 103          2HE       LYS 103 -15.462   2.682  -0.885
  769   2HE   LYS 103          1HE       LYS 103 -14.348   1.415  -0.357
  770   1HZ   LYS 103          3HZ       LYS 103 -13.575   3.982  -1.567
  771   2HZ   LYS 103          1HZ       LYS 103 -13.497   3.615   0.040
  772   3HZ   LYS 103          2HZ       LYS 103 -12.535   2.819  -1.034
  773    H    ALA 104           HN       ALA 104 -12.717   0.410  -7.097
  774    HA   ALA 104           HA       ALA 104 -13.571  -2.074  -8.103
  775   1HB   ALA 104          3HB       ALA 104 -14.070   0.123  -9.136
  776   2HB   ALA 104          1HB       ALA 104 -12.380   0.260  -9.667
  777   3HB   ALA 104          2HB       ALA 104 -13.410  -1.030 -10.314
  778    H    LEU 105           HN       LEU 105 -10.297  -0.557  -8.420
  779    HA   LEU 105           HA       LEU 105  -9.234  -2.701 -10.013
  780   1HB   LEU 105          2HB       LEU 105  -7.872  -0.619  -8.246
  781   2HB   LEU 105          1HB       LEU 105  -7.012  -1.781  -9.259
  782    HG   LEU 105           HG       LEU 105  -8.851   0.438 -10.242
  783   1HD1  LEU 105          3HD13     LEU 105  -6.559   1.082  -9.505
  784   2HD1  LEU 105          2HD12     LEU 105  -5.878  -0.101 -10.637
  785   3HD1  LEU 105          1HD11     LEU 105  -6.790   1.291 -11.253
  786   1HD2  LEU 105          1HD21     LEU 105  -7.554  -1.848 -11.752
  787   2HD2  LEU 105          3HD23     LEU 105  -9.260  -1.346 -11.775
  788   3HD2  LEU 105          2HD22     LEU 105  -8.035  -0.328 -12.534
  789    H    VAL 106           HN       VAL 106  -9.083  -2.066  -6.449
  790    HA   VAL 106           HA       VAL 106  -7.518  -4.343  -5.820
  791    HB   VAL 106           HB       VAL 106  -9.757  -2.989  -4.254
  792   1HG1  VAL 106          2HG22     VAL 106  -9.438  -5.344  -3.447
  793   2HG1  VAL 106          1HG21     VAL 106  -7.705  -5.033  -3.268
  794   3HG1  VAL 106          3HG23     VAL 106  -8.897  -4.148  -2.282
  795   1HG2  VAL 106          2HG12     VAL 106  -7.674  -1.631  -4.726
  796   2HG2  VAL 106          1HG11     VAL 106  -7.933  -1.961  -3.005
  797   3HG2  VAL 106          3HG13     VAL 106  -6.727  -2.889  -3.925
  798    H    ALA 107           HN       ALA 107 -11.060  -4.006  -5.945
  799    HA   ALA 107           HA       ALA 107 -11.745  -6.688  -5.461
  800   1HB   ALA 107          2HB       ALA 107 -13.394  -4.855  -5.565
  801   2HB   ALA 107          3HB       ALA 107 -13.153  -4.707  -7.317
  802   3HB   ALA 107          1HB       ALA 107 -13.862  -6.187  -6.640
  803    H    LYS 108           HN       LYS 108 -11.251  -5.167  -8.695
  804    HA   LYS 108           HA       LYS 108 -11.565  -7.461 -10.272
  805   1HB   LYS 108          2HB       LYS 108 -11.440  -5.210 -11.149
  806   2HB   LYS 108          1HB       LYS 108  -9.772  -5.016 -10.604
  807   1HG   LYS 108          2HG       LYS 108  -9.075  -6.861 -12.180
  808   2HG   LYS 108          1HG       LYS 108 -10.736  -6.901 -12.792
  809   1HD   LYS 108          2HD       LYS 108  -8.800  -4.529 -12.833
  810   2HD   LYS 108          1HD       LYS 108  -9.188  -5.579 -14.202
  811   1HE   LYS 108          1HE       LYS 108 -11.584  -4.823 -14.059
  812   2HE   LYS 108          2HE       LYS 108 -11.119  -3.685 -12.777
  813   1HZ   LYS 108          3HZ       LYS 108  -9.623  -2.649 -14.307
  814   2HZ   LYS 108          1HZ       LYS 108 -10.058  -3.691 -15.507
  815   3HZ   LYS 108          2HZ       LYS 108 -11.163  -2.636 -14.893
  816    H    HIS 109           HN       HIS 109  -8.438  -6.083  -9.187
  817    HA   HIS 109           HA       HIS 109  -6.896  -8.285 -10.211
  818   1HB   HIS 109          1HB       HIS 109  -6.230  -5.961  -8.370
  819   2HB   HIS 109          2HB       HIS 109  -5.048  -7.127  -8.975
  820    HD2  HIS 109           HD2      HIS 109  -7.249  -4.184 -10.443
  821    HE1  HIS 109           HE1      HIS 109  -4.416  -5.358 -13.318
  822    HE2  HIS 109           HE2      HIS 109  -6.160  -3.617 -12.750
  823    H    ALA 110           HN       ALA 110  -8.547  -7.843  -7.137
  824    HA   ALA 110           HA       ALA 110  -7.021  -9.947  -5.779
  825   1HB   ALA 110          1HB       ALA 110  -9.671  -8.627  -5.096
  826   2HB   ALA 110          3HB       ALA 110  -8.743  -9.728  -4.057
  827   3HB   ALA 110          2HB       ALA 110  -8.066  -8.147  -4.485
  828    H    ALA 111           HN       ALA 111 -10.123  -9.586  -7.559
  829    HA   ALA 111           HA       ALA 111 -11.055 -12.248  -6.999
  830   1HB   ALA 111          3HB       ALA 111 -12.575 -10.383  -7.530
  831   2HB   ALA 111          2HB       ALA 111 -11.862 -10.248  -9.155
  832   3HB   ALA 111          1HB       ALA 111 -12.764 -11.708  -8.695
  833    H    ALA 112           HN       ALA 112  -9.269 -10.786  -9.731
  834    HA   ALA 112           HA       ALA 112  -8.654 -13.520 -10.742
  835   1HB   ALA 112          3HB       ALA 112  -9.702 -11.198 -12.419
  836   2HB   ALA 112          2HB       ALA 112  -9.099 -12.750 -13.042
  837   3HB   ALA 112          1HB       ALA 112 -10.581 -12.704 -12.062
   
  No H/Q in entry =         837
  Start of MODEL   23
    1   1H    GLY   1          1HN       GLY   1  -1.133 -11.032   0.948
    2   2H    GLY   1          2HN       GLY   1  -0.276 -12.368   0.444
    3   3H    GLY   1          3HN       GLY   1  -1.778 -12.510   1.118
    4   1HA   GLY   1          1HA       GLY   1  -0.400 -13.125   2.849
    5   2HA   GLY   1          2HA       GLY   1   0.657 -11.735   2.519
    6    H    GLY   2           HN       GLY   2  -0.004 -11.673   5.042
    7   1HA   GLY   2          1HA       GLY   2  -2.523 -10.263   5.574
    8   2HA   GLY   2          2HA       GLY   2  -1.200 -10.591   6.701
    9    H    SER   3           HN       SER   3   0.511  -9.394   4.230
   10    HA   SER   3           HA       SER   3   1.346  -7.078   5.272
   11   1HB   SER   3          1HB       SER   3   1.152  -7.669   2.312
   12   2HB   SER   3          2HB       SER   3   2.490  -6.914   3.182
   13    HG   SER   3           HG       SER   3   3.081  -8.899   3.909
   14    H    VAL   4           HN       VAL   4  -0.077  -5.451   5.894
   15    HA   VAL   4           HA       VAL   4  -1.262  -3.792   3.747
   16    HB   VAL   4           HB       VAL   4  -2.975  -3.264   5.451
   17   1HG1  VAL   4          3HG13     VAL   4  -3.478  -5.017   3.706
   18   2HG1  VAL   4          2HG12     VAL   4  -2.905  -6.258   4.825
   19   3HG1  VAL   4          1HG11     VAL   4  -4.327  -5.303   5.238
   20   1HG2  VAL   4          3HG23     VAL   4  -1.831  -3.849   7.496
   21   2HG2  VAL   4          2HG22     VAL   4  -3.412  -4.632   7.354
   22   3HG2  VAL   4          1HG21     VAL   4  -1.937  -5.575   7.069
   23    H    ILE   5           HN       ILE   5   1.387  -3.810   4.931
   24    HA   ILE   5           HA       ILE   5   1.425  -1.885   7.128
   25    HB   ILE   5           HB       ILE   5   3.896  -2.363   7.078
   26   1HG1  ILE   5          2HG12     ILE   5   4.769  -4.218   5.849
   27   2HG1  ILE   5          1HG11     ILE   5   3.242  -4.550   5.045
   28   1HG2  ILE   5          3HG23     ILE   5   2.301  -3.591   8.497
   29   2HG2  ILE   5          2HG22     ILE   5   2.052  -4.783   7.204
   30   3HG2  ILE   5          1HG21     ILE   5   3.642  -4.617   7.969
   31   1HD1  ILE   5          3HD13     ILE   5   4.791  -1.951   4.642
   32   2HD1  ILE   5          1HD11     ILE   5   5.033  -3.396   3.660
   33   3HD1  ILE   5          2HD12     ILE   5   3.457  -2.605   3.657
   34    H    VAL   6           HN       VAL   6   3.135  -0.258   7.247
   35    HA   VAL   6           HA       VAL   6   3.405   1.359   4.810
   36    HB   VAL   6           HB       VAL   6   1.636   2.167   6.394
   37   1HG1  VAL   6          1HG21     VAL   6   2.539   1.349   8.528
   38   2HG1  VAL   6          3HG23     VAL   6   3.898   2.489   8.411
   39   3HG1  VAL   6          2HG22     VAL   6   2.239   3.088   8.591
   40   1HG2  VAL   6          1HG11     VAL   6   3.066   3.778   5.021
   41   2HG2  VAL   6          2HG12     VAL   6   2.172   4.437   6.407
   42   3HG2  VAL   6          3HG13     VAL   6   3.911   4.154   6.536
   43    H    ILE   7           HN       ILE   7   5.160  -0.616   6.269
