*HEADER    CALCIUM-BINDING PROTEIN                 07-JUL-95   1TNQ    
*COMPND    MOL_ID: 1;                                                  
*COMPND   2 MOLECULE: TROPONIN-C;                                      
*COMPND   3 CHAIN: NULL;                                               
*COMPND   4 DOMAIN: N-TERMINAL REGULATORY DOMAIN, RESIDUES 1 - 90;     
*COMPND   5 SYNONYM: NTNC APO;                                         
*COMPND   6 ENGINEERED: YES;                                           
*COMPND   7 HETEROGEN: CA                                              
*SOURCE    MOL_ID: 1;                                                  
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                        
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                  
*SOURCE   4 TISSUE: SKELETON;                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PET3A;                          
*SOURCE   7 EXPRESSION_SYSTEM_GENE: NTNC                               
*KEYWDS    EF-HAND                                                     
*EXPDTA    NMR, 40 STRUCTURES                                          
*AUTHOR    S.M.GAGNE,B.D.SYKES                                         
*REVDAT   1   15-OCT-95 1TNQ    0                                      


**************************************************************
*                                                            *
*             Author         :  Brian D. Sykes               *
*             Date submitted :  Tue Jul  4 1995              *
*                                                            *
**************************************************************
!BIOSYM restraint 1
!
#remote_prochiral_center
1:VAL_83:HG1*   1:VAL_83:HG2*   1:VAL_83:CG1    1:VAL_83:CG2    1:VAL_83:CB    
1:LEU_79:HD1*   1:LEU_79:HD2*   1:LEU_79:CD1    1:LEU_79:CD2    1:LEU_79:CG    
1:VAL_80:HG1*   1:VAL_80:HG2*   1:VAL_80:CG1    1:VAL_80:CG2    1:VAL_80:CB    
1:VAL_45:HG2*   1:VAL_45:HG1*   1:VAL_45:CG2    1:VAL_45:CG1    1:VAL_45:CB    
1:LEU_14:HD1*   1:LEU_14:HD2*   1:LEU_14:CD1    1:LEU_14:CD2    1:LEU_14:CG    
1:LEU_58:HD1*   1:LEU_58:HD2*   1:LEU_58:CD1    1:LEU_58:CD2    1:LEU_58:CG    
1:LEU_42:HD2*   1:LEU_42:HD1*   1:LEU_42:CD2    1:LEU_42:CD1    1:LEU_42:CG    
1:LEU_49:HD1*   1:LEU_49:HD2*   1:LEU_49:CD1    1:LEU_49:CD2    1:LEU_49:CG    
1:VAL_65:HG1*   1:VAL_65:HG2*   1:VAL_65:CG1    1:VAL_65:CG2    1:VAL_65:CB    
!
#chiral
1:ALAN_1:CA        S
1:SER_2:CA         S
1:MET_3:CA         S
1:THR_4:CA         S
1:THR_4:CB         R
1:ASP-_5:CA        S
1:GLN_6:CA         S
1:GLN_7:CA         S
1:ALA_8:CA         S
1:GLU-_9:CA        S
1:ALA_10:CA        S
1:ARG+_11:CA       S
1:ALA_12:CA        S
1:PHE_13:CA        S
1:LEU_14:CA        S
1:SER_15:CA        S
1:GLU-_16:CA       S
1:GLU-_17:CA       S
1:MET_18:CA        S
1:ILE_19:CA        S
1:ILE_19:CB        S
1:ALA_20:CA        S
1:GLU-_21:CA       S
1:PHE_22:CA        S
1:LYS+_23:CA       S
1:ALA_24:CA        S
1:ALA_25:CA        S
1:PHE_26:CA        S
1:ASP-_27:CA       S
1:MET_28:CA        S
1:PHE_29:CA        S
1:ASP-_30:CA       S
1:ALA_31:CA        S
1:ASP-_32:CA       S
1:ASP-_36:CA       S
1:ILE_37:CA        S
1:ILE_37:CB        S
1:SER_38:CA        S
1:THR_39:CA        S
1:THR_39:CB        R
1:LYS+_40:CA       S
1:GLU-_41:CA       S
1:LEU_42:CA        S
1:THR_44:CA        S
1:THR_44:CB        R
1:VAL_45:CA        S
1:MET_46:CA        S
1:ARG+_47:CA       S
1:MET_48:CA        S
1:LEU_49:CA        S
1:GLN_51:CA        S
1:ASN_52:CA        S
1:PRO_53:CA        S
1:THR_54:CA        S
1:THR_54:CB        R
1:LYS+_55:CA       S
1:GLU-_56:CA       S
1:GLU-_57:CA       S
1:LEU_58:CA        S
1:ASP-_59:CA       S
1:ALA_60:CA        S
1:ILE_61:CA        S
1:ILE_61:CB        S
1:ILE_62:CA        S
1:ILE_62:CB        S
1:GLU-_63:CA       S
1:GLU-_64:CA       S
1:VAL_65:CA        S
1:ASP-_66:CA       S
1:GLU-_67:CA       S
1:ASP-_68:CA       S
1:SER_70:CA        S
1:THR_72:CA        S
1:THR_72:CB        R
1:ILE_73:CA        S
1:ILE_73:CB        S
1:ASP-_74:CA       S
1:PHE_75:CA        S
1:GLU-_76:CA       S
1:GLU-_77:CA       S
1:PHE_78:CA        S
1:LEU_79:CA        S
1:VAL_80:CA        S
1:MET_81:CA        S
1:MET_82:CA        S
1:VAL_83:CA        S
1:ARG+_84:CA       S
1:GLN_85:CA        S
1:MET_86:CA        S
1:LYS+_87:CA       S
1:GLU-_88:CA       S
1:ASP-_89:CA       S
1:ALAC_90:CA       S
!
#distance
1:ASP-_30:OD1      1:CA_1B:CA1         2.000  2.800  1.00  1.00 1000.000
1:ASP-_32:OD1      1:CA_1B:CA1         2.000  2.800  1.00  1.00 1000.000
1:ASP-_36:O        1:CA_1B:CA1         2.000  2.800  1.00  1.00 1000.000
1:GLU-_41:OE1      1:CA_1B:CA1         2.000  2.800  1.00  1.00 1000.000
1:GLU-_41:OE2      1:CA_1B:CA1         2.000  2.800  1.00  1.00 1000.000
1:ASP-_66:OD1      1:CA_2B:CA2         2.000  2.800  1.00  1.00 1000.000
1:ASP-_68:OD1      1:CA_2B:CA2         2.000  2.800  1.00  1.00 1000.000
1:SER_70:OG        1:CA_2B:CA2         2.000  2.800  1.00  1.00 1000.000
1:THR_72:O         1:CA_2B:CA2         2.000  2.800  1.00  1.00 1000.000
1:GLU-_77:OE1      1:CA_2B:CA2         2.000  2.800  1.00  1.00 1000.000
1:GLU-_77:OE2      1:CA_2B:CA2         2.000  2.800  1.00  1.00 1000.000
!
#NOE_distance
1:ALA_10:HA        1:ALA_10:HB*        2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ALA_10:HA        1:VAL_83:HG1*       2.370  4.650  4.650  0.00  0.00   0.000  0.00
1:ALA_10:HA        1:VAL_83:HG2*       2.370  4.650  4.550  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:LEU_79:HA         2.950  5.430  5.430  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:LEU_79:HD1*      -1.000  8.670  6.270  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:LEU_79:HD2*      -1.000  8.670  6.270  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:GLN_7:HA          2.540  4.800  4.800  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:VAL_80:HA         2.240  4.020  4.020  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:VAL_80:HB         2.970  5.460  5.460  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:VAL_80:HG1*       2.160  5.800  5.800  0.00  0.00   0.000  0.00
1:VAL_80:HG2*      1:ALA_10:HB*        2.160  5.800  5.250  0.00  0.00   0.000  0.00
1:ALA_10:HB*       1:VAL_83:HG2*       2.370  5.610  5.550  0.00  0.00   0.000  0.00
1:VAL_83:HG1*      1:ALA_10:HB*        2.370  5.610  5.610  0.00  0.00   0.000  0.00
1:ALA_12:HA        1:ALA_12:HB*        2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ALA_20:HA        1:ILE_19:HG2*       2.810  5.210  5.210  0.00  0.00   0.000  0.00
1:ALA_20:HB*       1:GLU-_17:HA        1.810  4.670  4.670  0.00  0.00   0.000  0.00
1:ALA_25:HA        1:ALA_25:HB*        2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:ALA_24:HB*        2.460  5.690  5.690  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:PHE_22:HA         2.450  4.680  4.680  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:MET_28:HB1       -1.000  6.720  5.020  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:MET_28:HB2       -1.000  6.720  5.020  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:MET_28:HE*        2.730  6.090  6.090  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:MET_28:HG2       -1.000  7.140  5.440  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:MET_28:HG1       -1.000  7.140  5.440  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:VAL_45:HG2*      -1.000  8.640  6.240  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:VAL_45:HG1*      -1.000  8.640  6.240  0.00  0.00   0.000  0.00
1:ALA_31:HA        1:ALA_31:HB*        2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ALA_31:HB*       1:ILE_37:HG2*       1.700  6.840  5.840  0.00  0.00   0.000  0.00
1:ALA_8:HA         1:ARG+_11:HB*       1.700  5.360  5.360  0.00  0.00   0.000  0.00
1:ALA_8:HB*        1:ASP-_5:HA         1.710  4.700  4.700  0.00  0.00   0.000  0.00
1:ASP-_27:HA       1:ASP-_30:HB2       1.700  6.000  5.110  0.00  0.00   0.000  0.00
1:ASP-_30:HB1      1:ASP-_27:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_30:HA       1:ASP-_30:HB1       1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:ASP-_30:HB2      1:ASP-_30:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_30:HA       1:ILE_37:HD1*       2.050  5.160  5.160  0.00  0.00   0.000  0.00
1:ASP-_30:HB1      1:ASP-_30:HB2      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:ASP-_32:HA       1:ASP-_32:HB1       1.780  3.830  3.830  0.00  0.00   0.000  0.00
1:ASP-_32:HA       1:ASP-_32:HB2       1.780  3.830  3.720  0.00  0.00   0.000  0.00
1:ASP-_32:HB1      1:ASP-_32:HB2      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:ASP-_36:HB1       1.780  3.830  3.720  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:ASP-_36:HB2       1.780  3.830  3.830  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:ASP-_74:HA        1.920  3.760  3.760  0.00  0.00   0.000  0.00
1:ASP-_36:HB1      1:ASP-_36:HB2      -1.000  6.690  3.290  0.00  0.00   0.000  0.00
1:ASP-_36:HB1      1:ASP-_74:HA       -1.000  5.740  4.040  0.00  0.00   0.000  0.00
1:ASP-_36:HB2      1:ASP-_74:HA       -1.000  5.740  4.040  0.00  0.00   0.000  0.00
1:ASP-_36:HB2      1:THR_72:HB         1.980  4.200  3.930  0.00  0.00   0.000  0.00
1:THR_72:HB        1:ASP-_36:HB1       1.980  4.200  4.200  0.00  0.00   0.000  0.00
1:ASP-_5:HA        1:ASP-_5:HB1        1.820  3.740  3.740  0.00  0.00   0.000  0.00
1:ASP-_5:HA        1:ASP-_5:HB2        1.820  3.740  3.720  0.00  0.00   0.000  0.00
1:ASP-_59:HA       1:ASP-_59:HB1       1.750  3.910  3.720  0.00  0.00   0.000  0.00
1:ASP-_59:HA       1:ASP-_59:HB2       1.750  3.910  3.910  0.00  0.00   0.000  0.00
1:ASP-_59:HA       1:THR_39:HG2*       2.690  5.040  5.040  0.00  0.00   0.000  0.00
1:ASP-_59:HB1      1:GLU-_56:HA        2.180  4.440  3.900  0.00  0.00   0.000  0.00
1:GLU-_56:HA       1:ASP-_59:HB2       2.180  4.440  4.440  0.00  0.00   0.000  0.00
1:ASP-_66:HA       1:ASP-_66:HB1       1.710  4.000  3.720  0.00  0.00   0.000  0.00
1:ASP-_66:HA       1:ASP-_66:HB2       1.710  4.000  4.000  0.00  0.00   0.000  0.00
1:ASP-_66:HB1      1:ASP-_66:HB2      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:ASP-_68:HA       1:ASP-_68:HB1       1.800  3.780  3.720  0.00  0.00   0.000  0.00
1:ASP-_68:HA       1:ASP-_68:HB2       1.800  3.780  3.780  0.00  0.00   0.000  0.00
1:ASP-_74:HA       1:ASP-_74:HB1       1.790  3.810  3.810  0.00  0.00   0.000  0.00
1:ASP-_74:HA       1:ASP-_74:HB2       1.790  3.810  3.720  0.00  0.00   0.000  0.00
1:ASP-_74:HB1      1:ASP-_74:HB2      -1.000  6.620  3.220  0.00  0.00   0.000  0.00
1:ASP-_89:HA       1:ASP-_89:HB1       1.740  3.930  3.720  0.00  0.00   0.000  0.00
1:ASP-_89:HA       1:ASP-_89:HB2       1.740  3.930  3.930  0.00  0.00   0.000  0.00
1:ASP-_89:HB1      1:ASP-_89:HB2      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLU-_16:HA       1:GLU-_16:HB1       1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:GLU-_16:HA       1:GLU-_16:HB2       1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:GLU-_16:HA       1:GLU-_16:HG1       2.290  4.740  4.660  0.00  0.00   0.000  0.00
1:GLU-_16:HA       1:GLU-_16:HG2       2.290  4.740  4.740  0.00  0.00   0.000  0.00
1:GLU-_17:HA       1:GLU-_17:HB1       1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:GLU-_17:HB2      1:GLU-_17:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_17:HA       1:GLU-_17:HG1       1.700  4.580  4.010  0.00  0.00   0.000  0.00
1:GLU-_17:HG2      1:GLU-_17:HA        1.700  4.580  4.580  0.00  0.00   0.000  0.00
1:GLU-_17:HB1      1:GLU-_17:HG1      -1.000  5.740  3.810  0.00  0.00   0.000  0.00
1:GLU-_17:HB1      1:GLU-_17:HG2      -1.000  5.740  4.040  0.00  0.00   0.000  0.00
1:GLU-_17:HB2      1:GLU-_17:HG1      -1.000  5.740  3.810  0.00  0.00   0.000  0.00
1:GLU-_17:HB2      1:GLU-_17:HG2      -1.000  5.740  3.810  0.00  0.00   0.000  0.00
1:GLU-_17:HB1      1:MET_18:HG2       -1.000  7.640  4.240  0.00  0.00   0.000  0.00
1:GLU-_17:HB1      1:MET_18:HG1       -1.000  7.640  4.240  0.00  0.00   0.000  0.00
1:GLU-_17:HB2      1:MET_18:HG2       -1.000  7.640  4.240  0.00  0.00   0.000  0.00
1:GLU-_17:HB2      1:MET_18:HG1       -1.000  7.640  4.240  0.00  0.00   0.000  0.00
1:GLU-_21:HA       1:GLU-_21:HB2      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLU-_21:HA       1:GLU-_21:HB1      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLU-_21:HA       1:GLU-_21:HG1       2.100  3.990  3.910  0.00  0.00   0.000  0.00
1:GLU-_21:HA       1:GLU-_21:HG2       2.100  3.990  3.990  0.00  0.00   0.000  0.00
1:GLU-_21:HG1      1:GLU-_21:HB1      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_21:HG1      1:GLU-_21:HB2      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_21:HG2      1:GLU-_21:HB1      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_21:HG2      1:GLU-_21:HB2      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_41:HA       1:GLU-_41:HG*       1.700  4.930  4.930  0.00  0.00   0.000  0.00
1:GLU-_41:HA       1:THR_44:HB         2.060  4.270  4.270  0.00  0.00   0.000  0.00
1:GLU-_56:HA       1:GLU-_56:HB1      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLU-_56:HA       1:GLU-_56:HB2      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLU-_56:HA       1:GLU-_56:HG1       1.980  4.530  4.020  0.00  0.00   0.000  0.00
1:GLU-_56:HA       1:GLU-_56:HG2       1.980  4.530  4.530  0.00  0.00   0.000  0.00
1:GLU-_56:HA       1:THR_54:HG2*       2.430  5.940  5.940  0.00  0.00   0.000  0.00
1:GLU-_56:HG1      1:GLU-_56:HB1      -1.000  7.700  3.720  0.00  0.00   0.000  0.00
1:GLU-_56:HG1      1:GLU-_56:HB2      -1.000  7.700  3.720  0.00  0.00   0.000  0.00
1:GLU-_56:HG2      1:GLU-_56:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_56:HG2      1:GLU-_56:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HA       1:ALA_60:HB*        1.700  6.380  6.380  0.00  0.00   0.000  0.00
1:GLU-_63:HA       1:ASP-_66:HB2      -1.000  6.050  4.350  0.00  0.00   0.000  0.00
1:GLU-_63:HA       1:ASP-_66:HB1      -1.000  6.050  4.350  0.00  0.00   0.000  0.00
1:GLU-_63:HA       1:GLU-_63:HB2       1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:GLU-_63:HB1      1:GLU-_63:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_63:HA       1:ILE_62:HG2*       2.140  5.350  5.350  0.00  0.00   0.000  0.00
1:GLU-_63:HB1      1:ALA_60:HA         1.880  4.000  3.810  0.00  0.00   0.000  0.00
1:GLU-_63:HB2      1:ALA_60:HA         1.880  4.000  4.000  0.00  0.00   0.000  0.00
1:GLU-_67:HA       1:GLU-_67:HB1      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLU-_67:HA       1:GLU-_67:HB2      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLU-_67:HA       1:GLU-_67:HG2      -1.000  5.510  3.810  0.00  0.00   0.000  0.00
1:GLU-_67:HA       1:GLU-_67:HG1      -1.000  5.510  3.810  0.00  0.00   0.000  0.00
1:GLU-_76:HA       1:GLU-_76:HB1       1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:GLU-_76:HA       1:GLU-_76:HB2       1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:GLU-_76:HA       1:GLU-_76:HG*       1.900  4.990  4.990  0.00  0.00   0.000  0.00
1:GLU-_76:HA       1:LEU_79:HD1*      -1.000  7.300  4.900  0.00  0.00   0.000  0.00
1:GLU-_76:HA       1:LEU_79:HD2*      -1.000  7.300  4.900  0.00  0.00   0.000  0.00
1:GLU-_77:HA       1:GLU-_77:HB*       1.830  4.720  4.720  0.00  0.00   0.000  0.00
1:GLU-_77:HA       1:VAL_80:HG1*       2.040  5.150  5.150  0.00  0.00   0.000  0.00
1:GLU-_77:HA       1:VAL_80:HG2*       2.040  5.150  4.780  0.00  0.00   0.000  0.00
1:GLU-_88:HG1      1:GLU-_88:HB1      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_88:HG1      1:GLU-_88:HB2      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_88:HG2      1:GLU-_88:HB1      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_88:HG2      1:GLU-_88:HB2      -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLU-_9:HA        1:ALA_12:HB*        1.700  5.000  5.000  0.00  0.00   0.000  0.00
1:PHE_13:HA        1:PHE_13:HB1        1.800  3.790  3.790  0.00  0.00   0.000  0.00
1:PHE_13:HA        1:PHE_13:HB2        1.800  3.790  3.720  0.00  0.00   0.000  0.00
1:PHE_13:HB1       1:ALA_10:HA         2.030  4.310  4.310  0.00  0.00   0.000  0.00
1:PHE_13:HB2       1:ALA_10:HA         2.030  4.310  4.250  0.00  0.00   0.000  0.00
1:PHE_13:HB1       1:VAL_83:HG1*      -1.000  7.630  5.100  0.00  0.00   0.000  0.00
1:PHE_13:HB1       1:VAL_83:HG2*      -1.000  7.630  7.000  0.00  0.00   0.000  0.00
1:PHE_13:HB2       1:VAL_83:HG1*      -1.000  7.630  5.230  0.00  0.00   0.000  0.00
1:PHE_13:HB2       1:VAL_83:HG2*      -1.000  7.630  5.100  0.00  0.00   0.000  0.00
1:PHE_22:HA        1:PHE_22:HB*        1.830  4.720  4.720  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:ILE_19:HA         2.010  4.740  4.740  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:LEU_14:HD1*      -1.000  8.410  6.010  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:LEU_14:HD2*      -1.000  8.410  6.010  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:LEU_79:HD2*      -1.000  7.920  5.520  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:LEU_79:HD1*      -1.000  7.920  5.520  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:ILE_37:HD1*       2.540  4.810  4.810  0.00  0.00   0.000  0.00
1:PHE_26:HB*       1:PHE_26:HA         1.830  4.720  4.720  0.00  0.00   0.000  0.00
1:PHE_29:HA        1:PHE_29:HB1        1.700  3.940  3.720  0.00  0.00   0.000  0.00
1:PHE_29:HA        1:PHE_29:HB2        1.700  3.940  3.940  0.00  0.00   0.000  0.00
1:PHE_29:HB1       1:PHE_29:HB2       -1.000  6.530  3.130  0.00  0.00   0.000  0.00
1:PHE_29:HB1       1:ILE_37:HD1*       2.340  4.620  4.620  0.00  0.00   0.000  0.00
1:PHE_29:HB2       1:ILE_37:HD1*       2.340  4.620  4.520  0.00  0.00   0.000  0.00
1:PHE_75:HA        1:PHE_75:HB1        1.740  3.930  3.720  0.00  0.00   0.000  0.00
1:PHE_75:HA        1:PHE_75:HB2        1.740  3.930  3.930  0.00  0.00   0.000  0.00
1:PHE_75:HA        1:PHE_78:HB1        1.850  3.850  3.850  0.00  0.00   0.000  0.00
1:PHE_75:HA        1:PHE_78:HB2        1.850  3.850  3.650  0.00  0.00   0.000  0.00
1:PHE_75:HB1       1:PHE_75:HB2       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:PHE_78:HA        1:GLU-_77:HG1      -1.000  5.600  3.900  0.00  0.00   0.000  0.00
1:PHE_78:HA        1:GLU-_77:HG2      -1.000  5.600  3.900  0.00  0.00   0.000  0.00
1:PHE_78:HA        1:PHE_78:HB1        1.700  4.050  3.720  0.00  0.00   0.000  0.00
1:PHE_78:HA        1:PHE_78:HB2        1.700  4.050  4.050  0.00  0.00   0.000  0.00
1:PHE_78:HA        1:ILE_73:HG2*       1.700  4.660  4.660  0.00  0.00   0.000  0.00
1:PHE_78:HB1       1:PHE_78:HB2       -1.000  6.770  3.370  0.00  0.00   0.000  0.00
1:PHE_78:HB1       1:ILE_73:HG2*       1.700  4.960  4.610  0.00  0.00   0.000  0.00
1:PHE_78:HB2       1:ILE_73:HG2*       1.700  4.960  4.960  0.00  0.00   0.000  0.00
1:GLY_34:HA1       1:GLY_34:HA2       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLY_35:HA1       1:GLY_35:HA2       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLY_43:HA1       1:GLY_43:HA2       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLY_43:HA1       1:LEU_58:HD1*       1.870  3.880  3.790  0.00  0.00   0.000  0.00
1:GLY_43:HA1       1:LEU_58:HD2*       1.870  3.880  3.800  0.00  0.00   0.000  0.00
1:GLY_43:HA2       1:LEU_58:HD1*       1.870  3.880  3.880  0.00  0.00   0.000  0.00
1:GLY_43:HA2       1:LEU_58:HD2*       1.870  3.880  3.700  0.00  0.00   0.000  0.00