   44    HA   ILE   7           HA       ILE   7   7.481   1.111   6.995
   45    HB   ILE   7           HB       ILE   7   7.148  -0.844   8.380
   46   1HG1  ILE   7          2HG12     ILE   7   9.660  -0.798   6.621
   47   2HG1  ILE   7          1HG11     ILE   7   9.338   0.097   8.102
   48   1HG2  ILE   7          2HG22     ILE   7   6.157  -2.370   6.603
   49   2HG2  ILE   7          3HG23     ILE   7   7.800  -2.665   6.021
   50   3HG2  ILE   7          1HG21     ILE   7   7.345  -3.099   7.670
   51   1HD1  ILE   7          2HD12     ILE   7   9.196  -2.037   9.380
   52   2HD1  ILE   7          1HD11     ILE   7   9.648  -2.926   7.907
   53   3HD1  ILE   7          3HD13     ILE   7  10.779  -1.767   8.619
   54    H    ASP   8           HN       ASP   8   7.169   2.135   4.964
   55    HA   ASP   8           HA       ASP   8   7.424   0.805   2.476
   56   1HB   ASP   8          2HB       ASP   8   7.441   2.921   1.533
   57   2HB   ASP   8          1HB       ASP   8   6.417   3.057   2.988
   58    H    SER   9           HN       SER   9   9.908   1.648   4.728
   59    HA   SER   9           HA       SER   9  12.115   2.323   3.442
   60   1HB   SER   9          1HB       SER   9  12.059  -0.072   5.290
   61   2HB   SER   9          2HB       SER   9  13.328   1.161   5.121
   62    HG   SER   9           HG       SER   9  11.699   2.695   5.876
   63    H    LYS  10           HN       LYS  10  12.981   1.678   1.511
   64    HA   LYS  10           HA       LYS  10  12.292  -0.190  -0.196
   65   1HB   LYS  10          2HB       LYS  10  14.506  -0.143  -1.150
   66   2HB   LYS  10          1HB       LYS  10  13.752   1.413  -0.715
   67   1HG   LYS  10          1HG       LYS  10  15.265   1.447   1.353
   68   2HG   LYS  10          2HG       LYS  10  16.067   0.001   0.715
   69   1HD   LYS  10          2HD       LYS  10  15.909   2.728  -0.648
   70   2HD   LYS  10          1HD       LYS  10  17.307   2.061   0.210
   71   1HE   LYS  10          2HE       LYS  10  17.351   0.149  -1.445
   72   2HE   LYS  10          1HE       LYS  10  16.071   0.966  -2.362
   73   1HZ   LYS  10          3HZ       LYS  10  17.524   2.831  -2.627
   74   2HZ   LYS  10          2HZ       LYS  10  18.722   2.069  -1.789
   75   3HZ   LYS  10          1HZ       LYS  10  18.209   1.459  -3.230
   76    H    ALA  11           HN       ALA  11  14.657  -0.919   2.330
   77    HA   ALA  11           HA       ALA  11  15.246  -3.622   1.536
   78   1HB   ALA  11          1HB       ALA  11  15.223  -2.409   4.342
   79   2HB   ALA  11          2HB       ALA  11  15.990  -3.942   3.875
   80   3HB   ALA  11          3HB       ALA  11  16.593  -2.413   3.208
   81    H    ALA  12           HN       ALA  12  12.769  -2.301   3.732
   82    HA   ALA  12           HA       ALA  12  11.620  -4.853   4.502
   83   1HB   ALA  12          2HB       ALA  12  11.488  -2.813   5.932
   84   2HB   ALA  12          1HB       ALA  12  10.471  -2.034   4.698
   85   3HB   ALA  12          3HB       ALA  12   9.897  -3.490   5.527
   86    H    TRP  13           HN       TRP  13  10.870  -2.247   2.178
   87    HA   TRP  13           HA       TRP  13   8.489  -3.133   1.004
   88   1HB   TRP  13          1HB       TRP  13   9.322  -1.018   0.227
   89   2HB   TRP  13          2HB       TRP  13  10.903  -1.650   0.166
   90    HD1  TRP  13           HD1      TRP  13  11.939  -2.491  -1.987
   91    HE1  TRP  13           HE1      TRP  13  11.232  -2.550  -4.433
   92    HE3  TRP  13           HE3      TRP  13   7.035  -1.143  -1.431
   93    HZ2  TRP  13           HZ2      TRP  13   8.917  -1.940  -5.969
   94    HZ3  TRP  13           HZ3      TRP  13   5.623  -0.804  -3.440
   95    HH2  TRP  13           HH2      TRP  13   6.565  -1.161  -5.714
   96    H    ASP  14           HN       ASP  14  11.827  -3.908  -0.151
   97    HA   ASP  14           HA       ASP  14  11.050  -5.858  -2.040
   98   1HB   ASP  14          2HB       ASP  14  13.629  -5.570  -0.423
   99   2HB   ASP  14          1HB       ASP  14  13.419  -6.726  -1.744
  100    H    ALA  15           HN       ALA  15  12.093  -6.299   1.336
  101    HA   ALA  15           HA       ALA  15  11.861  -9.102   1.436
  102   1HB   ALA  15          3HB       ALA  15  12.911  -7.715   3.206
  103   2HB   ALA  15          1HB       ALA  15  11.308  -7.107   3.675
  104   3HB   ALA  15          2HB       ALA  15  11.697  -8.826   3.871
  105    H    GLN  16           HN       GLN  16   9.348  -6.629   1.948
  106    HA   GLN  16           HA       GLN  16   7.328  -8.404   2.884
  107   1HB   GLN  16          1HB       GLN  16   7.434  -5.831   3.093
  108   2HB   GLN  16          2HB       GLN  16   6.867  -5.771   1.424
  109   1HG   GLN  16          2HG       GLN  16   4.951  -5.565   2.874
  110   2HG   GLN  16          1HG       GLN  16   4.870  -7.158   2.123
  111   1HE2  GLN  16          2HE22     GLN  16   5.994  -7.026   6.121
  112   2HE2  GLN  16          1HE21     GLN  16   6.612  -5.796   5.037
  113    H    LEU  17           HN       LEU  17   8.095  -7.039  -0.394
  114    HA   LEU  17           HA       LEU  17   5.964  -8.359  -1.745
  115   1HB   LEU  17          2HB       LEU  17   8.772  -7.646  -2.731
  116   2HB   LEU  17          1HB       LEU  17   7.402  -8.114  -3.733
  117    HG   LEU  17           HG       LEU  17   7.655  -5.570  -2.084
  118   1HD1  LEU  17          2HD22     LEU  17   8.889  -5.609  -4.217
  119   2HD1  LEU  17          1HD21     LEU  17   7.395  -6.053  -5.074
  120   3HD1  LEU  17          3HD23     LEU  17   7.526  -4.477  -4.267
  121   1HD2  LEU  17          2HD12     LEU  17   5.274  -6.653  -3.608
  122   2HD2  LEU  17          1HD11     LEU  17   5.343  -6.203  -1.888
  123   3HD2  LEU  17          3HD13     LEU  17   5.464  -4.949  -3.123
  124    H    ALA  18           HN       ALA  18   9.375  -9.392  -1.284
  125    HA   ALA  18           HA       ALA  18   9.180 -11.887  -2.523
  126   1HB   ALA  18          3HB       ALA  18  11.277 -10.838  -1.793
  127   2HB   ALA  18          1HB       ALA  18  10.840 -11.087  -0.090
  128   3HB   ALA  18          2HB       ALA  18  11.140 -12.487  -1.143
  129    H    LYS  19           HN       LYS  19   8.779 -11.308   1.074
  130    HA   LYS  19           HA       LYS  19   8.056 -14.048   1.534
  131   1HB   LYS  19          2HB       LYS  19   7.644 -13.352   3.774
  132   2HB   LYS  19          1HB       LYS  19   9.065 -12.469   3.192
  133   1HG   LYS  19          2HG       LYS  19   7.379 -10.585   2.621
  134   2HG   LYS  19          1HG       LYS  19   6.225 -11.452   3.588
  135   1HD   LYS  19          2HD       LYS  19   8.908 -10.289   4.471
  136   2HD   LYS  19          1HD       LYS  19   7.303  -9.720   4.946
  137   1HE   LYS  19          2HE       LYS  19   8.594 -12.375   5.740
  138   2HE   LYS  19          1HE       LYS  19   8.339 -10.967   6.775
  139   1HZ   LYS  19          1HZ       LYS  19   5.983 -11.245   6.480
  140   2HZ   LYS  19          3HZ       LYS  19   6.223 -12.572   5.532
  141   3HZ   LYS  19          2HZ       LYS  19   6.663 -12.604   7.120
  142    H    GLY  20           HN       GLY  20   6.262 -11.433   0.131
  143   1HA   GLY  20          1HA       GLY  20   3.653 -12.046   1.055
  144   2HA   GLY  20          2HA       GLY  20   4.115 -11.192  -0.434
  145    H    LYS  21           HN       LYS  21   5.790 -13.609  -1.294
  146    HA   LYS  21           HA       LYS  21   5.547 -15.366  -2.712
  147   1HB   LYS  21          2HB       LYS  21   3.242 -16.120  -0.852
  148   2HB   LYS  21          1HB       LYS  21   3.986 -17.166  -2.070
  149   1HG   LYS  21          1HG       LYS  21   6.178 -16.964  -0.943
  150   2HG   LYS  21          2HG       LYS  21   5.454 -15.907   0.282
  151   1HD   LYS  21          1HD       LYS  21   3.897 -17.730   0.940
  152   2HD   LYS  21          2HD       LYS  21   4.645 -18.799  -0.265
  153   1HE   LYS  21          2HE       LYS  21   6.837 -18.567   0.906
  154   2HE   LYS  21          1HE       LYS  21   6.080 -17.498   2.104
  155   1HZ   LYS  21          3HZ       LYS  21   4.659 -19.309   2.728
  156   2HZ   LYS  21          2HZ       LYS  21   5.361 -20.304   1.616
  157   3HZ   LYS  21          1HZ       LYS  21   6.242 -19.735   2.886
  158    H    GLU  22           HN       GLU  22   5.031 -13.686  -4.193
  159    HA   GLU  22           HA       GLU  22   2.414 -12.888  -4.965
  160   1HB   GLU  22          1HB       GLU  22   4.974 -12.720  -6.602
  161   2HB   GLU  22          2HB       GLU  22   3.542 -11.701  -6.690
  162   1HG   GLU  22          2HG       GLU  22   4.796 -10.282  -5.482
  163   2HG   GLU  22          1HG       GLU  22   4.235 -11.220  -4.091
  164    H    GLU  23           HN       GLU  23   2.113 -15.594  -5.019
  165    HA   GLU  23           HA       GLU  23   2.582 -16.801  -7.586
  166   1HB   GLU  23          2HB       GLU  23   0.277 -17.556  -5.730
  167   2HB   GLU  23          1HB       GLU  23   1.153 -18.556  -6.891
  168   1HG   GLU  23          2HG       GLU  23   2.090 -17.539  -4.184
  169   2HG   GLU  23          1HG       GLU  23   1.913 -19.199  -4.732
  170    H    HIS  24           HN       HIS  24  -0.456 -15.534  -6.209
  171    HA   HIS  24           HA       HIS  24  -1.136 -14.057  -8.600
  172   1HB   HIS  24          1HB       HIS  24  -2.161 -16.075  -9.406
  173   2HB   HIS  24          2HB       HIS  24  -2.829 -16.453  -7.810
  174    HD2  HIS  24           HD2      HIS  24  -3.271 -12.824  -9.277
  175    HE1  HIS  24           HE1      HIS  24  -7.061 -14.658  -8.929
  176    HE2  HIS  24           HE2      HIS  24  -5.869 -12.436  -9.291
  177    H    LYS  25           HN       LYS  25  -1.044 -12.292  -7.218
  178    HA   LYS  25           HA       LYS  25  -3.369 -11.805  -5.635
  179   1HB   LYS  25          1HB       LYS  25  -2.016 -11.314  -3.540
  180   2HB   LYS  25          2HB       LYS  25  -2.333 -13.013  -3.903
  181   1HG   LYS  25          1HG       LYS  25   0.010 -13.155  -4.902
  182   2HG   LYS  25          2HG       LYS  25   0.271 -11.489  -4.373
  183   1HD   LYS  25          1HD       LYS  25   1.237 -13.017  -2.785
  184   2HD   LYS  25          2HD       LYS  25  -0.124 -12.210  -2.014
  185   1HE   LYS  25          2HE       LYS  25  -1.519 -14.210  -2.199
  186   2HE   LYS  25          1HE       LYS  25  -0.390 -14.940  -3.359
  187   1HZ   LYS  25          3HZ       LYS  25   1.229 -15.072  -1.657
  188   2HZ   LYS  25          1HZ       LYS  25   0.206 -14.437  -0.539
  189   3HZ   LYS  25          2HZ       LYS  25  -0.136 -15.898  -1.230
  190    HA   PRO  26           HA       PRO  26  -1.755  -7.981  -7.211
  191   1HB   PRO  26          2HB       PRO  26  -3.511  -6.167  -6.188
  192   2HB   PRO  26          1HB       PRO  26  -3.942  -7.339  -7.455
  193   1HG   PRO  26          1HG       PRO  26  -4.406  -7.569  -4.473
  194   2HG   PRO  26          2HG       PRO  26  -5.591  -7.834  -5.787
  195   1HD   PRO  26          2HD       PRO  26  -4.242  -9.928  -4.635
  196   2HD   PRO  26          1HD       PRO  26  -4.596  -9.902  -6.387
  197    H    ILE  27           HN       ILE  27   0.009  -6.978  -6.628
  198    HA   ILE  27           HA       ILE  27   0.582  -6.310  -3.826
  199    HB   ILE  27           HB       ILE  27   2.186  -6.243  -6.408
  200   1HG1  ILE  27          2HG12     ILE  27   3.712  -7.724  -5.307
  201   2HG1  ILE  27          1HG11     ILE  27   2.886  -7.566  -3.756
  202   1HG2  ILE  27          1HG21     ILE  27   3.011  -5.114  -3.704
  203   2HG2  ILE  27          3HG23     ILE  27   4.077  -5.337  -5.116
  204   3HG2  ILE  27          2HG22     ILE  27   2.772  -4.170  -5.186
  205   1HD1  ILE  27          3HD13     ILE  27   1.636  -8.818  -6.233
  206   2HD1  ILE  27          1HD11     ILE  27   2.473  -9.732  -4.966
  207   3HD1  ILE  27          2HD12     ILE  27   0.995  -8.861  -4.569
  208    H    VAL  28           HN       VAL  28  -0.805  -4.651  -3.369
  209    HA   VAL  28           HA       VAL  28  -1.355  -2.541  -5.406
  210    HB   VAL  28           HB       VAL  28  -2.739  -2.961  -2.731
  211   1HG1  VAL  28          3HG13     VAL  28  -2.958  -0.720  -3.818
  212   2HG1  VAL  28          2HG12     VAL  28  -3.542  -1.505  -5.293
  213   3HG1  VAL  28          1HG11     VAL  28  -4.496  -1.609  -3.803
  214   1HG2  VAL  28          2HG22     VAL  28  -3.082  -5.009  -4.070
  215   2HG2  VAL  28          3HG23     VAL  28  -4.546  -4.049  -3.931
  216   3HG2  VAL  28          1HG21     VAL  28  -3.618  -4.000  -5.442
  217    H    VAL  29           HN       VAL  29   0.118  -0.842  -5.225
  218    HA   VAL  29           HA       VAL  29   0.899  -0.110  -2.417
  219    HB   VAL  29           HB       VAL  29   2.840  -0.982  -3.208
  220   1HG1  VAL  29          1HG11     VAL  29   2.507   0.587  -5.745
  221   2HG1  VAL  29          3HG13     VAL  29   3.964  -0.330  -5.270
  222   3HG1  VAL  29          2HG12     VAL  29   2.444  -1.191  -5.572
  223   1HG2  VAL  29          2HG22     VAL  29   2.939   1.249  -2.092
  224   2HG2  VAL  29          1HG21     VAL  29   4.311   0.962  -3.176
  225   3HG2  VAL  29          3HG23     VAL  29   3.004   2.030  -3.679
  226    H    ASP  30           HN       ASP  30   0.490   1.733  -1.746
  227    HA   ASP  30           HA       ASP  30  -0.773   3.851  -3.380
  228   1HB   ASP  30          1HB       ASP  30  -1.858   3.014  -1.303
  229   2HB   ASP  30          2HB       ASP  30  -0.432   3.408  -0.375
  230    H    PHE  31           HN       PHE  31   1.022   4.856  -4.423
  231    HA   PHE  31           HA       PHE  31   3.391   5.572  -2.756
  232   1HB   PHE  31          1HB       PHE  31   2.772   5.885  -5.709
  233   2HB   PHE  31          2HB       PHE  31   4.166   6.552  -4.896
  234    HD1  PHE  31           HD1      PHE  31   5.837   5.073  -3.761
  235    HD2  PHE  31           HD2      PHE  31   2.827   3.574  -6.461
  236    HE1  PHE  31           HE1      PHE  31   7.230   3.073  -4.204
  237    HE2  PHE  31           HE2      PHE  31   4.273   1.614  -6.953
  238    HZ   PHE  31           HZ       PHE  31   6.452   1.349  -5.823
  239    H    THR  32           HN       THR  32   2.784   7.194  -1.387
  240    HA   THR  32           HA       THR  32   1.734   9.661  -2.605
  241    HB   THR  32           HB       THR  32  -0.168   8.530  -1.487
  242    HG1  THR  32           HG1      THR  32  -0.743  10.268  -0.256
  243   1HG2  THR  32          3HG23     THR  32   1.079   7.161   0.172
  244   2HG2  THR  32          1HG21     THR  32   1.518   8.633   1.066
  245   3HG2  THR  32          2HG22     THR  32  -0.181   8.129   0.938
  246    H    ALA  33           HN       ALA  33   1.919  11.168  -0.115
  247    HA   ALA  33           HA       ALA  33   4.715  10.763   0.741
  248   1HB   ALA  33          1HB       ALA  33   3.972  13.085  -1.091
  249   2HB   ALA  33          3HB       ALA  33   5.477  12.981  -0.169
  250   3HB   ALA  33          2HB       ALA  33   5.137  11.795  -1.434
  251    H    THR  34           HN       THR  34   4.609  11.149   2.833
  252    HA   THR  34           HA       THR  34   3.010  12.606   4.470
  253    HB   THR  34           HB       THR  34   6.053  12.362   4.414
  254    HG1  THR  34           HG1      THR  34   4.757  10.467   4.707
  255   1HG2  THR  34          1HG21     THR  34   4.326  13.416   6.676
  256   2HG2  THR  34          2HG22     THR  34   6.013  12.862   6.830
  257   3HG2  THR  34          3HG23     THR  34   5.644  14.276   5.831
  258    H    TRP  35           HN       TRP  35   5.716  13.994   2.622
  259    HA   TRP  35           HA       TRP  35   5.751  16.587   3.223
  260   1HB   TRP  35          1HB       TRP  35   6.664  15.033   1.120
  261   2HB   TRP  35          2HB       TRP  35   5.584  16.110   0.272
  262    HD1  TRP  35           HD1      TRP  35   8.822  15.930   2.155
  263    HE1  TRP  35           HE1      TRP  35  10.130  18.185   1.929
  264    HE3  TRP  35           HE3      TRP  35   5.160  18.795   0.050
  265    HZ2  TRP  35           HZ2      TRP  35   9.593  20.849   1.012
  266    HZ3  TRP  35           HZ3      TRP  35   5.531  21.187  -0.402
  267    HH2  TRP  35           HH2      TRP  35   7.756  22.227   0.043
  268    H    CYS  36           HN       CYS  36   3.192  15.200   1.070
  269    HA   CYS  36           HA       CYS  36   1.938  17.918   0.929
  270   1HB   CYS  36          1HB       CYS  36   0.599  16.976  -0.924