1:GLY_50:HA1       1:GLY_50:HA2       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLY_71:HA1       1:GLY_71:HA2       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLY_71:HA1       1:ILE_62:HG2*       1.700  7.000  3.830  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:GLY_71:HA2        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:ILE_19:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:ILE_19:HG11      -1.000  5.330  3.630  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:ILE_19:HG12      -1.000  5.330  3.630  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:ILE_19:HG2*       2.340  4.350  4.350  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:LEU_79:HD2*      -1.000  7.200  4.800  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:LEU_79:HD1*      -1.000  7.200  4.800  0.00  0.00   0.000  0.00
1:ILE_19:HB        1:GLU-_16:HA        1.700  3.410  3.410  0.00  0.00   0.000  0.00
1:ILE_19:HB        1:ILE_19:HD1*       1.700  4.240  4.240  0.00  0.00   0.000  0.00
1:ILE_19:HB        1:ILE_19:HG11       1.710  3.990  3.990  0.00  0.00   0.000  0.00
1:ILE_19:HB        1:ILE_19:HG12       1.710  3.990  3.720  0.00  0.00   0.000  0.00
1:ILE_19:HB        1:ILE_19:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_19:HD1*      1:GLU-_16:HA        1.700  5.020  5.020  0.00  0.00   0.000  0.00
1:ILE_19:HD1*      1:ILE_19:HA         1.700  5.410  5.410  0.00  0.00   0.000  0.00
1:ILE_19:HD1*      1:ILE_19:HG2*       1.700  5.450  5.450  0.00  0.00   0.000  0.00
1:ILE_19:HD1*      1:LEU_79:HD1*      -1.000  8.720  6.320  0.00  0.00   0.000  0.00
1:ILE_19:HD1*      1:LEU_79:HD2*      -1.000  8.720  6.320  0.00  0.00   0.000  0.00
1:ILE_19:HD1*      1:ARG+_11:HA        1.700  5.490  5.490  0.00  0.00   0.000  0.00
1:ILE_19:HG2*      1:PHE_22:HB*        2.890  6.340  6.340  0.00  0.00   0.000  0.00
1:ILE_19:HG2*      1:ILE_19:HG11      -1.000  6.770  5.070  0.00  0.00   0.000  0.00
1:ILE_19:HG2*      1:ILE_19:HG12      -1.000  6.770  5.070  0.00  0.00   0.000  0.00
1:ILE_19:HG2*      1:LEU_79:HD1*       2.450  5.700  5.700  0.00  0.00   0.000  0.00
1:ILE_19:HG2*      1:LEU_79:HD2*       2.450  5.700  5.670  0.00  0.00   0.000  0.00
1:ILE_37:HA        1:ILE_37:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:ILE_37:HA        1:ILE_37:HG1*       1.790  4.630  4.630  0.00  0.00   0.000  0.00
1:ILE_37:HA        1:ILE_37:HG2*       2.280  4.010  4.010  0.00  0.00   0.000  0.00
1:ILE_37:HB        1:ILE_37:HD1*       2.380  4.290  4.290  0.00  0.00   0.000  0.00
1:ILE_37:HB        1:ILE_37:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:ILE_37:HG1*       2.080  5.120  5.120  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:ILE_37:HG2*       2.050  4.960  4.960  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:ILE_73:HG2*       2.480  5.730  5.730  0.00  0.00   0.000  0.00
1:ILE_37:HG1*      1:ILE_37:HB         1.830  4.890  4.890  0.00  0.00   0.000  0.00
1:ILE_37:HG1*      1:ILE_37:HG2*       1.840  5.910  5.910  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:PHE_29:HB1       -1.000  6.840  5.140  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:PHE_29:HB2       -1.000  6.840  5.140  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:ILE_73:HB         2.700  5.050  5.050  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:LEU_42:HA         2.560  4.840  4.840  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:LEU_42:HB1       -1.000  6.250  4.550  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:LEU_42:HB2       -1.000  6.250  4.550  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:VAL_45:HG2*      -1.000  8.270  5.870  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:VAL_45:HG1*      -1.000  8.270  5.870  0.00  0.00   0.000  0.00
1:ILE_61:HA        1:ILE_61:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:ILE_61:HA        1:ILE_61:HG11       1.730  3.520  3.520  0.00  0.00   0.000  0.00
1:ILE_61:HA        1:ILE_61:HG12       1.730  3.520  2.580  0.00  0.00   0.000  0.00
1:ILE_61:HB        1:LEU_58:HA         1.850  3.750  3.750  0.00  0.00   0.000  0.00
1:ILE_61:HD1*      1:ILE_61:HA         2.550  4.820  4.820  0.00  0.00   0.000  0.00
1:ILE_61:HD1*      1:ILE_61:HG11       1.700  7.000  4.120  0.00  0.00   0.000  0.00
1:ILE_61:HG12      1:ILE_61:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_61:HG12      1:ILE_61:HG11      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_61:HA         2.210  4.320  4.320  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_61:HB         2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_61:HG11       2.310  4.940  4.940  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_61:HG12       2.310  4.940  4.460  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_62:HA         2.840  5.250  5.250  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_62:HG12      -1.000  7.070  5.370  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:ILE_62:HG11      -1.000  7.070  5.370  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:LEU_58:HA         2.890  5.330  5.330  0.00  0.00   0.000  0.00
1:ILE_61:HG2*      1:THR_39:HG2*       2.810  6.220  6.220  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:ILE_62:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:ILE_62:HD1*       1.780  4.610  4.610  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:ILE_62:HG11       1.760  3.730  3.570  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:ILE_62:HG12       1.760  3.730  3.730  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:ILE_62:HG2*       1.700  4.340  4.340  0.00  0.00   0.000  0.00
1:ILE_62:HB        1:ASP-_59:HA        1.800  3.740  3.740  0.00  0.00   0.000  0.00
1:ILE_62:HB        1:ILE_62:HD1*       2.260  4.490  4.490  0.00  0.00   0.000  0.00
1:ILE_62:HB        1:ILE_62:HG11       1.770  3.860  3.860  0.00  0.00   0.000  0.00
1:ILE_62:HB        1:ILE_62:HG12       1.770  3.860  3.720  0.00  0.00   0.000  0.00
1:ILE_62:HB        1:ILE_62:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:ASP-_59:HA        2.810  5.360  5.360  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:ILE_62:HG11       2.010  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:ILE_62:HG12       2.010  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:ILE_62:HG2*       2.040  5.000  5.000  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:THR_39:HA         2.280  4.540  4.540  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:THR_39:HG2*       2.120  5.170  5.170  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:THR_72:HA         2.870  4.930  4.930  0.00  0.00   0.000  0.00
1:ILE_62:HG11      1:ILE_62:HG12      -1.000  6.430  3.030  0.00  0.00   0.000  0.00
1:ILE_62:HG11      1:ILE_62:HG2*       2.400  4.600  4.600  0.00  0.00   0.000  0.00
1:ILE_62:HG12      1:ILE_62:HG2*       2.400  4.600  4.550  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:ASP-_59:HA        2.990  5.480  5.480  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:ILE_73:HG12      -1.000  6.540  4.840  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:ILE_73:HG11      -1.000  6.540  4.840  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:THR_39:HG2*       2.950  6.420  6.420  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:THR_72:HA         2.940  5.330  5.330  0.00  0.00   0.000  0.00
1:ILE_73:HA        1:ILE_73:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:ILE_73:HA        1:ILE_73:HG12       1.700  6.000  3.920  0.00  0.00   0.000  0.00
1:ILE_73:HG11      1:ILE_73:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_73:HA        1:ILE_73:HG2*       1.700  4.280  4.280  0.00  0.00   0.000  0.00
1:ILE_73:HB        1:ILE_37:HD1*       2.430  4.650  4.650  0.00  0.00   0.000  0.00
1:ILE_73:HB        1:ILE_73:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:ILE_73:HD1*      1:ILE_73:HA         1.700  5.950  5.950  0.00  0.00   0.000  0.00
1:ILE_73:HD1*      1:ILE_73:HG2*       1.700  5.910  5.910  0.00  0.00   0.000  0.00
1:ILE_73:HG11      1:ILE_73:HG12      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:LYS+_23:HA       1:LYS+_23:HD1       1.700  5.170  5.170  0.00  0.00   0.000  0.00
1:LYS+_23:HD2      1:LYS+_23:HA        1.700  5.170  3.610  0.00  0.00   0.000  0.00
1:LYS+_23:HB*      1:LYS+_23:HG1      -1.000  7.420  5.720  0.00  0.00   0.000  0.00
1:LYS+_23:HB*      1:LYS+_23:HG2      -1.000  7.420  5.720  0.00  0.00   0.000  0.00
1:LYS+_23:HD1      1:LYS+_23:HD2      -1.000  6.360  2.960  0.00  0.00   0.000  0.00
1:LYS+_23:HD1      1:LYS+_23:HE1       1.700  7.000  3.720  0.00  0.00   0.000  0.00
1:LYS+_23:HD1      1:LYS+_23:HE2       1.700  7.000  3.720  0.00  0.00   0.000  0.00
1:LYS+_23:HE1      1:LYS+_23:HD2       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LYS+_23:HE2      1:LYS+_23:HD2       1.700  7.000  4.010  0.00  0.00   0.000  0.00
1:LYS+_23:HD1      1:LYS+_23:HG1      -1.000  6.360  4.660  0.00  0.00   0.000  0.00
1:LYS+_23:HD1      1:LYS+_23:HG2      -1.000  6.360  4.660  0.00  0.00   0.000  0.00
1:LYS+_23:HD2      1:LYS+_23:HG1      -1.000  6.360  4.160  0.00  0.00   0.000  0.00
1:LYS+_23:HD2      1:LYS+_23:HG2      -1.000  6.360  4.660  0.00  0.00   0.000  0.00
1:LYS+_23:HE1      1:LYS+_23:HG1      -1.000  6.510  4.810  0.00  0.00   0.000  0.00
1:LYS+_23:HE1      1:LYS+_23:HG2      -1.000  6.510  4.810  0.00  0.00   0.000  0.00
1:LYS+_23:HE2      1:LYS+_23:HG1      -1.000  6.510  4.800  0.00  0.00   0.000  0.00
1:LYS+_23:HE2      1:LYS+_23:HG2      -1.000  6.510  4.810  0.00  0.00   0.000  0.00
1:LYS+_23:HG1      1:ILE_19:HG12      -1.000  8.420  5.020  0.00  0.00   0.000  0.00
1:LYS+_23:HG1      1:ILE_19:HG11      -1.000  8.420  5.020  0.00  0.00   0.000  0.00
1:LYS+_23:HG2      1:ILE_19:HG12      -1.000  8.420  5.020  0.00  0.00   0.000  0.00
1:LYS+_23:HG2      1:ILE_19:HG11      -1.000  8.420  5.020  0.00  0.00   0.000  0.00
1:LYS+_40:HA       1:LYS+_40:HB1       1.700  4.010  4.010  0.00  0.00   0.000  0.00
1:LYS+_40:HA       1:LYS+_40:HB2       1.700  4.010  3.720  0.00  0.00   0.000  0.00
1:LYS+_40:HA       1:LYS+_40:HG1       1.830  4.560  4.560  0.00  0.00   0.000  0.00
1:LYS+_40:HA       1:LYS+_40:HG2       1.830  4.560  3.790  0.00  0.00   0.000  0.00
1:LYS+_40:HB1      1:LYS+_40:HB2      -1.000  6.480  3.080  0.00  0.00   0.000  0.00
1:LYS+_40:HB1      1:LYS+_40:HG1       1.700  4.250  4.250  0.00  0.00   0.000  0.00
1:LYS+_40:HB1      1:LYS+_40:HG2       1.700  4.250  3.720  0.00  0.00   0.000  0.00
1:LYS+_40:HB2      1:LYS+_40:HG1       1.700  4.250  4.040  0.00  0.00   0.000  0.00
1:LYS+_40:HB2      1:LYS+_40:HG2       1.700  4.250  3.720  0.00  0.00   0.000  0.00
1:LYS+_40:HD*      1:LYS+_40:HE*       1.700  5.500  5.500  0.00  0.00   0.000  0.00
1:LYS+_40:HD*      1:LYS+_40:HG1       1.700  4.640  4.170  0.00  0.00   0.000  0.00
1:LYS+_40:HD*      1:LYS+_40:HG2       1.700  4.640  4.640  0.00  0.00   0.000  0.00
1:LYS+_40:HE*      1:LYS+_40:HA        1.700  6.030  6.030  0.00  0.00   0.000  0.00
1:LYS+_40:HE*      1:LYS+_40:HG1       1.810  5.090  5.090  0.00  0.00   0.000  0.00
1:LYS+_40:HE*      1:LYS+_40:HG2       1.810  5.090  4.990  0.00  0.00   0.000  0.00
1:LYS+_55:HA       1:LYS+_55:HB2       1.830  4.050  3.720  0.00  0.00   0.000  0.00
1:LYS+_55:HB1      1:LYS+_55:HA        1.830  4.050  4.050  0.00  0.00   0.000  0.00
1:LYS+_55:HA       1:LYS+_55:HG*       1.970  4.910  4.910  0.00  0.00   0.000  0.00
1:LYS+_55:HA       1:LEU_58:HB*        2.190  5.460  5.460  0.00  0.00   0.000  0.00
1:LYS+_55:HA       1:LEU_58:HD2*      -1.000  6.940  4.540  0.00  0.00   0.000  0.00
1:LYS+_55:HA       1:LEU_58:HD1*      -1.000  6.940  4.540  0.00  0.00   0.000  0.00
1:LYS+_55:HB1      1:LYS+_55:HG*       1.700  4.660  4.370  0.00  0.00   0.000  0.00
1:LYS+_55:HB2      1:LYS+_55:HG*       1.700  4.660  4.660  0.00  0.00   0.000  0.00
1:LYS+_55:HD1      1:LYS+_55:HE*       1.700  5.470  4.720  0.00  0.00   0.000  0.00
1:LYS+_55:HD2      1:LYS+_55:HE*       1.700  5.470  5.470  0.00  0.00   0.000  0.00
1:LYS+_55:HD1      1:LYS+_55:HG*       1.700  4.630  4.550  0.00  0.00   0.000  0.00
1:LYS+_55:HD2      1:LYS+_55:HG*       1.700  4.630  4.630  0.00  0.00   0.000  0.00
1:LYS+_55:HD2      1:LYS+_55:HA       -1.000  7.030  5.330  0.00  0.00   0.000  0.00
1:LYS+_55:HD1      1:LYS+_55:HA       -1.000  7.030  5.330  0.00  0.00   0.000  0.00
1:LYS+_55:HE*      1:LYS+_55:HA        2.040  5.160  5.160  0.00  0.00   0.000  0.00
1:LYS+_55:HE*      1:LYS+_55:HG*       2.000  5.700  5.700  0.00  0.00   0.000  0.00
1:LYS+_55:HE*      1:THR_54:HG2*       2.210  6.490  6.490  0.00  0.00   0.000  0.00
1:LYS+_87:HA       1:LYS+_87:HB1       1.700  4.000  4.000  0.00  0.00   0.000  0.00
1:LYS+_87:HA       1:LYS+_87:HB2       1.700  4.000  3.720  0.00  0.00   0.000  0.00
1:LYS+_87:HA       1:LYS+_87:HG1       1.710  3.940  3.550  0.00  0.00   0.000  0.00
1:LYS+_87:HA       1:LYS+_87:HG2       1.710  3.940  3.940  0.00  0.00   0.000  0.00
1:LYS+_87:HB1      1:LYS+_87:HB2      -1.000  6.260  2.860  0.00  0.00   0.000  0.00
1:LYS+_87:HB1      1:LYS+_87:HG1       1.730  4.270  3.750  0.00  0.00   0.000  0.00
1:LYS+_87:HB1      1:LYS+_87:HG2       1.730  4.270  3.940  0.00  0.00   0.000  0.00
1:LYS+_87:HB2      1:LYS+_87:HG1       1.730  4.270  3.720  0.00  0.00   0.000  0.00
1:LYS+_87:HB2      1:LYS+_87:HG2       1.730  4.270  4.270  0.00  0.00   0.000  0.00
1:LYS+_87:HG1      1:LYS+_87:HG2      -1.000  6.120  2.720  0.00  0.00   0.000  0.00
1:LEU_14:HA        1:LEU_14:HB1        1.760  3.870  3.720  0.00  0.00   0.000  0.00
1:LEU_14:HA        1:LEU_14:HB2        1.760  3.870  3.870  0.00  0.00   0.000  0.00
1:LEU_14:HA        1:LEU_14:HD1*       1.920  5.060  5.060  0.00  0.00   0.000  0.00
1:LEU_14:HA        1:LEU_14:HD2*       1.920  5.060  4.120  0.00  0.00   0.000  0.00
1:LEU_14:HA        1:LEU_14:HG         1.800  3.810  3.810  0.00  0.00   0.000  0.00
1:LEU_14:HB1       1:LEU_14:HB2       -1.000  6.570  3.170  0.00  0.00   0.000  0.00
1:LEU_14:HB1       1:LEU_14:HD1*       1.700  4.850  4.510  0.00  0.00   0.000  0.00
1:LEU_14:HB1       1:LEU_14:HD2*       1.700  4.850  4.610  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:LEU_14:HB2        1.700  4.850  4.850  0.00  0.00   0.000  0.00
1:LEU_14:HB2       1:LEU_14:HD2*       1.700  4.850  4.790  0.00  0.00   0.000  0.00
1:LEU_14:HB1       1:LEU_14:HG        -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:LEU_14:HB2       1:LEU_14:HG        -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:ALA_10:HB*        1.700  6.780  6.780  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:ALA_10:HB*        1.700  6.780  6.080  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:ILE_19:HA        -1.000  8.460  6.060  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:ILE_19:HA        -1.000  8.460  6.060  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:LEU_79:HD1*      -1.000 10.930  6.130  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:LEU_79:HD2*      -1.000 10.930  6.130  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:LEU_79:HD1*      -1.000 10.930  6.130  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:LEU_79:HD2*      -1.000 10.930  6.130  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:ARG+_11:HA       -1.000  8.090  5.690  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:ARG+_11:HA       -1.000  8.090  5.690  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:LEU_14:HD1*      -1.000  9.730  4.930  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:LEU_14:HG         1.700  4.120  4.120  0.00  0.00   0.000  0.00
1:LEU_14:HG        1:LEU_14:HD1*       1.700  4.120  4.120  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:MET_86:HE*       -1.000  7.620  5.220  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:MET_86:HE*       -1.000  7.620  5.220  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:VAL_83:HA        -1.000  7.650  5.250  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:VAL_83:HA        -1.000  7.650  5.250  0.00  0.00   0.000  0.00
1:LEU_14:HG        1:VAL_83:HG2*      -1.000  6.820  4.420  0.00  0.00   0.000  0.00
1:LEU_14:HG        1:VAL_83:HG1*      -1.000  6.820  4.420  0.00  0.00   0.000  0.00
1:LEU_42:HA        1:LEU_42:HB1        1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:LEU_42:HA        1:LEU_42:HB2        1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:LEU_42:HB1       1:LEU_42:HB2       -1.000  6.550  3.150  0.00  0.00   0.000  0.00
1:LEU_42:HB2       1:THR_39:HA         2.120  4.470  3.980  0.00  0.00   0.000  0.00
1:THR_39:HA        1:LEU_42:HB1        2.120  4.470  4.470  0.00  0.00   0.000  0.00
1:LEU_42:HD2*      1:ILE_37:HD1*      -1.000  9.360  6.960  0.00  0.00   0.000  0.00
1:LEU_42:HD1*      1:ILE_37:HD1*      -1.000  9.360  6.960  0.00  0.00   0.000  0.00
1:LEU_42:HD2*      1:ILE_37:HG1*      -1.000  9.600  7.200  0.00  0.00   0.000  0.00
1:LEU_42:HD1*      1:ILE_37:HG1*      -1.000  9.600  7.200  0.00  0.00   0.000  0.00
1:LEU_42:HD2*      1:THR_39:HG2*      -1.000  9.230  6.830  0.00  0.00   0.000  0.00
1:LEU_42:HD1*      1:THR_39:HG2*      -1.000  9.230  6.830  0.00  0.00   0.000  0.00
1:LEU_42:HG        1:LEU_42:HB2       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:LEU_42:HG        1:LEU_42:HB1       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:LEU_49:HA        1:LEU_49:HD1*       1.700  6.160  5.290  0.00  0.00   0.000  0.00
1:LEU_49:HD2*      1:LEU_49:HA         1.700  6.160  6.160  0.00  0.00   0.000  0.00
1:LEU_49:HD2*      1:MET_46:HA        -1.000  7.660  5.260  0.00  0.00   0.000  0.00
1:LEU_49:HD1*      1:MET_46:HA        -1.000  7.660  5.260  0.00  0.00   0.000  0.00
1:LEU_49:HD2*      1:MET_46:HG1       -1.000  9.400  6.200  0.00  0.00   0.000  0.00
1:MET_46:HG2       1:LEU_49:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_49:HD1*      1:MET_46:HG1       -1.000  9.400  6.200  0.00  0.00   0.000  0.00
1:LEU_49:HD1*      1:MET_46:HG2       -1.000  9.400  6.200  0.00  0.00   0.000  0.00
1:LEU_58:HD1*      1:LEU_58:HA         2.050  4.850  4.070  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:LEU_58:HA         2.050  4.850  4.850  0.00  0.00   0.000  0.00
1:LEU_58:HD1*      1:LEU_58:HG         2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:LEU_58:HG         2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:LEU_58:HD1*      1:PRO_53:HB2       -1.000  7.600  5.200  0.00  0.00   0.000  0.00
1:PRO_53:HB1       1:LEU_58:HD1*      -1.000  7.600  5.020  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:PRO_53:HB2       -1.000  7.600  5.200  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:PRO_53:HB1       -1.000  7.600  5.200  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:LEU_58:HB*       -1.000  7.860  5.460  0.00  0.00   0.000  0.00
1:LEU_58:HD1*      1:LEU_58:HB*       -1.000  7.860  5.460  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:THR_39:HB        -1.000  7.200  4.800  0.00  0.00   0.000  0.00
1:LEU_58:HD1*      1:THR_39:HB        -1.000  7.200  4.800  0.00  0.00   0.000  0.00
1:LEU_58:HD2*      1:THR_39:HG2*      -1.000  7.830  5.430  0.00  0.00   0.000  0.00
1:LEU_58:HD1*      1:THR_39:HG2*      -1.000  7.830  5.430  0.00  0.00   0.000  0.00
1:LEU_58:HG        1:LEU_58:HA         2.120  4.310  4.310  0.00  0.00   0.000  0.00
1:LEU_58:HG        1:LEU_58:HB*        1.830  4.720  4.720  0.00  0.00   0.000  0.00
1:LEU_79:HA        1:LEU_79:HB1        1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:LEU_79:HA        1:LEU_79:HB2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_79:HA        1:LEU_79:HD2*       1.700  5.900  4.240  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:LEU_79:HA         1.700  5.900  5.900  0.00  0.00   0.000  0.00
1:LEU_79:HA        1:LEU_79:HG         1.950  3.830  3.830  0.00  0.00   0.000  0.00
1:LEU_79:HA        1:MET_82:HG2       -1.000  5.800  4.100  0.00  0.00   0.000  0.00
1:LEU_79:HA        1:MET_82:HG1       -1.000  5.800  4.100  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:LEU_79:HD2*      -1.000 10.260  5.460  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:MET_82:HG2       -1.000 10.500  6.400  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:MET_82:HG1       -1.000 10.500  6.400  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:MET_82:HG2       -1.000 10.500  6.400  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:MET_82:HG1       -1.000 10.500  6.400  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:VAL_83:HB        -1.000  7.970  5.570  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:VAL_83:HB        -1.000  7.970  5.570  0.00  0.00   0.000  0.00
1:LEU_79:HG        1:LEU_79:HB1       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:LEU_79:HG        1:LEU_79:HB2       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:LEU_79:HG        1:LEU_79:HD1*       1.700  4.560  4.360  0.00  0.00   0.000  0.00
1:LEU_79:HG        1:LEU_79:HD2*       1.700  4.560  4.560  0.00  0.00   0.000  0.00
1:MET_18:HA        1:MET_18:HB1        1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:MET_18:HB2       1:MET_18:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_18:HB1       1:MET_18:HB2       -1.000  6.560  3.160  0.00  0.00   0.000  0.00
1:MET_18:HB2       1:MET_18:HG2        1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:MET_18:HB2       1:MET_18:HG1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_18:HG2       1:MET_18:HB1        1.700  6.000  4.100  0.00  0.00   0.000  0.00
1:MET_18:HG1       1:MET_18:HB1        1.700  6.000  3.960  0.00  0.00   0.000  0.00
1:MET_18:HG1       1:MET_18:HA         1.760  4.070  3.940  0.00  0.00   0.000  0.00
1:MET_18:HG2       1:MET_18:HA         1.760  4.070  4.070  0.00  0.00   0.000  0.00
1:MET_28:HA        1:MET_28:HB1        1.780  3.840  3.720  0.00  0.00   0.000  0.00
1:MET_28:HA        1:MET_28:HB2        1.780  3.840  3.840  0.00  0.00   0.000  0.00
1:MET_28:HA        1:MET_28:HG1        1.800  4.070  3.800  0.00  0.00   0.000  0.00
1:MET_28:HA        1:MET_28:HG2        1.800  4.070  4.070  0.00  0.00   0.000  0.00
1:MET_46:HA        1:MET_46:HB1        1.700  3.930  3.720  0.00  0.00   0.000  0.00
1:MET_46:HA        1:MET_46:HB2        1.700  3.930  3.930  0.00  0.00   0.000  0.00
1:MET_46:HA        1:MET_46:HG1        1.730  4.140  4.140  0.00  0.00   0.000  0.00
1:MET_46:HA        1:MET_46:HG2        1.730  4.140  3.940  0.00  0.00   0.000  0.00
1:MET_46:HB1       1:MET_46:HB2       -1.000  6.490  3.090  0.00  0.00   0.000  0.00
1:MET_46:HB1       1:MET_46:HG1        1.700  6.000  3.990  0.00  0.00   0.000  0.00
1:MET_46:HB1       1:MET_46:HG2        1.700  6.000  3.740  0.00  0.00   0.000  0.00
1:MET_46:HB2       1:MET_46:HG1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_46:HG2       1:MET_46:HB2        1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:MET_46:HE*       1:MET_46:HA         1.700  5.630  5.630  0.00  0.00   0.000  0.00
1:MET_46:HG1       1:MET_46:HG2       -1.000  6.190  2.790  0.00  0.00   0.000  0.00
1:MET_48:HA        1:MET_48:HG1        1.770  4.270  4.140  0.00  0.00   0.000  0.00
1:MET_48:HA        1:MET_48:HG2        1.770  4.270  4.270  0.00  0.00   0.000  0.00
1:MET_48:HB1       1:MET_48:HA         1.700  3.840  3.720  0.00  0.00   0.000  0.00
1:MET_48:HB2       1:MET_48:HA         1.700  3.840  3.840  0.00  0.00   0.000  0.00
1:MET_48:HB1       1:MET_48:HB2       -1.000  6.390  2.990  0.00  0.00   0.000  0.00
1:MET_48:HB1       1:MET_48:HG2        1.700  6.000  3.820  0.00  0.00   0.000  0.00
1:MET_48:HG1       1:MET_48:HB1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_48:HG2       1:MET_48:HB2        1.700  6.000  4.120  0.00  0.00   0.000  0.00
1:MET_48:HG1       1:MET_48:HB2        1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:MET_48:HB2       -1.000  7.630  5.930  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:MET_48:HB1       -1.000  7.630  5.930  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:MET_48:HG1        1.700  5.260  4.830  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:MET_48:HG2        1.700  5.260  5.260  0.00  0.00   0.000  0.00
1:MET_48:HG1       1:MET_48:HG2       -1.000  6.600  3.200  0.00  0.00   0.000  0.00
1:MET_81:HA        1:MET_81:HB1        1.700  4.090  3.720  0.00  0.00   0.000  0.00
1:MET_81:HB2       1:MET_81:HA         1.700  4.090  4.090  0.00  0.00   0.000  0.00
1:MET_81:HA        1:MET_81:HG1        1.700  4.160  4.160  0.00  0.00   0.000  0.00
1:MET_81:HG2       1:MET_81:HA         1.700  4.160  3.820  0.00  0.00   0.000  0.00
1:MET_81:HA        1:ARG+_84:HB*       1.960  4.980  4.980  0.00  0.00   0.000  0.00
1:MET_81:HA        1:VAL_80:HG1*      -1.000  6.950  4.550  0.00  0.00   0.000  0.00
1:MET_81:HA        1:VAL_80:HG2*      -1.000  6.950  4.550  0.00  0.00   0.000  0.00
1:MET_81:HB1       1:MET_81:HB2       -1.000  6.820  3.420  0.00  0.00   0.000  0.00
1:MET_81:HB1       1:MET_81:HE*       -1.000  6.550  4.850  0.00  0.00   0.000  0.00
1:MET_81:HB2       1:MET_81:HE*       -1.000  6.550  4.850  0.00  0.00   0.000  0.00
1:MET_81:HB1       1:MET_81:HG1       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:MET_81:HB1       1:MET_81:HG2       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:MET_81:HB2       1:MET_81:HG1       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:MET_81:HG2       1:MET_81:HB2       -1.000  5.420  3.770  0.00  0.00   0.000  0.00
1:MET_81:HE*       1:MET_81:HG2        1.780  5.060  4.750  0.00  0.00   0.000  0.00
1:MET_81:HG1       1:MET_81:HE*        1.780  5.060  5.060  0.00  0.00   0.000  0.00
1:MET_81:HG1       1:MET_81:HG2       -1.000  6.590  3.190  0.00  0.00   0.000  0.00
1:MET_82:HA        1:MET_82:HB2        1.700  6.000  3.720  0.00  0.00   0.000  0.00
1:MET_82:HA        1:MET_82:HB1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_82:HA        1:MET_82:HG1        2.010  4.020  4.020  0.00  0.00   0.000  0.00
1:MET_82:HA        1:MET_82:HG2        2.010  4.020  3.950  0.00  0.00   0.000  0.00
1:MET_82:HA        1:GLN_85:HB2       -1.000  6.400  4.700  0.00  0.00   0.000  0.00
1:MET_82:HA        1:GLN_85:HB1       -1.000  6.400  4.700  0.00  0.00   0.000  0.00
1:MET_82:HB1       1:MET_82:HB2       -1.000  6.610  3.210  0.00  0.00   0.000  0.00
1:MET_82:HB1       1:MET_82:HG1        1.700  3.870  3.750  0.00  0.00   0.000  0.00
1:MET_82:HB1       1:MET_82:HG2        1.700  3.870  3.720  0.00  0.00   0.000  0.00
1:MET_82:HB2       1:MET_82:HG1        1.700  3.870  3.720  0.00  0.00   0.000  0.00
1:MET_82:HG2       1:MET_82:HB2        1.700  3.870  3.870  0.00  0.00   0.000  0.00
1:MET_82:HG1       1:MET_82:HG2       -1.000  6.830  3.430  0.00  0.00   0.000  0.00
1:MET_86:HA        1:MET_86:HB1        1.710  4.000  4.000  0.00  0.00   0.000  0.00
1:MET_86:HA        1:MET_86:HB2        1.710  4.000  3.720  0.00  0.00   0.000  0.00
1:MET_86:HA        1:MET_86:HG1        1.790  3.890  3.560  0.00  0.00   0.000  0.00
1:MET_86:HA        1:MET_86:HG2        1.790  3.890  3.890  0.00  0.00   0.000  0.00
1:MET_86:HB1       1:MET_86:HB2       -1.000  6.430  3.030  0.00  0.00   0.000  0.00
1:MET_86:HB1       1:MET_86:HG1        1.700  3.930  3.930  0.00  0.00   0.000  0.00
1:MET_86:HB1       1:MET_86:HG2        1.700  3.930  3.720  0.00  0.00   0.000  0.00
1:MET_86:HB2       1:MET_86:HG1        1.700  3.930  3.870  0.00  0.00   0.000  0.00
1:MET_86:HB2       1:MET_86:HG2        1.700  3.930  3.890  0.00  0.00   0.000  0.00
1:MET_86:HB1       1:VAL_83:HA         1.870  4.480  3.800  0.00  0.00   0.000  0.00
1:MET_86:HB2       1:VAL_83:HA         1.870  4.480  4.480  0.00  0.00   0.000  0.00
1:MET_86:HE*       1:PHE_13:HB1        1.700  5.740  5.400  0.00  0.00   0.000  0.00
1:MET_86:HE*       1:PHE_13:HB2        1.700  5.740  5.740  0.00  0.00   0.000  0.00
1:MET_86:HE*       1:MET_86:HG1        1.750  4.760  4.760  0.00  0.00   0.000  0.00
1:MET_86:HE*       1:MET_86:HG2        1.750  4.760  4.490  0.00  0.00   0.000  0.00
1:MET_86:HE*       1:VAL_83:HA         2.160  5.390  5.390  0.00  0.00   0.000  0.00
1:MET_86:HG1       1:MET_86:HG2       -1.000  6.100  2.700  0.00  0.00   0.000  0.00
1:MET_86:HG2       1:VAL_83:HA        -1.000  5.870  4.170  0.00  0.00   0.000  0.00
1:MET_86:HG1       1:VAL_83:HA        -1.000  5.870  4.170  0.00  0.00   0.000  0.00
1:ASN_52:HA        1:ASN_52:HB1        1.820  3.750  3.720  0.00  0.00   0.000  0.00
1:ASN_52:HA        1:ASN_52:HB2        1.820  3.750  3.750  0.00  0.00   0.000  0.00
1:ASN_52:HA        1:PRO_53:HD1        1.800  2.600  2.600  0.00  0.00   0.000  0.00
1:ASN_52:HA        1:PRO_53:HD2        1.700  2.280  2.280  0.00  0.00   0.000  0.00
1:ASN_52:HB1       1:ASN_52:HB2       -1.000  6.140  2.740  0.00  0.00   0.000  0.00
1:PRO_53:HA        1:PRO_53:HB1        1.700  3.800  3.720  0.00  0.00   0.000  0.00
1:PRO_53:HA        1:PRO_53:HB2        1.700  3.800  3.800  0.00  0.00   0.000  0.00
1:PRO_53:HA        1:PRO_53:HG*        1.700  5.890  5.890  0.00  0.00   0.000  0.00
1:PRO_53:HB1       1:PRO_53:HB2       -1.000  6.520  3.120  0.00  0.00   0.000  0.00
1:PRO_53:HD1       1:PRO_53:HD2        1.700  2.160  2.160  0.00  0.00   0.000  0.00
1:GLN_51:HA        1:GLN_51:HB1        1.750  3.720  3.720  0.00  0.00   0.000  0.00
1:GLN_51:HB2       1:GLN_51:HA         1.750  3.720  3.720  0.00  0.00   0.000  0.00
1:GLN_51:HB2       1:GLN_51:HB1       -1.000  6.410  3.010  0.00  0.00   0.000  0.00
1:GLN_51:HG1       1:GLN_51:HB1       -1.000  5.490  3.790  0.00  0.00   0.000  0.00
1:GLN_51:HG1       1:GLN_51:HB2       -1.000  5.490  3.790  0.00  0.00   0.000  0.00
1:GLN_51:HG2       1:GLN_51:HB1       -1.000  5.490  3.720  0.00  0.00   0.000  0.00
1:GLN_51:HG2       1:GLN_51:HB2       -1.000  5.490  3.790  0.00  0.00   0.000  0.00
1:GLN_51:HG2       1:GLN_51:HA         1.700  6.000  4.080  0.00  0.00   0.000  0.00
1:GLN_51:HG1       1:GLN_51:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HA         1:GLN_6:HB2         1.760  4.060  3.720  0.00  0.00   0.000  0.00
1:GLN_6:HB1        1:GLN_6:HA          1.760  4.060  4.060  0.00  0.00   0.000  0.00
1:GLN_6:HB1        1:GLN_6:HB2        -1.000  6.520  3.120  0.00  0.00   0.000  0.00
1:GLN_6:HB1        1:GLN_6:HG2        -1.000  5.820  4.230  0.00  0.00   0.000  0.00
1:GLN_6:HB1        1:GLN_6:HG1        -1.000  5.820  4.230  0.00  0.00   0.000  0.00
1:GLN_6:HB2        1:GLN_6:HG2        -1.000  5.820  4.120  0.00  0.00   0.000  0.00
1:GLN_6:HB2        1:GLN_6:HG1        -1.000  5.820  3.720  0.00  0.00   0.000  0.00
1:GLN_6:HB1        1:VAL_80:HG1*      -1.000  7.980  5.580  0.00  0.00   0.000  0.00
1:GLN_6:HB1        1:VAL_80:HG2*      -1.000  7.980  5.580  0.00  0.00   0.000  0.00
1:GLN_6:HB2        1:VAL_80:HG1*      -1.000  7.980  5.510  0.00  0.00   0.000  0.00
1:GLN_6:HB2        1:VAL_80:HG2*      -1.000  7.980  5.580  0.00  0.00   0.000  0.00
1:GLN_6:HG1        1:VAL_80:HG2*      -1.000  8.220  4.120  0.00  0.00   0.000  0.00
1:GLN_6:HG1        1:VAL_80:HG1*      -1.000  8.220  4.120  0.00  0.00   0.000  0.00
1:GLN_6:HG2        1:VAL_80:HG2*      -1.000  8.220  4.120  0.00  0.00   0.000  0.00
1:GLN_6:HG2        1:VAL_80:HG1*      -1.000  8.220  4.120  0.00  0.00   0.000  0.00
1:GLN_6:HG2        1:GLN_6:HG1        -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:GLN_85:HA        1:GLN_85:HB2       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLN_85:HA        1:GLN_85:HB1       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:GLN_85:HG1       1:GLN_85:HG2       -1.000  6.240  2.840  0.00  0.00   0.000  0.00
1:GLN_85:HG2       1:GLN_85:HB2       -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLN_85:HG2       1:GLN_85:HB1       -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLN_85:HG1       1:GLN_85:HB2       -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:GLN_85:HG1       1:GLN_85:HB1       -1.000  7.120  3.720  0.00  0.00   0.000  0.00
1:ARG+_47:HA       1:ARG+_47:HB2       1.700  7.000  3.720  0.00  0.00   0.000  0.00
1:ARG+_47:HB1      1:ARG+_47:HA        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HB*      1:ARG+_84:HG1      -1.000  6.350  4.650  0.00  0.00   0.000  0.00
1:ARG+_84:HB*      1:ARG+_84:HG2      -1.000  6.350  4.650  0.00  0.00   0.000  0.00
1:ARG+_84:HD1      1:ARG+_84:HG1       1.700  4.020  4.020  0.00  0.00   0.000  0.00
1:ARG+_84:HD1      1:ARG+_84:HG2       1.700  4.020  3.730  0.00  0.00   0.000  0.00
1:ARG+_84:HD2      1:ARG+_84:HG1       1.700  4.020  3.960  0.00  0.00   0.000  0.00
1:ARG+_84:HD2      1:ARG+_84:HG2       1.700  4.020  3.720  0.00  0.00   0.000  0.00
1:ARG+_84:HD1      1:VAL_80:HG1*      -1.000  7.540  5.090  0.00  0.00   0.000  0.00
1:ARG+_84:HD1      1:VAL_80:HG2*      -1.000  7.540  5.090  0.00  0.00   0.000  0.00
1:ARG+_84:HD2      1:VAL_80:HG1*      -1.000  7.540  5.140  0.00  0.00   0.000  0.00
1:ARG+_84:HD2      1:VAL_80:HG2*      -1.000  7.540  5.090  0.00  0.00   0.000  0.00
1:ARG+_84:HG1      1:ARG+_84:HA        1.760  2.930  2.800  0.00  0.00   0.000  0.00
1:ARG+_84:HG2      1:ARG+_84:HA        1.760  2.930  2.930  0.00  0.00   0.000  0.00
1:ARG+_84:HG1      1:ARG+_84:HG2      -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:SER_15:HA        1:SER_15:HB1        1.800  3.720  3.720  0.00  0.00   0.000  0.00
1:SER_15:HA        1:SER_15:HB2        1.800  3.720  3.720  0.00  0.00   0.000  0.00
1:SER_15:HB1       1:SER_15:HB2       -1.000  6.320  2.920  0.00  0.00   0.000  0.00
1:SER_38:HA        1:ILE_62:HD1*       1.940  5.120  5.120  0.00  0.00   0.000  0.00
1:SER_38:HA        1:SER_38:HB1        1.750  3.720  3.720  0.00  0.00   0.000  0.00
1:SER_38:HA        1:SER_38:HB2        1.750  3.720  3.720  0.00  0.00   0.000  0.00
1:SER_38:HA        1:THR_72:HB         1.900  4.040  4.040  0.00  0.00   0.000  0.00
1:SER_38:HA        1:THR_72:HG2*       2.630  4.010  4.010  0.00  0.00   0.000  0.00
1:SER_38:HB1       1:SER_38:HB2       -1.000  6.560  3.160  0.00  0.00   0.000  0.00
1:SER_38:HB1       1:THR_72:HG2*       1.700  4.660  4.620  0.00  0.00   0.000  0.00
1:SER_38:HB2       1:THR_72:HG2*       1.700  4.660  4.660  0.00  0.00   0.000  0.00
1:SER_70:HA        1:GLY_69:HA2       -1.000  5.960  4.260  0.00  0.00   0.000  0.00
1:SER_70:HA        1:GLY_69:HA1       -1.000  5.960  4.260  0.00  0.00   0.000  0.00
1:SER_70:HA        1:SER_70:HB1       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:SER_70:HA        1:SER_70:HB2       -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:SER_70:HB2       1:SER_70:HB1       -1.000  5.560  2.160  0.00  0.00   0.000  0.00
1:THR_39:HA        1:THR_39:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:THR_39:HA        1:THR_39:HG2*       2.230  4.350  4.350  0.00  0.00   0.000  0.00
1:THR_39:HB        1:THR_39:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:THR_39:HG2*      1:LEU_58:HB*        2.660  5.990  5.990  0.00  0.00   0.000  0.00
1:THR_44:HA        1:THR_44:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:THR_44:HA        1:THR_44:HG2*       2.230  4.170  4.170  0.00  0.00   0.000  0.00
1:THR_44:HB        1:THR_44:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:THR_44:HG2*      1:VAL_45:HA         3.090  5.640  5.640  0.00  0.00   0.000  0.00
1:THR_54:HA        1:THR_54:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:THR_54:HA        1:THR_54:HG2*       2.210  4.300  4.300  0.00  0.00   0.000  0.00
1:THR_54:HB        1:THR_54:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:THR_72:HA        1:THR_72:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:THR_72:HA        1:THR_72:HG2*       2.340  4.500  4.500  0.00  0.00   0.000  0.00
1:THR_72:HB        1:THR_72:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_45:HB        1:VAL_45:HA         1.830  3.770  3.770  0.00  0.00   0.000  0.00
1:VAL_45:HB        1:VAL_45:HG1*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_45:HB        1:VAL_45:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_45:HG1*      1:PHE_29:HA        -1.000  7.120  4.720  0.00  0.00   0.000  0.00
1:VAL_45:HG2*      1:PHE_29:HA        -1.000  7.120  4.720  0.00  0.00   0.000  0.00
1:VAL_45:HG1*      1:VAL_45:HA         2.390  4.660  4.660  0.00  0.00   0.000  0.00
1:VAL_45:HG2*      1:VAL_45:HA         2.390  4.660  4.580  0.00  0.00   0.000  0.00
1:VAL_45:HG2*      1:VAL_45:HG1*      -1.000  9.830  5.030  0.00  0.00   0.000  0.00
1:VAL_65:HA        1:VAL_65:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:VAL_65:HG1*      1:ILE_62:HG2*      -1.000  8.710  6.310  0.00  0.00   0.000  0.00
1:VAL_65:HG2*      1:ILE_62:HG2*      -1.000  8.710  6.310  0.00  0.00   0.000  0.00
1:VAL_65:HG1*      1:ILE_73:HG2*      -1.000  8.080  5.680  0.00  0.00   0.000  0.00
1:VAL_65:HG2*      1:ILE_73:HG2*      -1.000  8.080  5.680  0.00  0.00   0.000  0.00
1:VAL_65:HG1*      1:MET_81:HE*       -1.000  8.460  6.060  0.00  0.00   0.000  0.00
1:VAL_65:HG2*      1:MET_81:HE*       -1.000  8.460  6.060  0.00  0.00   0.000  0.00
1:VAL_65:HG1*      1:VAL_65:HB         2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_65:HG2*      1:VAL_65:HB         2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_65:HG2*      1:VAL_65:HA         1.700  7.000  4.870  0.00  0.00   0.000  0.00
1:VAL_65:HG1*      1:VAL_65:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:VAL_80:HA        1:VAL_80:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:VAL_80:HA        1:VAL_80:HG1*       2.260  4.090  4.090  0.00  0.00   0.000  0.00
1:VAL_80:HA        1:VAL_80:HG2*       2.260  4.090  3.990  0.00  0.00   0.000  0.00
1:VAL_80:HA        1:VAL_83:HB         1.950  3.520  3.520  0.00  0.00   0.000  0.00
1:VAL_80:HA        1:VAL_83:HG1*       1.870  4.870  4.870  0.00  0.00   0.000  0.00
1:VAL_80:HA        1:VAL_83:HG2*       1.870  4.870  4.800  0.00  0.00   0.000  0.00
1:VAL_80:HB        1:GLU-_77:HA        1.820  4.080  4.080  0.00  0.00   0.000  0.00
1:VAL_80:HB        1:VAL_80:HG1*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_80:HB        1:VAL_80:HG2*       2.080  4.120  4.120  0.00  0.00   0.000  0.00
1:VAL_80:HG1*      1:ARG+_84:HG2      -1.000  9.400  5.300  0.00  0.00   0.000  0.00
1:VAL_80:HG1*      1:ARG+_84:HG1      -1.000  9.400  5.300  0.00  0.00   0.000  0.00
1:VAL_80:HG2*      1:ARG+_84:HG2      -1.000  9.400  5.300  0.00  0.00   0.000  0.00
1:VAL_80:HG2*      1:ARG+_84:HG1      -1.000  9.400  5.300  0.00  0.00   0.000  0.00
1:VAL_80:HG1*      1:VAL_80:HG2*      -1.000  9.800  5.000  0.00  0.00   0.000  0.00
1:VAL_80:HG2*      1:GLN_7:HA         -1.000  6.700  4.300  0.00  0.00   0.000  0.00
1:VAL_80:HG1*      1:GLN_7:HA         -1.000  6.700  4.300  0.00  0.00   0.000  0.00
1:VAL_83:HA        1:VAL_83:HB         1.830  3.720  3.720  0.00  0.00   0.000  0.00
1:VAL_83:HA        1:VAL_83:HG1*       1.700  4.380  4.380  0.00  0.00   0.000  0.00
1:VAL_83:HA        1:VAL_83:HG2*       1.700  4.380  4.240  0.00  0.00   0.000  0.00
1:VAL_83:HB        1:ALA_10:HB*        1.980  5.070  5.070  0.00  0.00   0.000  0.00
1:VAL_83:HB        1:VAL_83:HG1*       1.700  4.300  4.120  0.00  0.00   0.000  0.00
1:VAL_83:HB        1:VAL_83:HG2*       1.700  4.300  4.300  0.00  0.00   0.000  0.00
1:VAL_83:HG1*      1:VAL_83:HG2*      -1.000  9.680  4.880  0.00  0.00   0.000  0.00
1:ILE_62:HD1*      1:THR_39:HB         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LYS+_23:HE1      1:LYS+_23:HB*      -1.000  9.700  8.000  0.00  0.00   0.000  0.00
1:LYS+_23:HE2      1:LYS+_23:HB*      -1.000  9.700  8.000  0.00  0.00   0.000  0.00