  271   2HB   CYS  36          2HB       CYS  36   2.316  17.166  -1.201
  272    H    GLY  37           HN       GLY  37   1.852  16.262   3.331
  273   1HA   GLY  37          1HA       GLY  37   0.387  15.374   4.851
  274   2HA   GLY  37          2HA       GLY  37  -0.278  16.990   4.614
  275    HA   PRO  38           HA       PRO  38  -4.293  15.313   3.662
  276   1HB   PRO  38          1HB       PRO  38  -4.016  16.934   1.109
  277   2HB   PRO  38          2HB       PRO  38  -5.478  16.708   2.118
  278   1HG   PRO  38          2HG       PRO  38  -3.991  18.941   2.447
  279   2HG   PRO  38          1HG       PRO  38  -4.520  18.030   3.892
  280   1HD   PRO  38          2HD       PRO  38  -1.808  18.036   2.579
  281   2HD   PRO  38          1HD       PRO  38  -2.238  18.011   4.312
  282    H    CYS  39           HN       CYS  39  -1.954  15.297   0.975
  283    HA   CYS  39           HA       CYS  39  -3.190  13.232  -0.573
  284   1HB   CYS  39          2HB       CYS  39  -1.170  13.143  -1.784
  285   2HB   CYS  39          1HB       CYS  39  -1.317  14.828  -1.275
  286    H    LYS  40           HN       LYS  40  -1.010  13.157   2.257
  287    HA   LYS  40           HA       LYS  40  -0.535  10.276   2.084
  288   1HB   LYS  40          1HB       LYS  40   1.145  11.879   2.909
  289   2HB   LYS  40          2HB       LYS  40   0.130  12.273   4.294
  290   1HG   LYS  40          1HG       LYS  40   0.830   9.377   3.753
  291   2HG   LYS  40          2HG       LYS  40   2.105  10.410   4.362
  292   1HD   LYS  40          1HD       LYS  40  -0.592  10.132   5.768
  293   2HD   LYS  40          2HD       LYS  40   0.787   9.092   6.100
  294   1HE   LYS  40          1HE       LYS  40   0.885  12.135   6.392
  295   2HE   LYS  40          2HE       LYS  40   0.495  11.010   7.696
  296   1HZ   LYS  40          2HZ       LYS  40   2.620   9.983   7.397
  297   2HZ   LYS  40          1HZ       LYS  40   3.027  11.040   6.205
  298   3HZ   LYS  40          3HZ       LYS  40   2.778  11.586   7.735
  299    H    MET  41           HN       MET  41  -2.740  12.524   3.681
  300    HA   MET  41           HA       MET  41  -3.852  10.641   5.583
  301   1HB   MET  41          1HB       MET  41  -5.072  13.134   4.310
  302   2HB   MET  41          2HB       MET  41  -5.745  12.259   5.686
  303   1HG   MET  41          2HG       MET  41  -3.811  12.732   7.055
  304   2HG   MET  41          1HG       MET  41  -2.970  13.496   5.705
  305   1HE   MET  41          2HE       MET  41  -3.120  14.862   8.478
  306   2HE   MET  41          3HE       MET  41  -2.362  15.604   7.044
  307   3HE   MET  41          1HE       MET  41  -3.533  16.529   8.014
  308    H    ILE  42           HN       ILE  42  -4.009  10.446   2.198
  309    HA   ILE  42           HA       ILE  42  -6.602   9.081   2.165
  310    HB   ILE  42           HB       ILE  42  -4.321   9.394   0.189
  311   1HG1  ILE  42          1HG11     ILE  42  -7.223  10.356   0.083
  312   2HG1  ILE  42          2HG12     ILE  42  -5.964  11.314   0.862
  313   1HG2  ILE  42          1HG21     ILE  42  -6.936   7.853  -0.090
  314   2HG2  ILE  42          3HG23     ILE  42  -5.914   8.331  -1.461
  315   3HG2  ILE  42          2HG22     ILE  42  -5.283   7.218  -0.250
  316   1HD1  ILE  42          2HD12     ILE  42  -4.676  11.413  -1.217
  317   2HD1  ILE  42          1HD11     ILE  42  -5.980  10.546  -2.064
  318   3HD1  ILE  42          3HD13     ILE  42  -6.285  12.140  -1.358
  319    H    ALA  43           HN       ALA  43  -3.273   8.268   2.980
  320    HA   ALA  43           HA       ALA  43  -3.220   5.509   2.591
  321   1HB   ALA  43          1HB       ALA  43  -1.284   6.817   3.289
  322   2HB   ALA  43          2HB       ALA  43  -1.998   7.101   4.888
  323   3HB   ALA  43          3HB       ALA  43  -1.557   5.461   4.394
  324    HA   PRO  44           HA       PRO  44  -5.347   4.674   6.841
  325   1HB   PRO  44          2HB       PRO  44  -7.028   6.612   7.883
  326   2HB   PRO  44          1HB       PRO  44  -5.327   6.372   8.370
  327   1HG   PRO  44          1HG       PRO  44  -6.407   8.285   6.298
  328   2HG   PRO  44          2HG       PRO  44  -5.286   8.666   7.641
  329   1HD   PRO  44          2HD       PRO  44  -4.226   8.224   5.238
  330   2HD   PRO  44          1HD       PRO  44  -3.518   7.383   6.628
  331    H    LEU  45           HN       LEU  45  -6.852   6.698   4.336
  332    HA   LEU  45           HA       LEU  45  -9.455   5.352   4.565
  333   1HB   LEU  45          1HB       LEU  45  -8.182   7.144   2.477
  334   2HB   LEU  45          2HB       LEU  45  -9.615   6.222   2.088
  335    HG   LEU  45           HG       LEU  45 -10.004   8.566   2.797
  336   1HD1  LEU  45          1HD21     LEU  45 -11.795   6.856   2.834
  337   2HD1  LEU  45          2HD22     LEU  45 -11.401   6.475   4.524
  338   3HD1  LEU  45          3HD23     LEU  45 -12.005   8.082   4.094
  339   1HD2  LEU  45          2HD12     LEU  45  -8.354   8.674   4.629
  340   2HD2  LEU  45          1HD11     LEU  45  -9.977   9.194   5.119
  341   3HD2  LEU  45          3HD13     LEU  45  -9.382   7.597   5.608
  342    H    PHE  46           HN       PHE  46  -6.594   4.981   2.457
  343    HA   PHE  46           HA       PHE  46  -7.414   2.672   1.021
  344   1HB   PHE  46          1HB       PHE  46  -5.527   3.988   0.340
  345   2HB   PHE  46          2HB       PHE  46  -4.704   3.743   1.865
  346    HD1  PHE  46           HD2      PHE  46  -6.071   1.655  -0.975
  347    HD2  PHE  46           HD1      PHE  46  -2.986   2.179   1.975
  348    HE1  PHE  46           HE2      PHE  46  -4.566   0.191  -2.285
  349    HE2  PHE  46           HE1      PHE  46  -1.490   0.664   0.676
  350    HZ   PHE  46           HZ       PHE  46  -2.222  -0.241  -1.487
  351    H    GLU  47           HN       GLU  47  -5.927   3.003   4.247
  352    HA   GLU  47           HA       GLU  47  -5.320   0.393   4.865
  353   1HB   GLU  47          1HB       GLU  47  -5.054   2.452   6.338
  354   2HB   GLU  47          2HB       GLU  47  -6.757   2.230   6.793
  355   1HG   GLU  47          2HG       GLU  47  -5.451   1.267   8.510
  356   2HG   GLU  47          1HG       GLU  47  -6.221  -0.059   7.645
  357    H    THR  48           HN       THR  48  -8.591   1.850   4.646
  358    HA   THR  48           HA       THR  48 -10.045  -0.226   5.885
  359    HB   THR  48           HB       THR  48 -11.012   1.328   3.448
  360    HG1  THR  48           HG1      THR  48 -10.208   2.902   4.670
  361   1HG2  THR  48          1HG21     THR  48 -12.543  -0.388   4.416
  362   2HG2  THR  48          3HG23     THR  48 -12.391   0.392   6.007
  363   3HG2  THR  48          2HG22     THR  48 -13.155   1.259   4.661
  364    H    LEU  49           HN       LEU  49  -9.139   0.194   2.404
  365    HA   LEU  49           HA       LEU  49 -10.336  -2.299   1.563
  366   1HB   LEU  49          2HB       LEU  49  -8.258  -0.479   0.303
  367   2HB   LEU  49          1HB       LEU  49  -8.816  -1.989  -0.425
  368    HG   LEU  49           HG       LEU  49 -11.102  -1.175  -0.525
  369   1HD1  LEU  49          2HD22     LEU  49  -9.942   1.387   0.634
  370   2HD1  LEU  49          3HD23     LEU  49 -11.485   1.330  -0.246
  371   3HD1  LEU  49          1HD21     LEU  49 -11.312   0.426   1.257
  372   1HD2  LEU  49          1HD11     LEU  49  -9.008   0.681  -1.737
  373   2HD2  LEU  49          3HD13     LEU  49  -9.564  -0.860  -2.425
  374   3HD2  LEU  49          2HD12     LEU  49 -10.673   0.519  -2.319
  375    H    SER  50           HN       SER  50  -7.102  -1.240   2.547
  376    HA   SER  50           HA       SER  50  -5.573  -3.603   2.187
  377   1HB   SER  50          1HB       SER  50  -5.285  -1.927   4.678
  378   2HB   SER  50          2HB       SER  50  -4.081  -2.775   3.711
  379    HG   SER  50           HG       SER  50  -5.482  -0.505   2.766
  380    H    ASN  51           HN       ASN  51  -7.499  -2.710   5.082
  381    HA   ASN  51           HA       ASN  51  -7.227  -5.168   6.479
  382   1HB   ASN  51          2HB       ASN  51  -8.090  -3.328   7.676
  383   2HB   ASN  51          1HB       ASN  51  -9.294  -2.933   6.458
  384   1HD2  ASN  51          1HD21     ASN  51 -11.755  -5.170   7.706
  385   2HD2  ASN  51          2HD22     ASN  51 -11.345  -4.159   6.338
  386    H    ASP  52           HN       ASP  52  -9.898  -4.009   4.393
  387    HA   ASP  52           HA       ASP  52 -11.566  -6.204   4.506
  388   1HB   ASP  52          2HB       ASP  52 -11.014  -4.432   2.079
  389   2HB   ASP  52          1HB       ASP  52 -12.450  -5.434   2.328
  390    H    TYR  53           HN       TYR  53  -8.846  -5.757   2.231
  391    HA   TYR  53           HA       TYR  53  -9.347  -8.433   1.040
  392   1HB   TYR  53          1HB       TYR  53  -7.636  -6.019   0.356
  393   2HB   TYR  53          2HB       TYR  53  -7.449  -7.576  -0.429
  394    HD1  TYR  53           HD1      TYR  53  -9.813  -4.731  -0.055
  395    HD2  TYR  53           HD2      TYR  53  -8.980  -8.493  -1.984
  396    HE1  TYR  53           HE1      TYR  53 -11.668  -4.335  -1.622
  397    HE2  TYR  53           HE2      TYR  53 -10.757  -8.035  -3.623
  398    HH   TYR  53           HH       TYR  53 -12.630  -6.764  -4.086
  399    H    ALA  54           HN       ALA  54  -7.616  -7.430   3.767
  400    HA   ALA  54           HA       ALA  54  -5.043  -8.419   3.442
  401   1HB   ALA  54          2HB       ALA  54  -5.858  -7.224   5.455
  402   2HB   ALA  54          1HB       ALA  54  -6.829  -8.642   5.905
  403   3HB   ALA  54          3HB       ALA  54  -5.056  -8.743   5.887
  404    H    GLY  55           HN       GLY  55  -4.056 -10.429   3.388
  405   1HA   GLY  55          1HA       GLY  55  -4.170 -12.761   4.259
  406   2HA   GLY  55          2HA       GLY  55  -5.801 -12.866   3.571
  407    H    LYS  56           HN       LYS  56  -5.889 -12.054   1.158
  408    HA   LYS  56           HA       LYS  56  -4.000 -13.770  -0.299
  409   1HB   LYS  56          1HB       LYS  56  -6.355 -13.785  -0.848
  410   2HB   LYS  56          2HB       LYS  56  -6.332 -12.057  -1.260
  411   1HG   LYS  56          1HG       LYS  56  -4.768 -12.523  -3.131
  412   2HG   LYS  56          2HG       LYS  56  -4.677 -14.226  -2.641
  413   1HD   LYS  56          2HD       LYS  56  -7.124 -14.455  -3.060
  414   2HD   LYS  56          1HD       LYS  56  -7.183 -12.768  -3.608
  415   1HE   LYS  56          2HE       LYS  56  -5.573 -13.296  -5.429
  416   2HE   LYS  56          1HE       LYS  56  -5.467 -14.972  -4.863
  417   1HZ   LYS  56          2HZ       LYS  56  -7.806 -15.197  -5.315
  418   2HZ   LYS  56          3HZ       LYS  56  -7.884 -13.643  -5.864
  419   3HZ   LYS  56          1HZ       LYS  56  -6.972 -14.764  -6.667
  420    H    VAL  57           HN       VAL  57  -4.870 -10.296  -0.303
  421    HA   VAL  57           HA       VAL  57  -3.019  -9.588  -2.412
  422    HB   VAL  57           HB       VAL  57  -3.876  -7.366  -2.003
  423   1HG1  VAL  57          3HG23     VAL  57  -5.440  -9.153  -2.956
  424   2HG1  VAL  57          1HG21     VAL  57  -6.208  -9.218  -1.371
  425   3HG1  VAL  57          2HG22     VAL  57  -6.202  -7.707  -2.303
  426   1HG2  VAL  57          2HG12     VAL  57  -4.696  -8.476   0.724
  427   2HG2  VAL  57          1HG11     VAL  57  -3.623  -7.134   0.402
  428   3HG2  VAL  57          3HG13     VAL  57  -5.344  -6.967   0.080
  429    H    ILE  58           HN       ILE  58  -1.549  -7.654  -2.160
  430    HA   ILE  58           HA       ILE  58  -0.111  -7.607   0.468
  431    HB   ILE  58           HB       ILE  58   1.099  -7.689  -2.324
  432   1HG1  ILE  58          1HG11     ILE  58   0.459  -9.913  -1.528
  433   2HG1  ILE  58          2HG12     ILE  58   2.188  -9.707  -1.745
  434   1HG2  ILE  58          1HG21     ILE  58   2.419  -7.219   0.386
  435   2HG2  ILE  58          2HG22     ILE  58   3.298  -7.616  -1.103
  436   3HG2  ILE  58          3HG23     ILE  58   2.379  -6.113  -0.995
  437   1HD1  ILE  58          3HD13     ILE  58   0.795  -9.614   0.965
  438   2HD1  ILE  58          2HD12     ILE  58   1.647 -10.999   0.270
  439   3HD1  ILE  58          1HD11     ILE  58   2.544  -9.527   0.667
  440    H    PHE  59           HN       PHE  59  -1.046  -5.701   1.173
  441    HA   PHE  59           HA       PHE  59  -1.165  -3.438  -0.754
  442   1HB   PHE  59          1HB       PHE  59  -2.610  -4.037   1.794
  443   2HB   PHE  59          2HB       PHE  59  -2.309  -2.367   1.347
  444    HD1  PHE  59           HD2      PHE  59  -3.290  -5.295  -0.862
  445    HD2  PHE  59           HD1      PHE  59  -4.258  -1.366   0.576
  446    HE1  PHE  59           HE2      PHE  59  -5.586  -5.502  -1.800
  447    HE2  PHE  59           HE1      PHE  59  -6.462  -1.520  -0.476
  448    HZ   PHE  59           HZ       PHE  59  -7.279  -3.741  -1.320
  449    H    LEU  60           HN       LEU  60   0.075  -1.698  -0.551
  450    HA   LEU  60           HA       LEU  60   2.001  -1.540   1.733
  451   1HB   LEU  60          1HB       LEU  60   2.407  -2.287  -1.067
  452   2HB   LEU  60          2HB       LEU  60   3.260  -0.785  -0.751
  453    HG   LEU  60           HG       LEU  60   3.493  -3.097   1.186
  454   1HD1  LEU  60          1HD11     LEU  60   5.101  -2.810  -1.380
  455   2HD1  LEU  60          2HD12     LEU  60   5.483  -3.906  -0.035
  456   3HD1  LEU  60          3HD13     LEU  60   3.988  -4.128  -0.954
  457   1HD2  LEU  60          3HD23     LEU  60   4.416  -0.811   1.730
  458   2HD2  LEU  60          2HD22     LEU  60   5.728  -2.000   1.538
  459   3HD2  LEU  60          1HD21     LEU  60   5.364  -0.854   0.234
  460    H    LYS  61           HN       LYS  61   2.080   0.443   2.645
  461    HA   LYS  61           HA       LYS  61   1.124   2.808   1.050
  462   1HB   LYS  61          1HB       LYS  61   1.436   2.248   4.000
  463   2HB   LYS  61          2HB       LYS  61   1.213   3.886   3.361
  464   1HG   LYS  61          2HG       LYS  61  -0.908   3.404   2.464
  465   2HG   LYS  61          1HG       LYS  61  -0.686   1.653   2.600
  466   1HD   LYS  61          2HD       LYS  61  -0.662   3.361   5.095
  467   2HD   LYS  61          1HD       LYS  61  -2.209   2.905   4.364
  468   1HE   LYS  61          1HE       LYS  61  -0.071   0.849   5.080
  469   2HE   LYS  61          2HE       LYS  61  -1.339   1.360   6.192
  470   1HZ   LYS  61          3HZ       LYS  61  -2.965   0.609   4.613
  471   2HZ   LYS  61          1HZ       LYS  61  -1.787   0.130   3.563
  472   3HZ   LYS  61          2HZ       LYS  61  -1.928  -0.601   5.033
  473    H    VAL  62           HN       VAL  62   2.718   4.009   0.076
  474    HA   VAL  62           HA       VAL  62   5.440   3.904   1.284
  475    HB   VAL  62           HB       VAL  62   4.664   3.785  -1.648
  476   1HG1  VAL  62          1HG11     VAL  62   7.389   4.156  -0.312
  477   2HG1  VAL  62          2HG12     VAL  62   7.183   3.625  -1.979
  478   3HG1  VAL  62          3HG13     VAL  62   6.617   5.226  -1.491
  479   1HG2  VAL  62          3HG23     VAL  62   6.170   1.810   0.129
  480   2HG2  VAL  62          2HG22     VAL  62   4.529   1.608  -0.484
  481   3HG2  VAL  62          1HG21     VAL  62   5.895   1.649  -1.608
  482    H    ASP  63           HN       ASP  63   6.527   5.708   1.574
  483    HA   ASP  63           HA       ASP  63   5.208   8.291   0.911
  484   1HB   ASP  63          1HB       ASP  63   7.119   7.388   3.084
  485   2HB   ASP  63          2HB       ASP  63   6.976   9.089   2.640
  486    H    VAL  64           HN       VAL  64   5.794   8.535  -1.124
  487    HA   VAL  64           HA       VAL  64   8.096   7.957  -2.567
  488    HB   VAL  64           HB       VAL  64   6.052  10.216  -2.718
  489   1HG1  VAL  64          2HG22     VAL  64   8.098   9.472  -4.820
  490   2HG1  VAL  64          3HG23     VAL  64   6.668  10.492  -5.089
  491   3HG1  VAL  64          1HG21     VAL  64   7.928  11.031  -3.982
  492   1HG2  VAL  64          1HG11     VAL  64   5.178   7.870  -2.975
  493   2HG2  VAL  64          2HG12     VAL  64   4.998   8.845  -4.433
  494   3HG2  VAL  64          3HG13     VAL  64   6.308   7.641  -4.308
  495    H    ASP  65           HN       ASP  65   7.423  10.758  -0.456
  496    HA   ASP  65           HA       ASP  65   9.753  12.294  -1.185
  497   1HB   ASP  65          2HB       ASP  65   9.231  13.554   0.874