1:ILE_73:HB        1:ILE_73:HG12      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_73:HB        1:ILE_73:HG11      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASP-_68:HB1      1:ASP-_68:HB2      -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:ILE_37:HB        1:ILE_73:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_37:HB        1:ILE_73:HB         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HB2      1:ASP-_27:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HB1      1:ASP-_27:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HB1       1:PRO_53:HD2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HB2       1:PRO_53:HD2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_61:HB        1:ILE_62:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_61:HB        1:ILE_61:HG11      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_61:HB        1:ILE_61:HG12      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_46:HG1       1:MET_46:HE*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_46:HG2       1:MET_46:HE*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLN_51:HG2       1:GLY_50:HA1       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HG2       1:GLY_50:HA2       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HG1       1:GLY_50:HA1       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HG1       1:GLY_50:HA2       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:MET_28:HB2       1:MET_28:HG2       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:MET_28:HB2       1:MET_28:HG1       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:MET_28:HB1       1:MET_28:HG2       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:MET_28:HB1       1:MET_28:HG1       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:PRO_53:HB2       1:PRO_53:HD1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PRO_53:HB1       1:PRO_53:HD1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PRO_53:HB2       1:PRO_53:HD2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PRO_53:HB1       1:PRO_53:HD2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_23:HB*      1:LYS+_23:HA        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LYS+_23:HB*      1:ILE_19:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLN_51:HB2       1:GLY_50:HA1       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HB2       1:GLY_50:HA2       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HB1       1:GLY_50:HA1       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HB1       1:GLY_50:HA2       -1.000  9.400  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HB*      1:ARG+_84:HD1      -1.000  9.700  8.000  0.00  0.00   0.000  0.00
1:ARG+_84:HB*      1:ARG+_84:HD2      -1.000  9.700  8.000  0.00  0.00   0.000  0.00
1:ARG+_47:HB2      1:ARG+_47:HD*      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HB1      1:ARG+_47:HD*      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:GLU-_63:HB1      1:ALA_60:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_63:HB2      1:ALA_60:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LYS+_40:HD*      1:LYS+_40:HA        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HG1      1:ARG+_47:HD*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HG2      1:ARG+_47:HD*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HG1      1:ARG+_47:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_47:HG2      1:ARG+_47:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_73:HG11      1:ILE_73:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_73:HG12      1:ILE_73:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LEU_58:HG        1:PRO_53:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LEU_58:HG        1:PRO_53:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LEU_58:HG        1:LYS+_55:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_42:HG        1:LEU_42:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HG        1:LEU_42:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HG        1:LEU_42:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:LEU_79:HB2       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:LEU_79:HB1       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:LEU_79:HB2       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:LEU_79:HB1       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HD1*      1:LEU_42:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HD2*      1:LEU_42:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HD2*      1:LEU_42:HB2       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HD2*      1:LEU_42:HB1       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HB2       1:LEU_42:HD1*      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HB1       1:LEU_42:HD1*      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:THR_72:HG2*      1:GLY_71:HA2       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:THR_72:HG2*      1:GLY_71:HA1       -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ALAC_90:HB*      1:ALAC_90:HA        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:VAL_45:HG1*       1.700  8.000  8.000  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:VAL_45:HG2*       1.700  8.000  8.000  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:VAL_45:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_48:HE*       1:MET_48:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_28:HE*       1:MET_28:HG1        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_28:HE*       1:MET_28:HG2        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_28:HE*       1:MET_28:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_18:HE*       1:LEU_14:HD2*      -1.000 10.400  8.000  0.00  0.00   0.000  0.00
1:MET_18:HE*       1:LEU_14:HD1*      -1.000 10.400  8.000  0.00  0.00   0.000  0.00
1:MET_86:HE*       1:MET_86:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_81:HE*       1:ILE_73:HG2*       1.700  8.000  8.000  0.00  0.00   0.000  0.00
1:MET_81:HE*       1:MET_81:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:ASP-_66:HB2      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ILE_62:HG2*      1:ASP-_66:HB1      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:ILE_73:HD1*       1.700  8.000  8.000  0.00  0.00   0.000  0.00
1:ILE_73:HD1*      1:ILE_73:HG12      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ILE_73:HD1*      1:ILE_73:HG11      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HD*      1:ARG+_47:HA        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:THR_44:HB        1:VAL_45:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:THR_44:HB        1:VAL_45:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:THR_39:HB        1:LEU_42:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:THR_39:HB        1:LEU_42:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:THR_44:HA        1:ARG+_47:HD*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:THR_44:HA        1:VAL_45:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:MET_18:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:MET_18:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_70:HB1       1:THR_72:HB        -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_70:HB2       1:THR_72:HB        -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:ILE_61:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HA        1:GLU-_63:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_61:HA        1:ALA_60:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PRO_53:HA        1:PRO_53:HD1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:ALA_25:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:PHE_29:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:PHE_29:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:THR_54:HA        1:LYS+_55:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HA       1:ARG+_84:HD1      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HA       1:ARG+_84:HD2      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:MET_81:HA        1:ARG+_84:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_81:HA        1:ARG+_84:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_67:HA       1:ASP-_68:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_46:HA        1:ARG+_47:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_40:HA       1:THR_39:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HA       1:PHE_22:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_13:HA        1:LEU_14:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_22:HA        1:LEU_79:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:PHE_22:HA        1:LEU_79:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:THR_72:HA        1:ILE_73:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:PHE_29:HA        1:MET_28:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_18:HA        1:ILE_19:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_7:HA         1:GLN_7:HG*         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLN_85:HA        1:ARG+_84:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_31:HA        1:ASP-_32:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALAC_90:HA       1:ASP-_89:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:ASP-_74:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:ASP-_74:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_32:HA       1:ALA_31:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASN_52:HA        1:PRO_53:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HA        1:PRO_53:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PRO_53:HD1       1:PRO_53:HG*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:PRO_53:HD2       1:PRO_53:HG*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:PRO_53:HD2       1:PRO_53:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HD1      1:MET_81:HA        -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HD2      1:MET_81:HA        -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:THR_72:HB        1:GLY_71:HA2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:THR_72:HB        1:GLY_71:HA1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:THR_72:HB        1:ASP-_36:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_47:HD*      1:ASN_52:HA         1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASP-_5:HN        1:ASP-_5:HB1        1.980  4.670  4.110  0.00  0.00   0.000  0.00
1:ASP-_5:HN        1:ASP-_5:HB2        1.980  4.670  4.670  0.00  0.00   0.000  0.00
1:ASP-_5:HN        1:GLN_6:HN         -1.000  4.750  4.750  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:ASP-_5:HB1        1.700  6.000  4.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:ASP-_5:HB2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_6:HA          2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_6:HG2         1.700  6.000  4.260  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_6:HG1         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_7:HN         -1.000  3.670  3.670  0.00  0.00   0.000  0.00
1:GLN_6:HE21       1:GLN_6:HE22        1.830  2.590  2.590  0.00  0.00   0.000  0.00
1:GLN_6:HE21       1:GLN_6:HG1         3.170  4.660  4.510  0.00  0.00   0.000  0.00
1:GLN_6:HE21       1:GLN_6:HG2         3.170  4.660  4.660  0.00  0.00   0.000  0.00
1:GLN_6:HE22       1:GLU-_77:HG1      -1.000  6.340  4.640  0.00  0.00   0.000  0.00
1:GLN_6:HE22       1:GLU-_77:HG2      -1.000  6.340  4.640  0.00  0.00   0.000  0.00
1:GLN_6:HE22       1:GLN_6:HB2        -1.000  6.200  4.500  0.00  0.00   0.000  0.00
1:GLN_6:HE22       1:GLN_6:HB1        -1.000  6.200  4.500  0.00  0.00   0.000  0.00
1:GLN_6:HE22       1:GLN_6:HG2         1.700  6.000  4.120  0.00  0.00   0.000  0.00
1:GLN_6:HE22       1:GLN_6:HG1         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_7:HN         1:ALA_8:HN         -1.000  3.290  3.290  0.00  0.00   0.000  0.00
1:GLN_7:HN         1:GLN_7:HA          2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLN_7:HN         1:GLN_7:HG*         2.270  4.230  4.230  0.00  0.00   0.000  0.00
1:GLN_7:HN         1:VAL_80:HG2*      -1.000  7.030  4.630  0.00  0.00   0.000  0.00
1:GLN_7:HN         1:VAL_80:HG1*      -1.000  7.030  4.630  0.00  0.00   0.000  0.00
1:GLN_7:HE21       1:GLN_7:HE22        1.920  2.720  2.720  0.00  0.00   0.000  0.00
1:GLN_7:HE21       1:GLN_7:HG*         2.610  4.720  4.720  0.00  0.00   0.000  0.00
1:GLN_7:HE22       1:GLN_7:HG*         2.440  4.470  4.470  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:ALA_8:HA          2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:ALA_8:HB*         2.070  3.950  3.950  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:ASP-_5:HA         3.100  4.410  4.410  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:GLU-_9:HN        -1.000  3.670  3.670  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:GLN_7:HA          3.070  4.370  4.370  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:GLN_7:HB1         2.670  4.550  4.050  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:GLN_7:HB2         2.670  4.550  3.800  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:ALA_10:HN        -1.000  3.530  3.530  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:ALA_8:HA          1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:ALA_8:HB*         1.230  4.270  4.270  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:GLU-_9:HB*        1.700  3.960  3.960  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:GLU-_9:HG1        1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:GLU-_9:HG2        1.700  4.040  3.870  0.00  0.00   0.000  0.00
1:ALA_10:HN        1:ALA_10:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_10:HN        1:ALA_10:HB*        2.050  3.920  3.920  0.00  0.00   0.000  0.00
1:ALA_10:HN        1:GLN_7:HA          2.980  4.250  4.250  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:ALA_10:HB*        2.300  4.270  4.270  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:ALA_12:HN        -1.000  3.290  3.290  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:ARG+_11:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:ARG+_11:HB*       2.030  3.890  3.890  0.00  0.00   0.000  0.00
1:ALA_12:HN        1:ALA_12:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_12:HN        1:ALA_12:HB*        1.990  3.840  3.840  0.00  0.00   0.000  0.00
1:ALA_12:HN        1:GLU-_9:HA         2.840  4.050  4.050  0.00  0.00   0.000  0.00
1:ALA_12:HN        1:ARG+_11:HA        3.040  4.320  4.320  0.00  0.00   0.000  0.00
1:ALA_12:HN        1:ARG+_11:HB*       2.570  4.650  4.650  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:ALA_10:HA         2.880  4.100  4.100  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:ALA_12:HA         2.820  4.020  4.020  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:ALA_12:HB*        2.330  4.320  4.320  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:PHE_13:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:PHE_13:HB1        2.180  3.110  3.110  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:PHE_13:HB2        2.180  3.110  3.110  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:LEU_14:HN        -1.000  3.020  3.020  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:ARG+_11:HN       -1.000  3.930  3.930  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:PHE_13:HB1       -1.000  5.150  3.450  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:PHE_13:HB2       -1.000  5.150  3.450  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:LEU_14:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:LEU_14:HD1*       2.530  4.830  4.610  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:LEU_14:HD2*       2.530  4.830  4.830  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:LEU_14:HG         2.140  3.040  3.040  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:ARG+_11:HA        2.660  3.790  3.790  0.00  0.00   0.000  0.00
1:SER_15:HN        1:LEU_14:HA         1.760  2.510  2.510  0.00  0.00   0.000  0.00
1:SER_15:HN        1:LEU_14:HB1       -1.000  5.100  3.400  0.00  0.00   0.000  0.00
1:SER_15:HN        1:LEU_14:HB2       -1.000  5.100  3.400  0.00  0.00   0.000  0.00
1:SER_15:HN        1:LEU_14:HD2*       1.700  7.000  4.470  0.00  0.00   0.000  0.00
1:SER_15:HN        1:LEU_14:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:SER_15:HN        1:MET_18:HG2       -1.000  5.520  3.820  0.00  0.00   0.000  0.00
1:SER_15:HN        1:MET_18:HG1       -1.000  5.520  3.820  0.00  0.00   0.000  0.00
1:SER_15:HN        1:SER_15:HA         2.430  3.420  3.420  0.00  0.00   0.000  0.00
1:SER_15:HN        1:SER_15:HB1       -1.000  5.110  3.410  0.00  0.00   0.000  0.00
1:SER_15:HN        1:SER_15:HB2       -1.000  5.110  3.410  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:GLU-_16:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:GLU-_16:HB1       2.110  3.000  3.000  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:GLU-_16:HB2       2.110  3.000  3.000  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:GLU-_17:HN       -1.000  4.160  4.160  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:SER_15:HA         2.460  3.500  3.500  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:SER_15:HB2       -1.000  5.760  4.060  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:SER_15:HB1       -1.000  5.760  4.060  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:GLU-_17:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:GLU-_17:HB1       1.700  6.000  3.800  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:GLU-_17:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:GLU-_17:HG1       1.700  6.000  4.500  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:GLU-_17:HG2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:MET_18:HN        -1.000  3.870  3.870  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:SER_15:HB2       -1.000  6.270  4.570  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:SER_15:HB1       -1.000  6.270  4.570  0.00  0.00   0.000  0.00
1:MET_18:HN        1:ILE_19:HN        -1.000  3.440  3.440  0.00  0.00   0.000  0.00
1:MET_18:HN        1:MET_18:HB1        1.920  4.540  4.540  0.00  0.00   0.000  0.00
1:MET_18:HN        1:MET_18:HB2        1.920  4.540  4.000  0.00  0.00   0.000  0.00
1:MET_18:HN        1:MET_18:HG2        1.700  6.000  4.290  0.00  0.00   0.000  0.00
1:MET_18:HN        1:MET_18:HG1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ALA_20:HN        -1.000  3.610  3.610  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ILE_19:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ILE_19:HB         2.060  2.930  2.930  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ILE_19:HG11      -1.000  5.390  3.690  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ILE_19:HG12      -1.000  5.390  3.690  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ILE_19:HG2*       2.680  4.810  4.810  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ALA_20:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ALA_20:HB*        2.040  3.900  3.900  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:GLU-_17:HA        2.910  4.140  4.140  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ILE_19:HA         3.160  4.490  4.490  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ILE_19:HB         2.390  3.400  3.400  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ILE_19:HG2*       2.910  5.140  5.140  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:ALA_20:HB*        1.720  4.580  4.580  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:GLU-_21:HG1      -1.000  6.190  4.490  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:GLU-_21:HG2      -1.000  6.190  4.490  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:PHE_22:HN        -1.000  3.440  3.440  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:GLU-_21:HA        2.810  4.000  4.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:PHE_22:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:PHE_22:HB*        2.200  4.130  4.130  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:ILE_19:HA         2.800  3.980  3.980  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:LYS+_23:HN       -1.000  3.390  3.390  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:ALA_20:HA         2.470  3.510  3.510  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:ALA_24:HN        -1.000  3.280  3.280  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:PHE_22:HA         2.840  4.050  4.050  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:PHE_22:HB*        2.490  4.540  4.540  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:LYS+_23:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:LYS+_23:HB*       2.200  4.130  4.130  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:LYS+_23:HG1      -1.000  6.510  4.810  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:LYS+_23:HG2      -1.000  6.510  4.810  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:ALA_24:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_25:HN        1:ALA_25:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_25:HN        1:ALA_25:HB*        2.080  3.960  3.960  0.00  0.00   0.000  0.00
1:ALA_25:HN        1:PHE_26:HN        -1.000  3.640  3.640  0.00  0.00   0.000  0.00
1:PHE_26:HN        1:ALA_25:HB*        2.650  4.760  4.760  0.00  0.00   0.000  0.00
1:PHE_26:HN        1:ASP-_27:HN       -1.000  4.490  4.490  0.00  0.00   0.000  0.00
1:PHE_26:HN        1:PHE_26:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:PHE_26:HN        1:PHE_26:HB*        2.540  4.610  4.610  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:PHE_26:HA         1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:MET_28:HN        -1.000  3.930  3.930  0.00  0.00   0.000  0.00
1:MET_28:HN        1:PHE_29:HN        -1.000  3.220  3.220  0.00  0.00   0.000  0.00
1:MET_28:HN        1:MET_28:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:MET_28:HN        1:MET_28:HB1        2.300  3.370  3.280  0.00  0.00   0.000  0.00
1:MET_28:HN        1:MET_28:HB2        2.300  3.370  3.370  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:ASP-_30:HN       -1.000  3.130  3.130  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:PHE_26:HA         2.890  4.120  4.120  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:PHE_29:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:MET_28:HA         2.620  3.730  3.730  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:MET_28:HB1        2.500  3.890  3.890  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:MET_28:HB2        2.500  3.890  3.550  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:ASP-_27:HA        2.440  3.470  3.470  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:ASP-_30:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:ASP-_30:HB1       2.100  3.060  3.060  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:ASP-_30:HB2       2.100  3.060  2.980  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:PHE_29:HB2        1.700  6.000  3.600  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:PHE_29:HB1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_31:HN        1:ALA_31:HB*        1.700  4.820  4.820  0.00  0.00   0.000  0.00
1:ALA_31:HN        1:ASP-_30:HA        1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:ALA_31:HN        1:ASP-_30:HB2      -1.000  6.490  4.790  0.00  0.00   0.000  0.00
1:ALA_31:HN        1:ASP-_30:HB1      -1.000  6.490  4.790  0.00  0.00   0.000  0.00
1:ALA_31:HN        1:ASP-_32:HN       -1.000  3.820  3.820  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:ALA_31:HA         2.690  3.830  3.830  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:ALA_31:HB*        2.270  4.230  4.230  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:ASP-_32:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:ASP-_32:HB1       2.490  3.770  3.550  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:ASP-_32:HB2       2.490  3.770  3.770  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:GLY_33:HN        -1.000  3.440  3.440  0.00  0.00   0.000  0.00
1:GLY_33:HN        1:GLY_33:HA*        1.700  4.290  4.290  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:GLY_33:HA*        2.090  5.350  5.350  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:GLY_33:HN        -1.000  4.360  4.360  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:GLY_34:HA1        1.700  6.000  4.120  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:GLY_34:HA2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:GLY_35:HN        -1.000  4.310  4.310  0.00  0.00   0.000  0.00
1:GLY_35:HN        1:ASP-_36:HN       -1.000  3.020  3.020  0.00  0.00   0.000  0.00
1:GLY_35:HN        1:GLY_35:HA1        1.930  4.460  4.000  0.00  0.00   0.000  0.00
1:GLY_35:HN        1:GLY_35:HA2        1.930  4.460  4.460  0.00  0.00   0.000  0.00
1:ASP-_36:HN       1:ASP-_36:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ASP-_36:HN       1:GLY_35:HA1        2.620  3.790  3.790  0.00  0.00   0.000  0.00
1:ASP-_36:HN       1:GLY_35:HA2        2.620  3.790  3.730  0.00  0.00   0.000  0.00
1:ILE_37:HN        1:ASP-_36:HA        1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:ILE_37:HN        1:ILE_37:HB         1.700  4.110  4.110  0.00  0.00   0.000  0.00
1:SER_38:HN        1:GLU-_41:HG*       1.650  5.390  5.390  0.00  0.00   0.000  0.00
1:SER_38:HN        1:ILE_37:HA         1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:SER_38:HN        1:ILE_37:HD1*       2.070  6.520  6.520  0.00  0.00   0.000  0.00
1:SER_38:HN        1:ILE_37:HG2*       1.910  6.090  6.090  0.00  0.00   0.000  0.00
1:THR_39:HN        1:ILE_62:HD1*       2.520  4.590  4.590  0.00  0.00   0.000  0.00
1:THR_39:HN        1:SER_38:HA         2.280  3.250  3.250  0.00  0.00   0.000  0.00
1:THR_39:HN        1:SER_38:HB2       -1.000  5.130  3.430  0.00  0.00   0.000  0.00
1:THR_39:HN        1:SER_38:HB1       -1.000  5.130  3.430  0.00  0.00   0.000  0.00
1:THR_39:HN        1:THR_39:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:THR_39:HN        1:THR_39:HG2*       2.270  4.230  4.230  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:LYS+_40:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:LYS+_40:HB1       2.340  3.430  3.430  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:LYS+_40:HB2       2.340  3.430  3.330  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:GLU-_41:HG*       1.710  4.560  4.560  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:LYS+_40:HB1       2.050  4.590  4.270  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:LYS+_40:HB2       2.050  4.590  4.590  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:LEU_42:HN        -1.000  3.670  3.670  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:GLU-_41:HA        2.920  4.160  4.160  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:GLU-_41:HG*       2.560  4.650  4.650  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:GLY_43:HN        -1.000  3.630  3.630  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:ILE_37:HG2*       2.720  4.870  4.870  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:LEU_42:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:LEU_42:HB2        1.700  6.000  3.550  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:LEU_42:HB1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLY_43:HN        1:GLY_43:HA1        1.700  6.000  4.200  0.00  0.00   0.000  0.00
1:GLY_43:HN        1:GLY_43:HA2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLY_43:HN        1:LEU_42:HB2       -1.000  6.480  4.780  0.00  0.00   0.000  0.00
1:GLY_43:HN        1:LEU_42:HB1       -1.000  6.480  4.780  0.00  0.00   0.000  0.00
1:GLY_43:HN        1:THR_44:HN        -1.000  4.560  4.560  0.00  0.00   0.000  0.00
1:THR_44:HN        1:GLU-_41:HA        2.260  4.700  4.700  0.00  0.00   0.000  0.00
1:THR_44:HN        1:THR_44:HB         2.100  4.370  4.370  0.00  0.00   0.000  0.00
1:THR_44:HN        1:VAL_45:HN        -1.000  3.120  3.120  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:MET_46:HN        -1.000  3.180  3.180  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:THR_44:HB         2.150  3.060  3.060  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:VAL_45:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:VAL_45:HB         1.920  2.730  2.730  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:VAL_45:HG1*       1.980  4.390  3.820  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:VAL_45:HG2*       1.980  4.390  4.390  0.00  0.00   0.000  0.00
1:MET_46:HN        1:MET_46:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:MET_46:HN        1:MET_46:HB1       -1.000  5.340  3.640  0.00  0.00   0.000  0.00
1:MET_46:HN        1:MET_46:HB2       -1.000  5.340  3.640  0.00  0.00   0.000  0.00
1:MET_46:HN        1:MET_46:HG1        2.380  3.660  3.660  0.00  0.00   0.000  0.00
1:MET_46:HN        1:MET_46:HG2        2.380  3.660  3.390  0.00  0.00   0.000  0.00
1:MET_46:HN        1:ARG+_47:HN       -1.000  3.550  3.550  0.00  0.00   0.000  0.00
1:MET_46:HN        1:VAL_45:HG2*      -1.000  7.090  4.690  0.00  0.00   0.000  0.00
1:MET_46:HN        1:VAL_45:HG1*      -1.000  7.090  4.690  0.00  0.00   0.000  0.00
1:ARG+_47:HN       1:MET_48:HN        -1.000  3.560  3.560  0.00  0.00   0.000  0.00
1:MET_48:HN        1:LEU_49:HN        -1.000  3.820  3.820  0.00  0.00   0.000  0.00
1:MET_48:HN        1:MET_48:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:MET_48:HN        1:MET_48:HB1        2.320  3.620  3.620  0.00  0.00   0.000  0.00
1:MET_48:HN        1:MET_48:HB2        2.320  3.620  3.300  0.00  0.00   0.000  0.00
1:MET_48:HN        1:MET_48:HG1        2.400  3.860  3.860  0.00  0.00   0.000  0.00
1:MET_48:HN        1:MET_48:HG2        2.400  3.860  3.410  0.00  0.00   0.000  0.00
1:MET_48:HN        1:ARG+_47:HB1      -1.000  5.480  3.780  0.00  0.00   0.000  0.00
1:MET_48:HN        1:ARG+_47:HB2      -1.000  5.480  3.780  0.00  0.00   0.000  0.00
1:MET_48:HN        1:VAL_45:HA         2.910  4.140  4.140  0.00  0.00   0.000  0.00
1:GLY_50:HN        1:GLY_50:HA1        1.700  3.560  3.250  0.00  0.00   0.000  0.00
1:GLY_50:HN        1:GLY_50:HA2        1.700  3.560  3.560  0.00  0.00   0.000  0.00
1:GLY_50:HN        1:LEU_49:HA         1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:GLY_50:HN        1:LEU_49:HN        -1.000  3.950  3.950  0.00  0.00   0.000  0.00
1:GLY_50:HN        1:GLN_51:HN        -1.000  3.460  3.460  0.00  0.00   0.000  0.00
1:GLN_51:HN        1:GLY_50:HA1        1.700  6.000  3.650  0.00  0.00   0.000  0.00
1:GLN_51:HN        1:GLY_50:HA2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HN        1:GLN_51:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLN_51:HN        1:GLN_51:HB1       -1.000  5.010  3.310  0.00  0.00   0.000  0.00
1:GLN_51:HN        1:GLN_51:HB2       -1.000  5.010  3.310  0.00  0.00   0.000  0.00
1:GLN_51:HE21      1:GLN_51:HE22       1.790  2.150  2.150  0.00  0.00   0.000  0.00
1:GLN_51:HE22      1:GLN_51:HG2       -1.000  5.120  3.420  0.00  0.00   0.000  0.00
1:GLN_51:HE22      1:GLN_51:HG1       -1.000  5.120  3.420  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:ASN_52:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:ASN_52:HB1        2.160  3.240  3.070  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:ASN_52:HB2        2.160  3.240  3.240  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:PRO_53:HD1        2.440  3.470  3.470  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:GLN_51:HA         1.930  2.750  2.750  0.00  0.00   0.000  0.00
1:ASN_52:HD21      1:ASN_52:HB2        1.700  6.000  3.340  0.00  0.00   0.000  0.00
1:ASN_52:HD21      1:ASN_52:HB1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HD22      1:ASN_52:HB1        2.020  3.140  3.140  0.00  0.00   0.000  0.00
1:ASN_52:HD22      1:ASN_52:HB2        2.020  3.140  2.880  0.00  0.00   0.000  0.00
1:THR_54:HN        1:PRO_53:HB1        2.300  3.360  3.270  0.00  0.00   0.000  0.00
1:THR_54:HN        1:PRO_53:HB2        2.300  3.360  3.360  0.00  0.00   0.000  0.00
1:THR_54:HN        1:THR_54:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:THR_54:HN        1:THR_54:HG2*       2.180  4.100  4.100  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:LYS+_55:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:LYS+_55:HB2       1.700  6.000  3.230  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:LYS+_55:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:LYS+_55:HG*       2.830  5.030  5.030  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:THR_54:HA         2.270  3.240  3.240  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:THR_54:HG2*       2.930  5.180  5.180  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:GLU-_56:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:GLU-_56:HB2      -1.000  5.180  3.480  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:GLU-_56:HB1      -1.000  5.180  3.480  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:GLU-_56:HG1       2.820  4.610  4.020  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:GLU-_56:HG2       2.820  4.610  4.610  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:GLU-_57:HN       -1.000  3.650  3.650  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:LYS+_55:HA        3.060  4.360  4.360  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:LYS+_55:HB1      -1.000  5.380  3.680  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:LYS+_55:HB2      -1.000  5.380  3.680  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:LYS+_55:HG*       3.360  5.780  5.780  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_56:HB1       2.370  3.800  3.370  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_56:HB2       2.370  3.800  3.800  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_57:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:LEU_58:HN        -1.000  3.610  3.610  0.00  0.00   0.000  0.00
1:LEU_58:HN        1:LEU_58:HB*        2.110  5.390  5.390  0.00  0.00   0.000  0.00
1:LEU_58:HN        1:LEU_58:HG         2.100  4.360  4.360  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:ALA_60:HN        -1.000  3.760  3.760  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:ASP-_59:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:ASP-_59:HB1       2.570  3.760  3.760  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:ASP-_59:HB2       2.570  3.760  3.650  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:LEU_58:HB*        2.610  4.710  4.710  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:LEU_58:HN        -1.000  3.830  3.830  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ALA_60:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ALA_60:HB*        2.070  3.950  3.950  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ASP-_59:HA        3.130  4.450  4.450  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ASP-_59:HB1       2.730  4.070  4.070  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ASP-_59:HB2       2.730  4.070  3.880  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ALA_60:HB*        2.550  4.630  4.630  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ILE_61:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ILE_61:HB         2.070  2.950  2.950  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ILE_61:HG11       2.340  3.620  3.620  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ILE_61:HG12       2.340  3.620  3.320  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:LEU_58:HA         2.660  3.780  3.780  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:GLU-_63:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:GLU-_63:HB1       2.240  3.520  3.520  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:GLU-_63:HB2       2.240  3.520  3.180  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:GLU-_64:HN       -1.000  3.810  3.810  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:ILE_62:HB         2.370  3.380  3.380  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:ILE_62:HN        -1.000  3.780  3.780  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:GLU-_64:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:GLU-_64:HG1       2.930  4.540  4.540  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:GLU-_64:HG2       2.930  4.540  4.170  0.00  0.00   0.000  0.00
1:VAL_65:HN        1:ASP-_66:HN       -1.000  4.720  4.720  0.00  0.00   0.000  0.00
1:ASP-_66:HN       1:ASP-_66:HB1       2.240  4.850  4.850  0.00  0.00   0.000  0.00
1:ASP-_66:HN       1:ASP-_66:HB2       2.240  4.850  4.660  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:ASP-_66:HB2      -1.000  5.620  3.920  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:ASP-_66:HB1      -1.000  5.620  3.920  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:ASP-_68:HN       -1.000  3.790  3.790  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:GLU-_67:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:GLU-_67:HB1      -1.000  4.850  3.150  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:GLU-_67:HB2      -1.000  4.850  3.150  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:GLU-_67:HG2      -1.000  5.320  3.620  0.00  0.00   0.000  0.00
1:GLU-_67:HN       1:GLU-_67:HG1      -1.000  5.320  3.620  0.00  0.00   0.000  0.00
1:ASP-_68:HN       1:ASP-_68:HB1       1.700  6.000  3.950  0.00  0.00   0.000  0.00
1:ASP-_68:HN       1:ASP-_68:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_68:HN       1:GLU-_67:HA        1.510  4.040  4.040  0.00  0.00   0.000  0.00
1:ASP-_68:HN       1:GLU-_67:HB1      -1.000  5.520  3.820  0.00  0.00   0.000  0.00
1:ASP-_68:HN       1:GLU-_67:HB2      -1.000  5.520  3.820  0.00  0.00   0.000  0.00
1:ASP-_68:HN       1:GLY_69:HN        -1.000  3.330  3.330  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:GLY_69:HA1        1.710  3.610  3.550  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:GLY_69:HA2        1.710  3.610  3.610  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:SER_70:HN        -1.000  3.980  3.980  0.00  0.00   0.000  0.00
1:SER_70:HN        1:GLY_71:HN        -1.000  3.980  3.980  0.00  0.00   0.000  0.00
1:SER_70:HN        1:SER_70:HB1       -1.000  5.860  4.160  0.00  0.00   0.000  0.00
1:SER_70:HN        1:SER_70:HB2       -1.000  5.860  4.160  0.00  0.00   0.000  0.00
1:GLY_71:HN        1:GLY_71:HA1        1.860  4.100  3.860  0.00  0.00   0.000  0.00
1:GLY_71:HN        1:GLY_71:HA2        1.860  4.100  4.100  0.00  0.00   0.000  0.00
1:GLY_71:HN        1:THR_72:HN        -1.000  2.860  2.860  0.00  0.00   0.000  0.00
1:THR_72:HN        1:GLY_71:HA1        2.360  3.520  3.360  0.00  0.00   0.000  0.00
1:THR_72:HN        1:GLY_71:HA2        2.360  3.520  3.520  0.00  0.00   0.000  0.00
1:THR_72:HN        1:THR_72:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:THR_72:HN        1:THR_72:HG2*       2.290  4.270  4.270  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:ILE_37:HB         1.800  4.810  4.810  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:ILE_73:HB         1.700  4.490  4.490  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:ILE_73:HG11       1.750  4.870  4.870  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:ILE_73:HG12       1.750  4.870  4.660  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:THR_72:HA         1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:THR_72:HB         1.700  4.470  4.470  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:GLU-_77:HG2      -1.000  6.550  4.850  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:GLU-_77:HG1      -1.000  6.550  4.850  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:ILE_73:HA         1.700  4.040  4.040  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:ILE_73:HG2*       1.870  5.990  5.990  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:ASP-_36:HA        2.720  3.870  3.870  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:ASP-_74:HA        2.160  3.070  3.070  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:ASP-_74:HB1       2.030  3.330  3.330  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:ASP-_74:HB2       2.030  3.330  2.890  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:GLU-_76:HN       -1.000  3.440  3.440  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:PHE_75:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:PHE_75:HB1        2.040  3.030  2.900  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:PHE_75:HB2        2.040  3.030  3.030  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:GLU-_76:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:GLU-_76:HB1       2.260  3.660  3.660  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:GLU-_76:HB2       2.260  3.660  3.220  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:GLU-_76:HG*       2.160  4.070  4.070  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:GLU-_77:HN       -1.000  3.170  3.170  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:PHE_75:HB2       -1.000  5.470  3.770  0.00  0.00   0.000  0.00