  498   2HB   ASP  65          1HB       ASP  65   7.879  13.417  -0.250
  499    H    ALA  66           HN       ALA  66   9.291   9.462   0.821
  500    HA   ALA  66           HA       ALA  66  11.954   9.837   2.114
  501   1HB   ALA  66          2HB       ALA  66   9.727   7.822   2.666
  502   2HB   ALA  66          1HB       ALA  66  11.284   7.937   3.506
  503   3HB   ALA  66          3HB       ALA  66  10.113   9.264   3.620
  504    H    VAL  67           HN       VAL  67  10.115   7.062   0.670
  505    HA   VAL  67           HA       VAL  67  12.717   5.935  -0.284
  506    HB   VAL  67           HB       VAL  67   9.959   4.689  -0.163
  507   1HG1  VAL  67          3HG23     VAL  67  12.735   3.530  -0.747
  508   2HG1  VAL  67          1HG21     VAL  67  11.262   2.570  -0.484
  509   3HG1  VAL  67          2HG22     VAL  67  11.395   3.611  -1.894
  510   1HG2  VAL  67          1HG11     VAL  67  12.485   4.335   1.554
  511   2HG2  VAL  67          2HG12     VAL  67  10.985   5.108   2.106
  512   3HG2  VAL  67          3HG13     VAL  67  11.002   3.397   1.694
  513    H    ALA  68           HN       ALA  68  12.655   8.047  -1.518
  514    HA   ALA  68           HA       ALA  68  11.201   8.300  -3.940
  515   1HB   ALA  68          2HB       ALA  68  12.572  10.101  -2.961
  516   2HB   ALA  68          1HB       ALA  68  14.054   9.171  -3.287
  517   3HB   ALA  68          3HB       ALA  68  13.063   9.769  -4.635
  518    H    ALA  69           HN       ALA  69  14.137   6.518  -3.122
  519    HA   ALA  69           HA       ALA  69  15.197   5.720  -5.523
  520   1HB   ALA  69          2HB       ALA  69  16.141   5.167  -3.313
  521   2HB   ALA  69          3HB       ALA  69  14.814   4.019  -3.017
  522   3HB   ALA  69          1HB       ALA  69  15.985   3.713  -4.318
  523    H    VAL  70           HN       VAL  70  12.322   4.271  -3.917
  524    HA   VAL  70           HA       VAL  70  12.042   2.223  -6.017
  525    HB   VAL  70           HB       VAL  70  10.251   3.113  -3.715
  526   1HG1  VAL  70          3HG13     VAL  70   9.892   0.781  -5.670
  527   2HG1  VAL  70          1HG11     VAL  70   8.893   1.103  -4.236
  528   3HG1  VAL  70          2HG12     VAL  70   8.861   2.216  -5.609
  529   1HG2  VAL  70          2HG22     VAL  70  12.333   1.825  -3.106
  530   2HG2  VAL  70          1HG21     VAL  70  10.836   0.934  -2.761
  531   3HG2  VAL  70          3HG23     VAL  70  11.804   0.526  -4.192
  532    H    ALA  71           HN       ALA  71  10.233   5.103  -4.919
  533    HA   ALA  71           HA       ALA  71   8.223   5.243  -6.762
  534   1HB   ALA  71          3HB       ALA  71   8.527   6.769  -4.843
  535   2HB   ALA  71          2HB       ALA  71   9.819   7.616  -5.720
  536   3HB   ALA  71          1HB       ALA  71   8.163   7.643  -6.348
  537    H    GLU  72           HN       GLU  72  11.469   6.744  -7.275
  538    HA   GLU  72           HA       GLU  72  10.875   7.865  -9.802
  539   1HB   GLU  72          2HB       GLU  72  13.274   8.084 -10.084
  540   2HB   GLU  72          1HB       GLU  72  12.809   8.472  -8.423
  541   1HG   GLU  72          2HG       GLU  72  13.507   6.090  -7.797
  542   2HG   GLU  72          1HG       GLU  72  14.182   5.936  -9.421
  543    H    ALA  73           HN       ALA  73  11.792   4.522  -8.985
  544    HA   ALA  73           HA       ALA  73  12.248   3.803 -11.814
  545   1HB   ALA  73          1HB       ALA  73  13.598   2.766 -10.026
  546   2HB   ALA  73          2HB       ALA  73  12.126   2.105  -9.283
  547   3HB   ALA  73          3HB       ALA  73  12.627   1.562 -10.897
  548    H    ALA  74           HN       ALA  74   9.846   3.360  -9.230
  549    HA   ALA  74           HA       ALA  74   8.089   1.587 -10.545
  550   1HB   ALA  74          2HB       ALA  74   8.085   2.056  -8.121
  551   2HB   ALA  74          1HB       ALA  74   7.507   3.705  -8.432
  552   3HB   ALA  74          3HB       ALA  74   6.479   2.315  -8.816
  553    H    GLY  75           HN       GLY  75   8.084   5.146 -10.448
  554   1HA   GLY  75          1HA       GLY  75   7.438   6.497 -12.330
  555   2HA   GLY  75          2HA       GLY  75   6.405   5.196 -12.930
  556    H    ILE  76           HN       ILE  76   6.759   7.652 -10.419
  557    HA   ILE  76           HA       ILE  76   3.902   7.471  -9.608
  558    HB   ILE  76           HB       ILE  76   6.433   8.642  -8.438
  559   1HG1  ILE  76          2HG12     ILE  76   5.736   7.442  -6.482
  560   2HG1  ILE  76          1HG11     ILE  76   4.123   7.136  -7.151
  561   1HG2  ILE  76          3HG23     ILE  76   3.607   9.476  -7.636
  562   2HG2  ILE  76          1HG21     ILE  76   5.070   9.751  -6.680
  563   3HG2  ILE  76          2HG22     ILE  76   4.904  10.538  -8.244
  564   1HD1  ILE  76          1HD11     ILE  76   6.634   6.008  -8.403
  565   2HD1  ILE  76          2HD12     ILE  76   5.759   5.168  -7.125
  566   3HD1  ILE  76          3HD13     ILE  76   4.950   5.498  -8.658
  567    H    THR  77           HN       THR  77   2.558   9.355  -9.691
  568    HA   THR  77           HA       THR  77   3.474  11.476 -11.609
  569    HB   THR  77           HB       THR  77   1.211  11.532 -12.486
  570    HG1  THR  77           HG1      THR  77   0.752   9.448 -10.592
  571   1HG2  THR  77          1HG21     THR  77   2.865   9.981 -13.543
  572   2HG2  THR  77          2HG22     THR  77   2.242   8.653 -12.542
  573   3HG2  THR  77          3HG23     THR  77   1.185   9.439 -13.725
  574    H    ALA  78           HN       ALA  78   0.351  11.680 -10.254
  575    HA   ALA  78           HA       ALA  78   1.215  13.849  -8.389
  576   1HB   ALA  78          1HB       ALA  78  -1.543  13.020  -9.399
  577   2HB   ALA  78          2HB       ALA  78  -1.195  14.375  -8.304
  578   3HB   ALA  78          3HB       ALA  78  -0.592  14.409  -9.974
  579    H    MET  79           HN       MET  79   1.176  13.395  -6.176
  580    HA   MET  79           HA       MET  79   0.649  10.679  -5.339
  581   1HB   MET  79          2HB       MET  79   1.320  13.225  -3.814
  582   2HB   MET  79          1HB       MET  79   1.081  11.655  -3.049
  583   1HG   MET  79          1HG       MET  79   3.411  11.831  -3.319
  584   2HG   MET  79          2HG       MET  79   2.881  10.711  -4.568
  585   1HE   MET  79          2HE       MET  79   4.626  13.990  -3.645
  586   2HE   MET  79          1HE       MET  79   4.651  14.914  -5.163
  587   3HE   MET  79          3HE       MET  79   3.123  14.708  -4.281
  588    HA   PRO  80           HA       PRO  80  -0.418   9.307  -3.965
  589   1HB   PRO  80          2HB       PRO  80  -3.145   8.180  -4.331
  590   2HB   PRO  80          1HB       PRO  80  -1.981   7.885  -3.024
  591   1HG   PRO  80          1HG       PRO  80  -4.202   9.380  -2.669
  592   2HG   PRO  80          2HG       PRO  80  -2.660   9.857  -1.899
  593   1HD   PRO  80          1HD       PRO  80  -3.858  10.914  -4.489
  594   2HD   PRO  80          2HD       PRO  80  -3.179  11.842  -3.124
  595    H    THR  81           HN       THR  81   0.362   7.936  -5.533
  596    HA   THR  81           HA       THR  81  -1.212   7.512  -8.050
  597    HB   THR  81           HB       THR  81   1.766   7.457  -7.646
  598    HG1  THR  81           HG1      THR  81   0.403   9.494  -8.196
  599   1HG2  THR  81          2HG22     THR  81   0.027   6.678 -10.031
  600   2HG2  THR  81          3HG23     THR  81   1.776   6.922 -10.144
  601   3HG2  THR  81          1HG21     THR  81   1.129   5.635  -9.114
  602    H    PHE  82           HN       PHE  82  -2.127   5.574  -7.919
  603    HA   PHE  82           HA       PHE  82  -1.176   3.567  -5.940
  604   1HB   PHE  82          2HB       PHE  82  -3.785   4.081  -7.378
  605   2HB   PHE  82          1HB       PHE  82  -3.463   2.548  -6.599
  606    HD1  PHE  82           HD2      PHE  82  -3.000   2.463  -4.107
  607    HD2  PHE  82           HD1      PHE  82  -4.344   6.085  -6.041
  608    HE1  PHE  82           HE2      PHE  82  -3.876   3.333  -1.947
  609    HE2  PHE  82           HE1      PHE  82  -5.324   6.849  -3.902
  610    HZ   PHE  82           HZ       PHE  82  -5.081   5.468  -1.857