1:GLU-_76:HN       1:PHE_75:HB1       -1.000  5.470  3.770  0.00  0.00   0.000  0.00
1:GLU-_77:HN       1:GLU-_77:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLU-_77:HN       1:PHE_78:HN        -1.000  3.270  3.270  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:GLU-_77:HG2      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:GLU-_77:HG1      -1.000  5.420  3.720  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:PHE_75:HA         2.550  3.630  3.630  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:PHE_78:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:PHE_78:HB1        2.230  3.240  3.240  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:PHE_78:HB2        2.230  3.240  3.170  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:ILE_73:HG2*       2.370  4.370  4.370  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:LEU_79:HN        -1.000  3.420  3.420  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:GLU-_76:HA        2.290  4.760  4.760  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:PHE_75:HA         2.330  4.830  4.830  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:PHE_78:HB1       -1.000  6.530  4.830  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:PHE_78:HB2       -1.000  6.530  4.830  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:LEU_79:HB1       -1.000  6.190  4.490  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:LEU_79:HB2       -1.000  6.190  4.490  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:LEU_79:HD1*       2.280  5.750  5.750  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:LEU_79:HD2*       2.280  5.750  5.740  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:LEU_79:HG         1.860  3.860  3.860  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:VAL_80:HN        -1.000  3.480  3.480  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:MET_81:HN        -1.000  3.500  3.500  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:VAL_80:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:VAL_80:HB         2.070  2.950  2.950  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:VAL_80:HG2*       1.700  7.000  3.900  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:VAL_80:HG1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_81:HN        1:PHE_78:HA         2.820  4.010  4.010  0.00  0.00   0.000  0.00
1:MET_81:HN        1:MET_81:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:MET_81:HN        1:MET_81:HB1       -1.000  4.960  3.260  0.00  0.00   0.000  0.00
1:MET_81:HN        1:MET_81:HB2       -1.000  4.960  3.260  0.00  0.00   0.000  0.00
1:MET_81:HN        1:MET_82:HN        -1.000  3.650  3.650  0.00  0.00   0.000  0.00
1:MET_81:HN        1:VAL_80:HG1*       1.700  7.000  4.440  0.00  0.00   0.000  0.00
1:MET_81:HN        1:VAL_80:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_82:HN        1:LEU_79:HA         2.670  3.810  3.810  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_81:HA         2.770  3.940  3.940  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_81:HB1       -1.000  5.590  3.890  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_81:HB2       -1.000  5.590  3.890  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_82:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_82:HB1        2.330  3.610  3.610  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_82:HB2        2.330  3.610  3.320  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_82:HG1        2.490  3.810  3.810  0.00  0.00   0.000  0.00
1:MET_82:HN        1:MET_82:HG2        2.490  3.810  3.540  0.00  0.00   0.000  0.00
1:MET_82:HN        1:VAL_83:HN        -1.000  3.610  3.610  0.00  0.00   0.000  0.00
1:VAL_83:HN        1:VAL_80:HA         2.800  3.990  3.990  0.00  0.00   0.000  0.00
1:VAL_83:HN        1:VAL_83:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:VAL_83:HN        1:VAL_83:HB         2.040  2.900  2.900  0.00  0.00   0.000  0.00
1:VAL_83:HN        1:VAL_83:HG1*       2.140  4.660  4.660  0.00  0.00   0.000  0.00
1:VAL_83:HN        1:VAL_83:HG2*       2.140  4.660  4.040  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:GLN_85:HN        -1.000  3.520  3.520  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:ARG+_84:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:ARG+_84:HG1      -1.000  6.200  4.500  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:ARG+_84:HG2      -1.000  6.200  4.500  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:VAL_83:HA         2.790  3.970  3.970  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:VAL_83:HB         2.540  3.610  3.610  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:VAL_83:HG1*       2.970  5.310  5.230  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:VAL_83:HG2*       2.970  5.310  5.310  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:VAL_83:HN        -1.000  3.670  3.670  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:MET_86:HN        -1.000  3.450  3.450  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:GLN_85:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:GLN_85:HB2       -1.000  4.760  3.060  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:GLN_85:HB1       -1.000  4.760  3.060  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:GLN_85:HG1        2.630  3.770  3.770  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:GLN_85:HG2        2.630  3.770  3.740  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:ARG+_84:HA        2.770  3.950  3.950  0.00  0.00   0.000  0.00
1:GLN_85:HE21      1:GLN_85:HE22       1.700  2.160  2.160  0.00  0.00   0.000  0.00
1:GLN_85:HE21      1:GLN_85:HG2       -1.000  5.720  4.020  0.00  0.00   0.000  0.00
1:GLN_85:HE21      1:GLN_85:HG1       -1.000  5.720  4.020  0.00  0.00   0.000  0.00
1:GLN_85:HE22      1:GLN_85:HG1        2.520  3.790  3.790  0.00  0.00   0.000  0.00
1:GLN_85:HE22      1:GLN_85:HG2        2.520  3.790  3.580  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_86:HA         2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_86:HB1        2.150  3.440  3.050  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_86:HB2        2.150  3.440  3.440  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_86:HG1        2.330  4.080  4.080  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_86:HG2        2.330  4.080  3.320  0.00  0.00   0.000  0.00
1:MET_86:HN        1:VAL_83:HA         2.590  3.680  3.680  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:LYS+_87:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:LYS+_87:HB1       2.370  3.810  3.370  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:LYS+_87:HB2       2.370  3.810  3.810  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:LYS+_87:HG1       2.590  4.250  4.250  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:LYS+_87:HG2       2.590  4.250  3.680  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:MET_86:HA         2.750  3.910  3.910  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:MET_86:HB1        2.840  4.150  4.040  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:MET_86:HB2        2.840  4.150  4.150  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:ARG+_84:HA        3.110  4.420  4.420  0.00  0.00   0.000  0.00
1:GLU-_88:HN       1:GLU-_88:HB1       1.700  6.000  3.930  0.00  0.00   0.000  0.00
1:GLU-_88:HN       1:GLU-_88:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_88:HN       1:GLU-_88:HG2       1.700  6.000  4.780  0.00  0.00   0.000  0.00
1:GLU-_88:HN       1:GLU-_88:HG1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:ASP-_89:HA        2.410  3.420  3.420  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:ASP-_89:HB1       1.700  6.000  2.960  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:ASP-_89:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:THR_72:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_73:HN        1:ILE_73:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_37:HN        1:ILE_37:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_37:HN        1:ILE_37:HG1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_37:HN        1:ASP-_36:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_37:HN        1:ASP-_36:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:LYS+_23:HD1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_23:HN       1:LYS+_23:HD2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_10:HN        1:VAL_80:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ALA_10:HN        1:VAL_80:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ALA_10:HN        1:GLU-_9:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:VAL_80:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:VAL_80:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:ASP-_5:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_8:HN         1:ASP-_5:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_38:HN        1:SER_38:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_38:HN        1:SER_38:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_38:HN        1:GLU-_41:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:SER_38:HN        1:LEU_42:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_78:HN        1:GLU-_77:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:LYS+_55:HD1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LYS+_55:HN       1:LYS+_55:HD2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLN_7:HN         1:GLN_6:HA          1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:GLU-_57:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ILE_61:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:ILE_62:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:LEU_58:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_60:HN        1:GLU-_63:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_48:HN        1:THR_44:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_48:HN        1:MET_48:HE*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASP-_5:HN        1:ASP-_5:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_56:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_57:HG*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_56:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:GLU-_56:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:LYS+_55:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:ASP-_59:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_57:HN       1:THR_54:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_48:HN        1:LEU_49:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:MET_48:HN        1:LEU_49:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:LYS+_40:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:LYS+_40:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:THR_39:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_40:HN       1:THR_39:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:ILE_19:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_16:HN       1:SER_15:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:GLU-_16:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:ALA_20:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:MET_18:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:LYS+_23:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:GLU-_21:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:ALAC_90:HB*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:GLU-_88:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:GLU-_88:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:ALAC_90:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_89:HN       1:GLU-_88:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_83:HN        1:MET_82:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:ILE_37:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:LEU_42:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:LEU_42:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_42:HN        1:THR_39:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:ILE_37:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:LYS+_40:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:LYS+_40:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_41:HN       1:GLU-_41:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:LYS+_23:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:LYS+_23:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:LYS+_23:HB*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ALA_24:HN        1:ALA_24:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:ILE_19:HG11      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:ILE_19:HG12      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:GLU-_21:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:GLU-_21:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:GLU-_21:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_21:HN       1:LYS+_23:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ILE_19:HG11      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:ILE_19:HG12      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:GLU-_21:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_20:HN        1:GLU-_21:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ALA_25:HN        1:ALA_24:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:THR_44:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:LEU_42:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_88:HN       1:LYS+_87:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_88:HN       1:LYS+_87:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_45:HN        1:THR_44:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ALA_25:HN        1:PHE_22:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_18:HN        1:GLU-_17:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_81:HN        1:GLU-_77:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_81:HN        1:LEU_79:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:MET_81:HN        1:LEU_79:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:MET_81:HN        1:VAL_80:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_81:HN        1:VAL_83:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ALA_60:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_61:HN        1:ILE_62:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_58:HN        1:LEU_58:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_58:HN        1:LEU_58:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LEU_58:HN        1:THR_54:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:LEU_58:HN        1:LYS+_55:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_18:HN        1:GLU-_17:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_18:HN        1:GLU-_17:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_18:HN        1:MET_18:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_26:HN        1:ALA_25:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_26:HN        1:LYS+_23:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:LEU_79:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:LEU_79:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:ILE_19:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:GLU-_21:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:GLU-_21:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:GLU-_21:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_22:HN        1:GLU-_21:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:ILE_19:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:MET_18:HB1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:MET_18:HB2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:GLU-_16:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:MET_18:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_19:HN        1:GLU-_17:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:ASP-_5:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:MET_81:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:ARG+_84:HD1      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:ARG+_84:HD2      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HN       1:VAL_80:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_77:HN       1:GLU-_77:HG1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_77:HN       1:GLU-_77:HG2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_77:HN       1:GLU-_76:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_17:HN       1:GLU-_16:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:VAL_80:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:VAL_80:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_6:HB2        -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_6:HB1        -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_6:HE22        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_6:HN         1:GLN_7:HE22        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:GLN_6:HA          1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:GLU-_9:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:VAL_83:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:VAL_83:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:VAL_83:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LYS+_87:HN       1:ASP-_89:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:ALA_10:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:LEU_79:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_47:HN       1:THR_44:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HN       1:ARG+_47:HD*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ARG+_47:HN       1:GLY_43:HA1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ARG+_47:HN       1:GLY_43:HA2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_28:HN        1:MET_28:HE*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_28:HN        1:MET_28:HG1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_28:HN        1:MET_28:HG2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_28:HN        1:ASP-_27:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALA_12:HN        1:LEU_14:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_9:HN        1:GLN_7:HA          1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_80:HN        1:GLU-_77:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_28:HN        1:ALA_25:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:GLU-_56:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:LEU_58:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:VAL_83:HG1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:VAL_83:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_82:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:MET_82:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:LYS+_87:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:LYS+_87:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:ARG+_84:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_86:HN        1:GLN_85:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_59:HN       1:LYS+_55:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:PHE_78:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:MET_81:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_79:HN        1:GLU-_77:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_75:HN        1:ILE_37:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:THR_44:HN        1:THR_44:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:THR_44:HN        1:GLY_43:HA1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:THR_44:HN        1:GLY_43:HA2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:THR_44:HN        1:THR_44:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:MET_28:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:ILE_37:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:ILE_37:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASP-_30:HN       1:PHE_29:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:LEU_58:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:ASP-_27:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ILE_62:HG11       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ILE_62:HG12       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ILE_62:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ALA_60:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ILE_62:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_51:HN        1:ASN_52:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:ILE_37:HD1*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:ASP-_30:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:ASP-_30:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:MET_28:HG1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_29:HN        1:MET_28:HG2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:ALA_12:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:LEU_14:HN        1:PHE_13:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:LEU_14:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:LEU_14:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:LEU_14:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:LEU_14:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:PHE_13:HN        1:ARG+_11:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ILE_61:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ILE_62:HN        1:ASP-_59:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:ILE_62:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:ILE_62:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_63:HN       1:ALA_60:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:LYS+_23:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_82:HN        1:VAL_83:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:MET_82:HN        1:VAL_83:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:LYS+_23:HG1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:LYS+_23:HG2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:ALA_25:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:ASP-_27:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:ASP-_27:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_27:HN       1:ASP-_27:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:SER_70:HN        1:GLY_71:HA1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_70:HN        1:GLY_71:HA2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_70:HN        1:GLY_69:HA1        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:SER_70:HN        1:GLY_69:HA2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:SER_70:HN        1:ASP-_68:HN        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:THR_54:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:LYS+_55:HD1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLU-_56:HN       1:LYS+_55:HD2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:GLN_51:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:GLN_51:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASN_52:HN        1:PRO_53:HD2        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:MET_46:HN        1:GLY_43:HA1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_46:HN        1:GLY_43:HA2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:MET_46:HN        1:VAL_45:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLN_85:HN        1:MET_82:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:SER_15:HN        1:MET_18:HB1       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:SER_15:HN        1:MET_18:HB2       -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:ALA_8:HA          1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:ALA_10:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:LEU_79:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:LEU_79:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:LEU_14:HD1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:LEU_14:HD2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:VAL_80:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_11:HN       1:VAL_80:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:ALA_60:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:ILE_62:HG2*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:ALA_60:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:GLU-_64:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:GLU-_64:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:ILE_62:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:ILE_61:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLU-_64:HN       1:GLU-_63:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_36:HN       1:ASP-_36:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASP-_36:HN       1:ASP-_36:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:THR_39:HN        1:THR_39:HB         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_32:HN       1:GLY_33:HA*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLY_33:HN        1:ALA_31:HB*        1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:GLY_33:HN        1:ALA_31:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:ASP-_66:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:ASP-_66:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:ASP-_68:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:ASP-_68:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_69:HN        1:GLY_71:HN         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:ASP-_30:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:ASP-_30:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:ASP-_32:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:GLY_34:HN        1:ASP-_32:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HE       1:VAL_80:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HE       1:VAL_80:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HE       1:ARG+_84:HG1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HE       1:ARG+_84:HG2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ARG+_84:HE       1:ARG+_84:HD1      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ARG+_84:HE       1:ARG+_84:HD2      -1.000  8.700  7.000  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:ASP-_74:HB1      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:ASP-_74:HB2      -1.000  7.700  6.000  0.00  0.00   0.000  0.00
1:ASP-_74:HN       1:ASP-_74:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_65:HN        1:VAL_65:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_65:HN        1:VAL_65:HG1*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:VAL_65:HN        1:VAL_65:HG2*      -1.000  9.400  7.000  0.00  0.00   0.000  0.00
1:VAL_65:HN        1:VAL_65:HB         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:VAL_65:HN        1:GLU-_64:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALAC_90:HN       1:ALAC_90:HA        1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALAC_90:HN       1:ASP-_89:HB2       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALAC_90:HN       1:ASP-_89:HB1       1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ALAC_90:HN       1:ALAC_90:HB*       1.700  7.000  7.000  0.00  0.00   0.000  0.00
1:ALA_31:HN        1:ALA_31:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:GLY_43:HN        1:THR_39:HA         1.700  6.000  6.000  0.00  0.00   0.000  0.00
1:ASP-_74:HA       1:PHE_26:HZ         2.130  3.880  3.880  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:PHE_26:HE*        2.300  6.330  4.180  0.00  0.00   0.000  0.00
1:ASP-_36:HA       1:PHE_26:HZ         1.990  3.630  3.630  0.00  0.00   0.000  0.00
1:PHE_22:HA        1:PHE_22:HD*        1.840  5.510  3.360  0.00  0.00   0.000  0.00
1:PHE_13:HA        1:PHE_13:HD*        2.040  5.870  3.720  0.00  0.00   0.000  0.00
1:LYS+_23:HA       1:PHE_75:HZ         2.560  4.670  4.670  0.00  0.00   0.000  0.00
1:LYS+_23:HA       1:PHE_75:HE*        2.030  5.850  3.700  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:PHE_22:HD*        2.310  6.360  4.210  0.00  0.00   0.000  0.00
1:ILE_19:HA        1:PHE_75:HZ         2.720  4.960  4.960  0.00  0.00   0.000  0.00
1:GLY_35:HA1       1:PHE_26:HE*       -1.000  6.770  4.620  0.00  0.00   0.000  0.00
1:GLY_35:HA2       1:PHE_26:HE*       -1.000  6.770  4.620  0.00  0.00   0.000  0.00
1:PHE_75:HA        1:PHE_75:HD*        1.920  5.640  3.490  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:PHE_75:HZ         2.570  5.670  5.670  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:PHE_75:HE*        2.150  7.070  4.920  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:PHE_22:HD*        2.060  6.900  4.750  0.00  0.00   0.000  0.00
1:PHE_22:HB*       1:PHE_78:HE*        2.350  7.440  5.290  0.00  0.00   0.000  0.00
1:PHE_13:HB2       1:PHE_13:HD*        2.080  6.020  3.870  0.00  0.00   0.000  0.00
1:PHE_13:HB1       1:PHE_13:HD*        2.080  5.940  3.790  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:PHE_29:HD*        2.340  6.420  4.270  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:PHE_26:HD*        2.060  5.910  3.760  0.00  0.00   0.000  0.00
1:PHE_26:HA        1:PHE_78:HE*        2.640  6.950  4.800  0.00  0.00   0.000  0.00
1:PHE_75:HB2       1:PHE_75:HD*        2.020  5.840  3.690  0.00  0.00   0.000  0.00
1:PHE_75:HB1       1:PHE_75:HD*        2.020  5.840  3.690  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:PHE_22:HD*        2.350  7.430  5.280  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:PHE_29:HD*        2.630  7.940  5.790  0.00  0.00   0.000  0.00
1:ALA_25:HB*       1:PHE_78:HE*        2.380  7.480  5.330  0.00  0.00   0.000  0.00
1:ILE_19:HG12      1:PHE_75:HZ        -1.000  6.120  4.420  0.00  0.00   0.000  0.00
1:ILE_19:HG11      1:PHE_75:HZ        -1.000  6.120  4.420  0.00  0.00   0.000  0.00
1:MET_82:HB2       1:PHE_22:HD*       -1.000  6.880  4.730  0.00  0.00   0.000  0.00
1:MET_82:HB1       1:PHE_22:HD*       -1.000  6.880  4.730  0.00  0.00   0.000  0.00
1:ILE_19:HG2*      1:PHE_22:HD*        2.550  7.800  5.650  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:PHE_22:HE*       -1.000  6.750  4.600  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:PHE_22:HE*       -1.000  6.750  4.600  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:PHE_13:HD*       -1.000  6.900  4.750  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:PHE_13:HD*       -1.000  6.900  4.750  0.00  0.00   0.000  0.00
1:LEU_14:HD2*      1:PHE_22:HD*       -1.000  7.450  5.300  0.00  0.00   0.000  0.00
1:LEU_14:HD1*      1:PHE_22:HD*       -1.000  7.450  5.300  0.00  0.00   0.000  0.00
1:ILE_37:HG2*      1:PHE_29:HD*        2.650  7.980  5.830  0.00  0.00   0.000  0.00
1:VAL_45:HG2*      1:PHE_29:HD*       -1.000  7.570  5.420  0.00  0.00   0.000  0.00
1:VAL_45:HG1*      1:PHE_29:HD*       -1.000  7.570  5.420  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:PHE_75:HZ        -1.000  7.930  5.530  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:PHE_75:HZ        -1.000  7.930  5.530  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:PHE_22:HD*       -1.000  7.970  5.820  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:PHE_22:HD*       -1.000  7.970  5.820  0.00  0.00   0.000  0.00
1:LEU_79:HD1*      1:PHE_75:HE*       -1.000  7.040  4.890  0.00  0.00   0.000  0.00
1:LEU_79:HD2*      1:PHE_75:HE*       -1.000  7.040  4.890  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:PHE_29:HD*        2.380  7.480  5.330  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:PHE_78:HE*        2.540  7.780  5.630  0.00  0.00   0.000  0.00
1:ILE_37:HD1*      1:PHE_29:HE*        2.560  7.810  5.660  0.00  0.00   0.000  0.00
1:LYS+_23:HD1      1:PHE_75:HE*       -1.000  7.000  4.850  0.00  0.00   0.000  0.00
1:LYS+_23:HD2      1:PHE_75:HE*       -1.000  7.000  4.850  0.00  0.00   0.000  0.00
!
#NMR_dihedral
1:THR_4:C          1:ASP-_5:N         1:ASP-_5:CA        1:ASP-_5:C         -90.000 -10.000 30.00 30.00 1000.000
1:ASP-_5:C         1:GLN_6:N          1:GLN_6:CA         1:GLN_6:C          -90.000 -10.000 30.00 30.00 1000.000
1:GLN_7:C          1:ALA_8:N          1:ALA_8:CA         1:ALA_8:C          -90.000 -10.000 30.00 30.00 1000.000
1:ALA_8:C          1:GLU-_9:N         1:GLU-_9:CA        1:GLU-_9:C         -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_9:C         1:ALA_10:N         1:ALA_10:CA        1:ALA_10:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_10:C         1:ARG+_11:N        1:ARG+_11:CA       1:ARG+_11:C        -90.000 -10.000 30.00 30.00 1000.000
1:ARG+_11:C        1:ALA_12:N         1:ALA_12:CA        1:ALA_12:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_12:C         1:PHE_13:N         1:PHE_13:CA        1:PHE_13:C         -90.000 -10.000 30.00 30.00 1000.000
1:SER_15:C         1:GLU-_16:N        1:GLU-_16:CA       1:GLU-_16:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_16:C        1:GLU-_17:N        1:GLU-_17:CA       1:GLU-_17:C        -90.000 -10.000 30.00 30.00 1000.000
1:MET_18:C         1:ILE_19:N         1:ILE_19:CA        1:ILE_19:C         -90.000 -10.000 30.00 30.00 1000.000
1:ILE_19:C         1:ALA_20:N         1:ALA_20:CA        1:ALA_20:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_20:C         1:GLU-_21:N        1:GLU-_21:CA       1:GLU-_21:C        -90.000 -10.000 30.00 30.00 1000.000
1:PHE_22:C         1:LYS+_23:N        1:LYS+_23:CA       1:LYS+_23:C        -90.000 -10.000 30.00 30.00 1000.000
1:LYS+_23:C        1:ALA_24:N         1:ALA_24:CA        1:ALA_24:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_24:C         1:ALA_25:N         1:ALA_25:CA        1:ALA_25:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_25:C         1:PHE_26:N         1:PHE_26:CA        1:PHE_26:C         -90.000 -10.000 30.00 30.00 1000.000
1:PHE_26:C         1:ASP-_27:N        1:ASP-_27:CA       1:ASP-_27:C        -90.000 -10.000 30.00 30.00 1000.000
1:ASP-_27:C        1:MET_28:N         1:MET_28:CA        1:MET_28:C         -90.000 -10.000 30.00 30.00 1000.000
1:MET_28:C         1:PHE_29:N         1:PHE_29:CA        1:PHE_29:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_31:C         1:ASP-_32:N        1:ASP-_32:CA       1:ASP-_32:C        -170.000 -70.000 30.00 30.00 1000.000
1:ASP-_36:C        1:ILE_37:N         1:ILE_37:CA        1:ILE_37:C         -160.000 -80.000 30.00 30.00 1000.000
1:ILE_37:C         1:SER_38:N         1:SER_38:CA        1:SER_38:C         -170.000 -70.000 30.00 30.00 1000.000
1:SER_38:C         1:THR_39:N         1:THR_39:CA        1:THR_39:C         -90.000 -10.000 30.00 30.00 1000.000
1:THR_39:C         1:LYS+_40:N        1:LYS+_40:CA       1:LYS+_40:C        -90.000 -10.000 30.00 30.00 1000.000
1:LYS+_40:C        1:GLU-_41:N        1:GLU-_41:CA       1:GLU-_41:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_41:C        1:LEU_42:N         1:LEU_42:CA        1:LEU_42:C         -90.000 -10.000 30.00 30.00 1000.000
1:GLY_43:C         1:THR_44:N         1:THR_44:CA        1:THR_44:C         -90.000 -10.000 30.00 30.00 1000.000
1:THR_44:C         1:VAL_45:N         1:VAL_45:CA        1:VAL_45:C         -90.000 -10.000 30.00 30.00 1000.000
1:VAL_45:C         1:MET_46:N         1:MET_46:CA        1:MET_46:C         -90.000 -10.000 30.00 30.00 1000.000
1:MET_46:C         1:ARG+_47:N        1:ARG+_47:CA       1:ARG+_47:C        -90.000 -10.000 30.00 30.00 1000.000
1:ARG+_47:C        1:MET_48:N         1:MET_48:CA        1:MET_48:C         -90.000 -10.000 30.00 30.00 1000.000
1:GLY_50:C         1:GLN_51:N         1:GLN_51:CA        1:GLN_51:C         -160.000 -80.000 30.00 30.00 1000.000
1:GLN_51:C         1:ASN_52:N         1:ASN_52:CA        1:ASN_52:C         -170.000 -70.000 30.00 30.00 1000.000
1:PRO_53:C         1:THR_54:N         1:THR_54:CA        1:THR_54:C         -170.000 -70.000 30.00 30.00 1000.000
1:THR_54:C         1:LYS+_55:N        1:LYS+_55:CA       1:LYS+_55:C        -90.000 -10.000 30.00 30.00 1000.000
1:LYS+_55:C        1:GLU-_56:N        1:GLU-_56:CA       1:GLU-_56:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_56:C        1:GLU-_57:N        1:GLU-_57:CA       1:GLU-_57:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_57:C        1:LEU_58:N         1:LEU_58:CA        1:LEU_58:C         -90.000 -10.000 30.00 30.00 1000.000
1:LEU_58:C         1:ASP-_59:N        1:ASP-_59:CA       1:ASP-_59:C        -90.000 -10.000 30.00 30.00 1000.000
1:ASP-_59:C        1:ALA_60:N         1:ALA_60:CA        1:ALA_60:C         -90.000 -10.000 30.00 30.00 1000.000
1:ALA_60:C         1:ILE_61:N         1:ILE_61:CA        1:ILE_61:C         -90.000 -10.000 30.00 30.00 1000.000
1:ILE_61:C         1:ILE_62:N         1:ILE_62:CA        1:ILE_62:C         -90.000 -10.000 30.00 30.00 1000.000
1:ILE_62:C         1:GLU-_63:N        1:GLU-_63:CA       1:GLU-_63:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_63:C        1:GLU-_64:N        1:GLU-_64:CA       1:GLU-_64:C        -90.000 -10.000 30.00 30.00 1000.000
1:ASP-_66:C        1:GLU-_67:N        1:GLU-_67:CA       1:GLU-_67:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_67:C        1:ASP-_68:N        1:ASP-_68:CA       1:ASP-_68:C        -160.000 -80.000 30.00 30.00 1000.000
1:GLY_71:C         1:THR_72:N         1:THR_72:CA        1:THR_72:C         -170.000 -70.000 30.00 30.00 1000.000
1:THR_72:C         1:ILE_73:N         1:ILE_73:CA        1:ILE_73:C         -160.000 -80.000 30.00 30.00 1000.000
1:ASP-_74:C        1:PHE_75:N         1:PHE_75:CA        1:PHE_75:C         -90.000 -10.000 30.00 30.00 1000.000
1:GLU-_77:C        1:PHE_78:N         1:PHE_78:CA        1:PHE_78:C         -90.000 -10.000 30.00 30.00 1000.000
1:PHE_78:C         1:LEU_79:N         1:LEU_79:CA        1:LEU_79:C         -90.000 -10.000 30.00 30.00 1000.000
1:VAL_80:C         1:MET_81:N         1:MET_81:CA        1:MET_81:C         -90.000 -10.000 30.00 30.00 1000.000
1:MET_81:C         1:MET_82:N         1:MET_82:CA        1:MET_82:C         -90.000 -10.000 30.00 30.00 1000.000
1:MET_82:C         1:VAL_83:N         1:VAL_83:CA        1:VAL_83:C         -90.000 -10.000 30.00 30.00 1000.000
1:VAL_83:C         1:ARG+_84:N        1:ARG+_84:CA       1:ARG+_84:C        -90.000 -10.000 30.00 30.00 1000.000
1:GLN_85:C         1:MET_86:N         1:MET_86:CA        1:MET_86:C         -90.000 -10.000 30.00 30.00 1000.000
1:MET_86:C         1:LYS+_87:N        1:LYS+_87:CA       1:LYS+_87:C        -90.000 -10.000 30.00 30.00 1000.000
1:ASP-_5:N         1:ASP-_5:CA        1:ASP-_5:C         1:GLN_6:N          -140.000 80.000 30.00 30.00 1000.000
1:GLN_7:N          1:GLN_7:CA         1:GLN_7:C          1:ALA_8:N          -140.000 80.000 30.00 30.00 1000.000
1:ALA_8:N          1:ALA_8:CA         1:ALA_8:C          1:GLU-_9:N         -140.000 80.000 30.00 30.00 1000.000
1:ALA_10:N         1:ALA_10:CA        1:ALA_10:C         1:ARG+_11:N        -140.000 80.000 30.00 30.00 1000.000