  611    H    HIS  83           HN       HIS  83  -0.208   1.717  -6.712
  612    HA   HIS  83           HA       HIS  83  -0.502   1.060  -9.638
  613   1HB   HIS  83          2HB       HIS  83   1.834   0.674  -7.833
  614   2HB   HIS  83          1HB       HIS  83   1.714  -0.003  -9.460
  615    HD2  HIS  83           HD2      HIS  83   0.697   3.426 -10.230
  616    HE1  HIS  83           HE1      HIS  83   4.914   3.541 -10.059
  617    HE2  HIS  83           HE2      HIS  83   2.896   4.773 -10.896
  618    H    VAL  84           HN       VAL  84  -0.705  -1.138 -10.092
  619    HA   VAL  84           HA       VAL  84  -0.966  -3.021  -7.804
  620    HB   VAL  84           HB       VAL  84  -2.617  -3.184 -10.339
  621   1HG1  VAL  84          3HG23     VAL  84  -2.808  -4.434  -7.577
  622   2HG1  VAL  84          1HG21     VAL  84  -3.984  -4.675  -8.883
  623   3HG1  VAL  84          2HG22     VAL  84  -2.321  -5.256  -9.071
  624   1HG2  VAL  84          2HG12     VAL  84  -3.415  -1.892  -7.691
  625   2HG2  VAL  84          1HG11     VAL  84  -3.328  -1.085  -9.273
  626   3HG2  VAL  84          3HG13     VAL  84  -4.544  -2.336  -8.991
  627    H    TYR  85           HN       TYR  85   0.734  -4.435  -8.027
  628    HA   TYR  85           HA       TYR  85   1.600  -5.230 -10.793
  629   1HB   TYR  85          2HB       TYR  85   3.236  -5.539  -8.254
  630   2HB   TYR  85          1HB       TYR  85   3.700  -5.869  -9.881
  631    HD1  TYR  85           HD1      TYR  85   2.457  -2.978  -7.744
  632    HD2  TYR  85           HD2      TYR  85   5.343  -4.354 -10.627
  633    HE1  TYR  85           HE1      TYR  85   3.514  -0.751  -7.782
  634    HE2  TYR  85           HE2      TYR  85   6.373  -2.114 -10.665
  635    HH   TYR  85           HH       TYR  85   4.777   0.695  -9.253
  636    H    LYS  86           HN       LYS  86   1.464  -7.486 -11.263
  637    HA   LYS  86           HA       LYS  86  -0.107  -9.034  -9.204
  638   1HB   LYS  86          1HB       LYS  86   0.296  -9.431 -12.179
  639   2HB   LYS  86          2HB       LYS  86  -0.391 -10.665 -11.101
  640   1HG   LYS  86          1HG       LYS  86  -2.065  -8.986 -10.290
  641   2HG   LYS  86          2HG       LYS  86  -1.579  -7.896 -11.579
  642   1HD   LYS  86          2HD       LYS  86  -2.452 -10.772 -12.154
  643   2HD   LYS  86          1HD       LYS  86  -3.639  -9.512 -11.828
  644   1HE   LYS  86          1HE       LYS  86  -3.336  -9.848 -14.229
  645   2HE   LYS  86          2HE       LYS  86  -2.962  -8.201 -13.718
  646   1HZ   LYS  86          2HZ       LYS  86  -0.980 -10.313 -14.237
  647   2HZ   LYS  86          1HZ       LYS  86  -1.365  -9.092 -15.275
  648   3HZ   LYS  86          3HZ       LYS  86  -0.647  -8.750 -13.836
  649    H    ASP  87           HN       ASP  87   1.859 -10.739 -11.504
  650    HA   ASP  87           HA       ASP  87   3.001 -12.479  -9.607
  651   1HB   ASP  87          2HB       ASP  87   4.417 -13.195 -11.418
  652   2HB   ASP  87          1HB       ASP  87   2.821 -12.831 -12.100
  653    H    GLY  88           HN       GLY  88   4.159  -9.661 -11.136
  654   1HA   GLY  88          1HA       GLY  88   5.783  -8.570  -9.030
  655   2HA   GLY  88          2HA       GLY  88   6.804  -9.411 -10.220
  656    H    VAL  89           HN       VAL  89   4.828  -8.769 -12.507
  657    HA   VAL  89           HA       VAL  89   5.964  -6.167 -13.081
  658    HB   VAL  89           HB       VAL  89   5.329  -6.541 -15.251
  659   1HG1  VAL  89          3HG13     VAL  89   7.049  -8.153 -14.414
  660   2HG1  VAL  89          2HG12     VAL  89   5.779  -9.385 -14.276
  661   3HG1  VAL  89          1HG11     VAL  89   6.170  -8.703 -15.854
  662   1HG2  VAL  89          3HG23     VAL  89   3.226  -8.535 -14.360
  663   2HG2  VAL  89          2HG22     VAL  89   2.990  -6.990 -15.196
  664   3HG2  VAL  89          1HG21     VAL  89   3.762  -8.334 -16.038
  665    H    LYS  90           HN       LYS  90   4.994  -4.287 -12.931
  666    HA   LYS  90           HA       LYS  90   2.589  -3.567 -11.846
  667   1HB   LYS  90          2HB       LYS  90   4.634  -2.164 -12.625
  668   2HB   LYS  90          1HB       LYS  90   3.810  -2.061 -14.178
  669   1HG   LYS  90          1HG       LYS  90   1.867  -0.971 -13.065
  670   2HG   LYS  90          2HG       LYS  90   2.597  -1.256 -11.487
  671   1HD   LYS  90          1HD       LYS  90   2.947   1.062 -12.149
  672   2HD   LYS  90          2HD       LYS  90   4.484   0.223 -11.989
  673   1HE   LYS  90          1HE       LYS  90   4.352   1.746 -13.958
  674   2HE   LYS  90          2HE       LYS  90   4.748   0.082 -14.398
  675   1HZ   LYS  90          3HZ       LYS  90   2.042   1.239 -14.546
  676   2HZ   LYS  90          1HZ       LYS  90   3.077   1.081 -15.823
  677   3HZ   LYS  90          2HZ       LYS  90   2.504  -0.255 -15.052
  678    H    ALA  91           HN       ALA  91   0.604  -4.220 -12.405
  679    HA   ALA  91           HA       ALA  91  -0.023  -5.095 -15.163
  680   1HB   ALA  91          3HB       ALA  91  -0.362  -6.644 -13.264
  681   2HB   ALA  91          1HB       ALA  91  -1.455  -5.472 -12.495
  682   3HB   ALA  91          2HB       ALA  91  -1.903  -6.206 -14.046
  683    H    ASP  92           HN       ASP  92  -1.130  -2.885 -12.603
  684    HA   ASP  92           HA       ASP  92  -2.793  -1.370 -14.516
  685   1HB   ASP  92          1HB       ASP  92  -4.172  -3.289 -13.793
  686   2HB   ASP  92          2HB       ASP  92  -3.877  -2.871 -12.096
  687    H    ASP  93           HN       ASP  93  -3.698   0.617 -13.312
  688    HA   ASP  93           HA       ASP  93  -2.147   1.462 -10.969
  689   1HB   ASP  93          1HB       ASP  93  -1.798   2.876 -13.653
  690   2HB   ASP  93          2HB       ASP  93  -1.132   3.405 -12.104
  691    H    LEU  94           HN       LEU  94  -2.788   3.773 -10.417
  692    HA   LEU  94           HA       LEU  94  -5.096   5.005 -11.667
  693   1HB   LEU  94          2HB       LEU  94  -6.245   3.324 -10.434
  694   2HB   LEU  94          1HB       LEU  94  -5.321   3.584  -8.967
  695    HG   LEU  94           HG       LEU  94  -6.974   5.874 -10.063
  696   1HD1  LEU  94          2HD22     LEU  94  -8.107   3.494  -8.559
  697   2HD1  LEU  94          3HD23     LEU  94  -8.949   5.028  -8.857
  698   3HD1  LEU  94          1HD21     LEU  94  -8.497   3.990 -10.221
  699   1HD2  LEU  94          1HD11     LEU  94  -5.573   6.153  -7.955
  700   2HD2  LEU  94          2HD12     LEU  94  -7.301   6.356  -7.664
  701   3HD2  LEU  94          3HD13     LEU  94  -6.499   4.841  -7.215
  702    H    VAL  95           HN       VAL  95  -5.473   7.168 -10.531
  703    HA   VAL  95           HA       VAL  95  -3.178   8.075  -8.900
  704    HB   VAL  95           HB       VAL  95  -3.168  10.178 -10.205
  705   1HG1  VAL  95          2HG12     VAL  95  -1.505   8.427 -10.594
  706   2HG1  VAL  95          3HG13     VAL  95  -2.532   7.692 -11.845
  707   3HG1  VAL  95          1HG11     VAL  95  -1.871   9.321 -12.087
  708   1HG2  VAL  95          3HG23     VAL  95  -5.411  10.057 -11.275
  709   2HG2  VAL  95          1HG21     VAL  95  -4.120  10.273 -12.463
  710   3HG2  VAL  95          2HG22     VAL  95  -4.867   8.681 -12.258
  711    H    GLY  96           HN       GLY  96  -3.783   9.850  -7.559
  712   1HA   GLY  96          1HA       GLY  96  -5.262  11.338  -6.479
  713   2HA   GLY  96          2HA       GLY  96  -6.568  10.851  -7.578
  714    H    ALA  97           HN       ALA  97  -7.846  10.765  -5.526
  715    HA   ALA  97           HA       ALA  97  -7.216   8.640  -3.592
  716   1HB   ALA  97          2HB       ALA  97  -9.554  10.597  -3.790
  717   2HB   ALA  97          3HB       ALA  97  -9.255   9.457  -2.459
  718   3HB   ALA  97          1HB       ALA  97  -8.114  10.769  -2.794
  719    H    SER  98           HN       SER  98 -10.304   9.360  -5.149
  720    HA   SER  98           HA       SER  98 -12.101   7.964  -5.568
  721   1HB   SER  98          1HB       SER  98  -9.954   7.019  -7.510
  722   2HB   SER  98          2HB       SER  98 -11.713   6.973  -7.769
  723    HG   SER  98           HG       SER  98 -11.740   9.230  -7.702
  724    H    GLN  99           HN       GLN  99 -11.415   6.830  -3.340
  725    HA   GLN  99           HA       GLN  99 -10.417   4.276  -3.081
  726   1HB   GLN  99          1HB       GLN  99 -12.808   5.637  -1.789
  727   2HB   GLN  99          2HB       GLN  99 -12.250   4.049  -1.260
  728   1HG   GLN  99          2HG       GLN  99 -10.227   6.299  -1.428
  729   2HG   GLN  99          1HG       GLN  99 -11.369   6.281  -0.083
  730   1HE2  GLN  99          1HE21     GLN  99 -10.039   3.418   1.544
  731   2HE2  GLN  99          2HE22     GLN  99 -11.563   4.204   1.181
  732    H    ASP 100           HN       ASP 100 -13.641   5.157  -4.316
  733    HA   ASP 100           HA       ASP 100 -14.788   2.542  -4.398
  734   1HB   ASP 100          1HB       ASP 100 -16.401   3.557  -5.920
  735   2HB   ASP 100          2HB       ASP 100 -16.111   4.620  -4.540
  736    H    LYS 101           HN       LYS 101 -13.138   4.512  -6.902
  737    HA   LYS 101           HA       LYS 101 -13.234   2.482  -8.927
  738   1HB   LYS 101          2HB       LYS 101 -12.924   4.945  -9.310
  739   2HB   LYS 101          1HB       LYS 101 -11.278   4.798  -8.664
  740   1HG   LYS 101          1HG       LYS 101 -10.733   3.165 -10.469
  741   2HG   LYS 101          2HG       LYS 101 -12.395   3.293 -11.071
  742   1HD   LYS 101          2HD       LYS 101 -12.071   5.669 -11.603
  743   2HD   LYS 101          1HD       LYS 101 -10.474   5.660 -10.844
  744   1HE   LYS 101          2HE       LYS 101 -10.253   5.550 -13.280
  745   2HE   LYS 101          1HE       LYS 101  -9.636   4.065 -12.540
  746   1HZ   LYS 101          3HZ       LYS 101 -12.289   4.385 -13.764
  747   2HZ   LYS 101          2HZ       LYS 101 -10.994   3.636 -14.453
  748   3HZ   LYS 101          1HZ       LYS 101 -11.691   2.997 -13.106
  749    H    LEU 102           HN       LEU 102 -10.843   3.420  -6.467
  750    HA   LEU 102           HA       LEU 102  -8.687   1.756  -7.130
  751   1HB   LEU 102          1HB       LEU 102  -9.086   3.558  -5.243
  752   2HB   LEU 102          2HB       LEU 102  -9.585   2.178  -4.264
  753    HG   LEU 102           HG       LEU 102  -6.869   2.687  -5.536
  754   1HD1  LEU 102          2HD12     LEU 102  -7.940   2.654  -2.673
  755   2HD1  LEU 102          1HD11     LEU 102  -6.234   2.761  -3.107
  756   3HD1  LEU 102          3HD13     LEU 102  -7.345   4.059  -3.585
  757   1HD2  LEU 102          1HD21     LEU 102  -7.793   0.295  -3.882
  758   2HD2  LEU 102          2HD22     LEU 102  -7.186   0.267  -5.558
  759   3HD2  LEU 102          3HD23     LEU 102  -6.102   0.703  -4.238
  760    H    LYS 103           HN       LYS 103 -11.497   1.035  -4.949
  761    HA   LYS 103           HA       LYS 103 -10.854  -1.674  -4.515
  762   1HB   LYS 103          2HB       LYS 103 -12.635  -0.105  -3.386
  763   2HB   LYS 103          1HB       LYS 103 -13.710  -0.638  -4.676
  764   1HG   LYS 103          2HG       LYS 103 -13.148  -3.039  -4.026
  765   2HG   LYS 103          1HG       LYS 103 -12.242  -2.379  -2.648
  766   1HD   LYS 103          2HD       LYS 103 -14.308  -1.239  -1.845
  767   2HD   LYS 103          1HD       LYS 103 -15.200  -1.918  -3.214
  768   1HE   LYS 103          2HE       LYS 103 -13.861  -3.480  -0.939
  769   2HE   LYS 103          1HE       LYS 103 -15.597  -3.230  -1.160
  770   1HZ   LYS 103          1HZ       LYS 103 -15.432  -4.467  -3.224
  771   2HZ   LYS 103          2HZ       LYS 103 -13.835  -4.770  -2.946
  772   3HZ   LYS 103          3HZ       LYS 103 -14.970  -5.366  -1.925
  773    H    ALA 104           HN       ALA 104 -13.061  -0.165  -6.908
  774    HA   ALA 104           HA       ALA 104 -13.975  -2.468  -8.202
  775   1HB   ALA 104          2HB       ALA 104 -14.790  -0.152  -8.641
  776   2HB   ALA 104          3HB       ALA 104 -13.297   0.186  -9.546
  777   3HB   ALA 104          1HB       ALA 104 -14.426  -1.047 -10.129
  778    H    LEU 105           HN       LEU 105 -10.943  -0.634  -8.895
  779    HA   LEU 105           HA       LEU 105 -10.081  -2.381 -11.012
  780   1HB   LEU 105          1HB       LEU 105  -8.493  -0.620  -9.093
  781   2HB   LEU 105          2HB       LEU 105  -7.794  -1.496 -10.453
  782    HG   LEU 105           HG       LEU 105  -9.862   0.728 -10.669
  783   1HD1  LEU 105          1HD11     LEU 105  -7.607   1.437  -9.936
  784   2HD1  LEU 105          2HD12     LEU 105  -6.883   0.611 -11.328
  785   3HD1  LEU 105          3HD13     LEU 105  -7.955   2.002 -11.584
  786   1HD2  LEU 105          3HD23     LEU 105  -8.435  -0.863 -12.838
  787   2HD2  LEU 105          2HD22     LEU 105 -10.188  -0.778 -12.551
  788   3HD2  LEU 105          1HD21     LEU 105  -9.314   0.652 -13.104
  789    H    VAL 106           HN       VAL 106  -9.096  -2.230  -7.530
  790    HA   VAL 106           HA       VAL 106  -7.379  -4.387  -7.515
  791    HB   VAL 106           HB       VAL 106  -8.661  -2.809  -5.568
  792   1HG1  VAL 106          1HG11     VAL 106  -9.076  -5.685  -4.725
  793   2HG1  VAL 106          2HG12     VAL 106  -9.088  -4.269  -3.670
  794   3HG1  VAL 106          3HG13     VAL 106 -10.326  -4.425  -4.899
  795   1HG2  VAL 106          1HG21     VAL 106  -6.229  -3.474  -5.732
  796   2HG2  VAL 106          2HG22     VAL 106  -6.860  -3.782  -4.101
  797   3HG2  VAL 106          3HG23     VAL 106  -6.671  -5.125  -5.244
  798    H    ALA 107           HN       ALA 107 -10.829  -4.516  -6.932
  799    HA   ALA 107           HA       ALA 107 -11.283  -7.178  -6.510
  800   1HB   ALA 107          2HB       ALA 107 -13.048  -5.448  -6.529
  801   2HB   ALA 107          3HB       ALA 107 -12.987  -5.399  -8.308
  802   3HB   ALA 107          1HB       ALA 107 -13.523  -6.872  -7.471
  803    H    LYS 108           HN       LYS 108 -10.552  -5.774  -9.731
  804    HA   LYS 108           HA       LYS 108 -11.288  -8.123 -11.209
  805   1HB   LYS 108          2HB       LYS 108 -10.694  -6.902 -13.008
  806   2HB   LYS 108          1HB       LYS 108 -10.759  -5.572 -11.842
  807   1HG   LYS 108          2HG       LYS 108  -8.309  -5.858 -11.596
  808   2HG   LYS 108          1HG       LYS 108  -8.305  -6.982 -12.963
  809   1HD   LYS 108          1HD       LYS 108  -9.074  -4.026 -12.918
  810   2HD   LYS 108          2HD       LYS 108  -7.666  -4.753 -13.693
  811   1HE   LYS 108          1HE       LYS 108  -9.191  -6.025 -15.233
  812   2HE   LYS 108          2HE       LYS 108 -10.573  -5.158 -14.528
  813   1HZ   LYS 108          2HZ       LYS 108  -9.580  -3.114 -15.234
  814   2HZ   LYS 108          3HZ       LYS 108  -8.302  -3.913 -15.901
  815   3HZ   LYS 108          1HZ       LYS 108  -9.816  -4.121 -16.516
  816    H    HIS 109           HN       HIS 109  -8.355  -7.086  -9.610
  817    HA   HIS 109           HA       HIS 109  -6.682  -9.269 -10.724
  818   1HB   HIS 109          1HB       HIS 109  -6.046  -7.254  -8.538
  819   2HB   HIS 109          2HB       HIS 109  -4.911  -8.332  -9.361
  820    HD2  HIS 109           HD2      HIS 109  -6.930  -5.058  -9.987
  821    HE1  HIS 109           HE1      HIS 109  -4.315  -5.603 -13.241
  822    HE2  HIS 109           HE2      HIS 109  -5.924  -3.944 -12.121
  823    H    ALA 110           HN       ALA 110  -7.971  -8.184  -7.632
  824    HA   ALA 110           HA       ALA 110  -6.998 -10.156  -5.881
  825   1HB   ALA 110          1HB       ALA 110  -7.797  -7.932  -5.184
  826   2HB   ALA 110          2HB       ALA 110  -9.448  -8.380  -5.654
  827   3HB   ALA 110          3HB       ALA 110  -8.637  -9.238  -4.329
  828    H    ALA 111           HN       ALA 111 -10.073  -9.849  -7.698
  829    HA   ALA 111           HA       ALA 111 -11.795 -11.209  -8.134
  830   1HB   ALA 111          3HB       ALA 111 -10.042 -12.847  -8.838
  831   2HB   ALA 111          2HB       ALA 111 -10.056 -13.545  -7.203
  832   3HB   ALA 111          1HB       ALA 111 -11.512 -13.608  -8.203
  833    H    ALA 112           HN       ALA 112 -12.016  -9.722  -5.894
  834    HA   ALA 112           HA       ALA 112 -13.876 -11.077  -4.277
  835   1HB   ALA 112          2HB       ALA 112 -11.164 -10.422  -3.020
  836   2HB   ALA 112          3HB       ALA 112 -12.643 -10.812  -2.119
  837   3HB   ALA 112          1HB       ALA 112 -11.886 -12.040  -3.149
   
  No H/Q in entry =         837