1:ARG+_11:N        1:ARG+_11:CA       1:ARG+_11:C        1:ALA_12:N         -140.000 80.000 30.00 30.00 1000.000
1:ALA_12:N         1:ALA_12:CA        1:ALA_12:C         1:PHE_13:N         -140.000 80.000 30.00 30.00 1000.000
1:PHE_13:N         1:PHE_13:CA        1:PHE_13:C         1:LEU_14:N         -140.000 80.000 30.00 30.00 1000.000
1:LEU_14:N         1:LEU_14:CA        1:LEU_14:C         1:SER_15:N         20.000 -140.000 30.00 30.00 1000.000
1:GLU-_16:N        1:GLU-_16:CA       1:GLU-_16:C        1:GLU-_17:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_17:N        1:GLU-_17:CA       1:GLU-_17:C        1:MET_18:N         -140.000 80.000 30.00 30.00 1000.000
1:MET_18:N         1:MET_18:CA        1:MET_18:C         1:ILE_19:N         -140.000 80.000 30.00 30.00 1000.000
1:ILE_19:N         1:ILE_19:CA        1:ILE_19:C         1:ALA_20:N         -140.000 80.000 30.00 30.00 1000.000
1:ALA_20:N         1:ALA_20:CA        1:ALA_20:C         1:GLU-_21:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_21:N        1:GLU-_21:CA       1:GLU-_21:C        1:PHE_22:N         -140.000 80.000 30.00 30.00 1000.000
1:PHE_22:N         1:PHE_22:CA        1:PHE_22:C         1:LYS+_23:N        -140.000 80.000 30.00 30.00 1000.000
1:LYS+_23:N        1:LYS+_23:CA       1:LYS+_23:C        1:ALA_24:N         -140.000 80.000 30.00 30.00 1000.000
1:ALA_24:N         1:ALA_24:CA        1:ALA_24:C         1:ALA_25:N         -140.000 80.000 30.00 30.00 1000.000
1:ALA_25:N         1:ALA_25:CA        1:ALA_25:C         1:PHE_26:N         -140.000 80.000 30.00 30.00 1000.000
1:ASP-_27:N        1:ASP-_27:CA       1:ASP-_27:C        1:MET_28:N         -140.000 80.000 30.00 30.00 1000.000
1:MET_28:N         1:MET_28:CA        1:MET_28:C         1:PHE_29:N         -140.000 80.000 30.00 30.00 1000.000
1:PHE_29:N         1:PHE_29:CA        1:PHE_29:C         1:ASP-_30:N        -140.000 80.000 30.00 30.00 1000.000
1:ASP-_36:N        1:ASP-_36:CA       1:ASP-_36:C        1:ILE_37:N         20.000 -140.000 30.00 30.00 1000.000
1:ILE_37:N         1:ILE_37:CA        1:ILE_37:C         1:SER_38:N         20.000 -140.000 30.00 30.00 1000.000
1:SER_38:N         1:SER_38:CA        1:SER_38:C         1:THR_39:N         20.000 -140.000 30.00 30.00 1000.000
1:THR_39:N         1:THR_39:CA        1:THR_39:C         1:LYS+_40:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_41:N        1:GLU-_41:CA       1:GLU-_41:C        1:LEU_42:N         -140.000 80.000 30.00 30.00 1000.000
1:ARG+_47:N        1:ARG+_47:CA       1:ARG+_47:C        1:MET_48:N         -140.000 80.000 30.00 30.00 1000.000
1:LEU_49:N         1:LEU_49:CA        1:LEU_49:C         1:GLY_50:N         -140.000 80.000 30.00 30.00 1000.000
1:GLN_51:N         1:GLN_51:CA        1:GLN_51:C         1:ASN_52:N         20.000 -140.000 30.00 30.00 1000.000
1:THR_54:N         1:THR_54:CA        1:THR_54:C         1:LYS+_55:N        20.000 -140.000 30.00 30.00 1000.000
1:LYS+_55:N        1:LYS+_55:CA       1:LYS+_55:C        1:GLU-_56:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_56:N        1:GLU-_56:CA       1:GLU-_56:C        1:GLU-_57:N        -140.000 80.000 30.00 30.00 1000.000
1:LEU_58:N         1:LEU_58:CA        1:LEU_58:C         1:ASP-_59:N        -140.000 80.000 30.00 30.00 1000.000
1:ASP-_59:N        1:ASP-_59:CA       1:ASP-_59:C        1:ALA_60:N         -140.000 80.000 30.00 30.00 1000.000
1:ALA_60:N         1:ALA_60:CA        1:ALA_60:C         1:ILE_61:N         -140.000 80.000 30.00 30.00 1000.000
1:ILE_62:N         1:ILE_62:CA        1:ILE_62:C         1:GLU-_63:N        -140.000 80.000 30.00 30.00 1000.000
1:ASP-_66:N        1:ASP-_66:CA       1:ASP-_66:C        1:GLU-_67:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_67:N        1:GLU-_67:CA       1:GLU-_67:C        1:ASP-_68:N        -140.000 80.000 30.00 30.00 1000.000
1:ASP-_68:N        1:ASP-_68:CA       1:ASP-_68:C        1:GLY_69:N         -140.000 80.000 30.00 30.00 1000.000
1:SER_70:N         1:SER_70:CA        1:SER_70:C         1:GLY_71:N         -140.000 80.000 30.00 30.00 1000.000
1:THR_72:N         1:THR_72:CA        1:THR_72:C         1:ILE_73:N         20.000 -140.000 30.00 30.00 1000.000
1:ILE_73:N         1:ILE_73:CA        1:ILE_73:C         1:ASP-_74:N        20.000 -140.000 30.00 30.00 1000.000
1:ASP-_74:N        1:ASP-_74:CA       1:ASP-_74:C        1:PHE_75:N         20.000 -140.000 30.00 30.00 1000.000
1:PHE_75:N         1:PHE_75:CA        1:PHE_75:C         1:GLU-_76:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_76:N        1:GLU-_76:CA       1:GLU-_76:C        1:GLU-_77:N        -140.000 80.000 30.00 30.00 1000.000
1:GLU-_77:N        1:GLU-_77:CA       1:GLU-_77:C        1:PHE_78:N         -140.000 80.000 30.00 30.00 1000.000
1:PHE_78:N         1:PHE_78:CA        1:PHE_78:C         1:LEU_79:N         -140.000 80.000 30.00 30.00 1000.000
1:LEU_79:N         1:LEU_79:CA        1:LEU_79:C         1:VAL_80:N         -140.000 80.000 30.00 30.00 1000.000
1:VAL_80:N         1:VAL_80:CA        1:VAL_80:C         1:MET_81:N         -140.000 80.000 30.00 30.00 1000.000
1:MET_81:N         1:MET_81:CA        1:MET_81:C         1:MET_82:N         -140.000 80.000 30.00 30.00 1000.000
1:MET_82:N         1:MET_82:CA        1:MET_82:C         1:VAL_83:N         -140.000 80.000 30.00 30.00 1000.000
1:VAL_83:N         1:VAL_83:CA        1:VAL_83:C         1:ARG+_84:N        -140.000 80.000 30.00 30.00 1000.000
1:ARG+_84:N        1:ARG+_84:CA       1:ARG+_84:C        1:GLN_85:N         -140.000 80.000 30.00 30.00 1000.000
1:GLN_85:N         1:GLN_85:CA        1:GLN_85:C         1:MET_86:N         -140.000 80.000 30.00 30.00 1000.000
1:MET_86:N         1:MET_86:CA        1:MET_86:C         1:LYS+_87:N        -140.000 80.000 30.00 30.00 1000.000
1:ALAN_1:CA        1:ALAN_1:C         1:SER_2:N          1:SER_2:CA         175.000 -175.000 10.00 10.00 1000.000
1:SER_2:CA         1:SER_2:C          1:MET_3:N          1:MET_3:CA         175.000 -175.000 10.00 10.00 1000.000
1:MET_3:CA         1:MET_3:C          1:THR_4:N          1:THR_4:CA         175.000 -175.000 10.00 10.00 1000.000
1:THR_4:CA         1:THR_4:C          1:ASP-_5:N         1:ASP-_5:CA        175.000 -175.000 10.00 10.00 1000.000
1:ASP-_5:CA        1:ASP-_5:C         1:GLN_6:N          1:GLN_6:CA         175.000 -175.000 10.00 10.00 1000.000
1:GLN_6:CA         1:GLN_6:C          1:GLN_7:N          1:GLN_7:CA         175.000 -175.000 10.00 10.00 1000.000
1:GLN_7:CA         1:GLN_7:C          1:ALA_8:N          1:ALA_8:CA         175.000 -175.000 10.00 10.00 1000.000
1:ALA_8:CA         1:ALA_8:C          1:GLU-_9:N         1:GLU-_9:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLU-_9:CA        1:GLU-_9:C         1:ALA_10:N         1:ALA_10:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_10:CA        1:ALA_10:C         1:ARG+_11:N        1:ARG+_11:CA       175.000 -175.000 10.00 10.00 1000.000
1:ARG+_11:CA       1:ARG+_11:C        1:ALA_12:N         1:ALA_12:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_12:CA        1:ALA_12:C         1:PHE_13:N         1:PHE_13:CA        175.000 -175.000 10.00 10.00 1000.000
1:PHE_13:CA        1:PHE_13:C         1:LEU_14:N         1:LEU_14:CA        175.000 -175.000 10.00 10.00 1000.000
1:LEU_14:CA        1:LEU_14:C         1:SER_15:N         1:SER_15:CA        175.000 -175.000 10.00 10.00 1000.000
1:SER_15:CA        1:SER_15:C         1:GLU-_16:N        1:GLU-_16:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_16:CA       1:GLU-_16:C        1:GLU-_17:N        1:GLU-_17:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_17:CA       1:GLU-_17:C        1:MET_18:N         1:MET_18:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_18:CA        1:MET_18:C         1:ILE_19:N         1:ILE_19:CA        175.000 -175.000 10.00 10.00 1000.000
1:ILE_19:CA        1:ILE_19:C         1:ALA_20:N         1:ALA_20:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_20:CA        1:ALA_20:C         1:GLU-_21:N        1:GLU-_21:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_21:CA       1:GLU-_21:C        1:PHE_22:N         1:PHE_22:CA        175.000 -175.000 10.00 10.00 1000.000
1:PHE_22:CA        1:PHE_22:C         1:LYS+_23:N        1:LYS+_23:CA       175.000 -175.000 10.00 10.00 1000.000
1:LYS+_23:CA       1:LYS+_23:C        1:ALA_24:N         1:ALA_24:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_24:CA        1:ALA_24:C         1:ALA_25:N         1:ALA_25:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_25:CA        1:ALA_25:C         1:PHE_26:N         1:PHE_26:CA        175.000 -175.000 10.00 10.00 1000.000
1:PHE_26:CA        1:PHE_26:C         1:ASP-_27:N        1:ASP-_27:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_27:CA       1:ASP-_27:C        1:MET_28:N         1:MET_28:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_28:CA        1:MET_28:C         1:PHE_29:N         1:PHE_29:CA        175.000 -175.000 10.00 10.00 1000.000
1:PHE_29:CA        1:PHE_29:C         1:ASP-_30:N        1:ASP-_30:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_30:CA       1:ASP-_30:C        1:ALA_31:N         1:ALA_31:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_31:CA        1:ALA_31:C         1:ASP-_32:N        1:ASP-_32:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_32:CA       1:ASP-_32:C        1:GLY_33:N         1:GLY_33:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_33:CA        1:GLY_33:C         1:GLY_34:N         1:GLY_34:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_34:CA        1:GLY_34:C         1:GLY_35:N         1:GLY_35:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_35:CA        1:GLY_35:C         1:ASP-_36:N        1:ASP-_36:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_36:CA       1:ASP-_36:C        1:ILE_37:N         1:ILE_37:CA        175.000 -175.000 10.00 10.00 1000.000
1:ILE_37:CA        1:ILE_37:C         1:SER_38:N         1:SER_38:CA        175.000 -175.000 10.00 10.00 1000.000
1:SER_38:CA        1:SER_38:C         1:THR_39:N         1:THR_39:CA        175.000 -175.000 10.00 10.00 1000.000
1:THR_39:CA        1:THR_39:C         1:LYS+_40:N        1:LYS+_40:CA       175.000 -175.000 10.00 10.00 1000.000
1:LYS+_40:CA       1:LYS+_40:C        1:GLU-_41:N        1:GLU-_41:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_41:CA       1:GLU-_41:C        1:LEU_42:N         1:LEU_42:CA        175.000 -175.000 10.00 10.00 1000.000
1:LEU_42:CA        1:LEU_42:C         1:GLY_43:N         1:GLY_43:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_43:CA        1:GLY_43:C         1:THR_44:N         1:THR_44:CA        175.000 -175.000 10.00 10.00 1000.000
1:THR_44:CA        1:THR_44:C         1:VAL_45:N         1:VAL_45:CA        175.000 -175.000 10.00 10.00 1000.000
1:VAL_45:CA        1:VAL_45:C         1:MET_46:N         1:MET_46:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_46:CA        1:MET_46:C         1:ARG+_47:N        1:ARG+_47:CA       175.000 -175.000 10.00 10.00 1000.000
1:ARG+_47:CA       1:ARG+_47:C        1:MET_48:N         1:MET_48:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_48:CA        1:MET_48:C         1:LEU_49:N         1:LEU_49:CA        175.000 -175.000 10.00 10.00 1000.000
1:LEU_49:CA        1:LEU_49:C         1:GLY_50:N         1:GLY_50:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_50:CA        1:GLY_50:C         1:GLN_51:N         1:GLN_51:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLN_51:CA        1:GLN_51:C         1:ASN_52:N         1:ASN_52:CA        175.000 -175.000 10.00 10.00 1000.000
1:ASN_52:CA        1:ASN_52:C         1:PRO_53:N         1:PRO_53:CA        175.000 -175.000 10.00 10.00 1000.000
1:PRO_53:CA        1:PRO_53:C         1:THR_54:N         1:THR_54:CA        175.000 -175.000 10.00 10.00 1000.000
1:THR_54:CA        1:THR_54:C         1:LYS+_55:N        1:LYS+_55:CA       175.000 -175.000 10.00 10.00 1000.000
1:LYS+_55:CA       1:LYS+_55:C        1:GLU-_56:N        1:GLU-_56:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_56:CA       1:GLU-_56:C        1:GLU-_57:N        1:GLU-_57:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_57:CA       1:GLU-_57:C        1:LEU_58:N         1:LEU_58:CA        175.000 -175.000 10.00 10.00 1000.000
1:LEU_58:CA        1:LEU_58:C         1:ASP-_59:N        1:ASP-_59:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_59:CA       1:ASP-_59:C        1:ALA_60:N         1:ALA_60:CA        175.000 -175.000 10.00 10.00 1000.000
1:ALA_60:CA        1:ALA_60:C         1:ILE_61:N         1:ILE_61:CA        175.000 -175.000 10.00 10.00 1000.000
1:ILE_61:CA        1:ILE_61:C         1:ILE_62:N         1:ILE_62:CA        175.000 -175.000 10.00 10.00 1000.000
1:ILE_62:CA        1:ILE_62:C         1:GLU-_63:N        1:GLU-_63:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_63:CA       1:GLU-_63:C        1:GLU-_64:N        1:GLU-_64:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_64:CA       1:GLU-_64:C        1:VAL_65:N         1:VAL_65:CA        175.000 -175.000 10.00 10.00 1000.000
1:VAL_65:CA        1:VAL_65:C         1:ASP-_66:N        1:ASP-_66:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_66:CA       1:ASP-_66:C        1:GLU-_67:N        1:GLU-_67:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_67:CA       1:GLU-_67:C        1:ASP-_68:N        1:ASP-_68:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_68:CA       1:ASP-_68:C        1:GLY_69:N         1:GLY_69:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_69:CA        1:GLY_69:C         1:SER_70:N         1:SER_70:CA        175.000 -175.000 10.00 10.00 1000.000
1:SER_70:CA        1:SER_70:C         1:GLY_71:N         1:GLY_71:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLY_71:CA        1:GLY_71:C         1:THR_72:N         1:THR_72:CA        175.000 -175.000 10.00 10.00 1000.000
1:THR_72:CA        1:THR_72:C         1:ILE_73:N         1:ILE_73:CA        175.000 -175.000 10.00 10.00 1000.000
1:ILE_73:CA        1:ILE_73:C         1:ASP-_74:N        1:ASP-_74:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_74:CA       1:ASP-_74:C        1:PHE_75:N         1:PHE_75:CA        175.000 -175.000 10.00 10.00 1000.000
1:PHE_75:CA        1:PHE_75:C         1:GLU-_76:N        1:GLU-_76:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_76:CA       1:GLU-_76:C        1:GLU-_77:N        1:GLU-_77:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_77:CA       1:GLU-_77:C        1:PHE_78:N         1:PHE_78:CA        175.000 -175.000 10.00 10.00 1000.000
1:PHE_78:CA        1:PHE_78:C         1:LEU_79:N         1:LEU_79:CA        175.000 -175.000 10.00 10.00 1000.000
1:LEU_79:CA        1:LEU_79:C         1:VAL_80:N         1:VAL_80:CA        175.000 -175.000 10.00 10.00 1000.000
1:VAL_80:CA        1:VAL_80:C         1:MET_81:N         1:MET_81:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_81:CA        1:MET_81:C         1:MET_82:N         1:MET_82:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_82:CA        1:MET_82:C         1:VAL_83:N         1:VAL_83:CA        175.000 -175.000 10.00 10.00 1000.000
1:VAL_83:CA        1:VAL_83:C         1:ARG+_84:N        1:ARG+_84:CA       175.000 -175.000 10.00 10.00 1000.000
1:ARG+_84:CA       1:ARG+_84:C        1:GLN_85:N         1:GLN_85:CA        175.000 -175.000 10.00 10.00 1000.000
1:GLN_85:CA        1:GLN_85:C         1:MET_86:N         1:MET_86:CA        175.000 -175.000 10.00 10.00 1000.000
1:MET_86:CA        1:MET_86:C         1:LYS+_87:N        1:LYS+_87:CA       175.000 -175.000 10.00 10.00 1000.000
1:LYS+_87:CA       1:LYS+_87:C        1:GLU-_88:N        1:GLU-_88:CA       175.000 -175.000 10.00 10.00 1000.000
1:GLU-_88:CA       1:GLU-_88:C        1:ASP-_89:N        1:ASP-_89:CA       175.000 -175.000 10.00 10.00 1000.000
1:ASP-_89:CA       1:ASP-_89:C        1:ALAC_90:N        1:ALAC_90:CA       175.000 -175.000 10.00 10.00 1000.000

  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had  660 H/Q atoms
  Start of MODEL    1
    1   1H    ALA   1          1H        ALA   1 -21.187  13.582 -12.203
    2   2H    ALA   1          2H        ALA   1 -22.348  13.960 -13.360
    3   3H    ALA   1          3H        ALA   1 -22.550  12.612 -12.374
    4    HA   ALA   1           HA       ALA   1 -21.878  11.645 -14.292
    5   1HB   ALA   1          1HB       ALA   1 -19.675  12.869 -15.418
    6   2HB   ALA   1          2HB       ALA   1 -20.466  14.285 -14.698
    7   3HB   ALA   1          3HB       ALA   1 -21.348  13.274 -15.871
    8    H    SER   2           H        SER   2 -21.260  11.094 -11.701
    9    HA   SER   2           HA       SER   2 -18.253  10.529 -11.540
   10   1HB   SER   2          1HB       SER   2 -19.916  10.131  -9.077
   11   2HB   SER   2          2HB       SER   2 -18.312  10.842  -9.275
   12    HG   SER   2           HG       SER   2 -20.073  12.280  -8.726
   13    H    MET   3           H        MET   3 -18.277   8.691 -12.832
   14    HA   MET   3           HA       MET   3 -19.797   6.235 -11.798
   15   1HB   MET   3          1HB       MET   3 -19.611   5.281 -14.080
   16   2HB   MET   3          2HB       MET   3 -20.526   6.777 -14.053
   17   1HG   MET   3          1HG       MET   3 -18.599   8.036 -15.019
   18   2HG   MET   3          2HG       MET   3 -17.565   6.607 -14.898
   19   1HE   MET   3          1HE       MET   3 -16.882   6.473 -17.442
   20   2HE   MET   3          2HE       MET   3 -17.736   8.025 -17.680
   21   3HE   MET   3          3HE       MET   3 -18.047   6.660 -18.792
   22    H    THR   4           H        THR   4 -16.741   7.434 -13.179
   23    HA   THR   4           HA       THR   4 -15.234   5.000 -12.197
   24    HB   THR   4           HB       THR   4 -13.243   6.275 -13.379
   25    HG1  THR   4           HG1      THR   4 -14.053   8.065 -14.030
   26   1HG2  THR   4          1HG2      THR   4 -13.736   4.178 -14.378
   27   2HG2  THR   4          2HG2      THR   4 -14.050   5.320 -15.703
   28   3HG2  THR   4          3HG2      THR   4 -15.408   4.620 -14.785
   29    H    ASP   5           H        ASP   5 -16.145   6.185 -10.081
   30    HA   ASP   5           HA       ASP   5 -14.627   8.385  -8.870
   31   1HB   ASP   5          1HB       ASP   5 -15.700   6.322  -6.974
   32   2HB   ASP   5          2HB       ASP   5 -15.828   8.066  -6.947
   33    H    GLN   6           H        GLN   6 -14.048   4.962  -9.260
   34    HA   GLN   6           HA       GLN   6 -12.219   4.239  -7.214
   35   1HB   GLN   6          1HB       GLN   6 -12.721   3.295  -9.994
   36   2HB   GLN   6          2HB       GLN   6 -12.592   2.404  -8.489
   37   1HG   GLN   6          1HG       GLN   6  -9.965   2.928  -8.717
   38   2HG   GLN   6          2HG       GLN   6 -10.352   3.229 -10.397
   39   1HE2  GLN   6          1HE2      GLN   6 -10.200  -0.255 -11.133
   40   2HE2  GLN   6          2HE2      GLN   6 -10.100   1.492 -11.684
   41    H    GLN   7           H        GLN   7 -11.134   5.315 -10.455
   42    HA   GLN   7           HA       GLN   7  -8.390   6.017  -9.400
   43   1HB   GLN   7          1HB       GLN   7  -9.284   6.496 -12.293
   44   2HB   GLN   7          2HB       GLN   7  -7.671   6.214 -11.653
   45   1HG   GLN   7          1HG       GLN   7  -7.802   3.999 -12.030
   46   2HG   GLN   7          2HG       GLN   7  -9.233   3.841 -11.023
   47   1HE2  GLN   7          1HE2      GLN   7 -11.313   4.606 -14.164
   48   2HE2  GLN   7          2HE2      GLN   7 -11.048   5.445 -12.554
   49    H    ALA   8           H        ALA   8 -11.290   7.603 -10.643
   50    HA   ALA   8           HA       ALA   8 -10.471  10.271 -11.181
   51   1HB   ALA   8          1HB       ALA   8 -12.777  10.988 -10.576
   52   2HB   ALA   8          2HB       ALA   8 -12.796   9.486 -11.521
   53   3HB   ALA   8          3HB       ALA   8 -13.083   9.434  -9.763
   54    H    GLU   9           H        GLU   9 -10.947   8.698  -8.054
   55    HA   GLU   9           HA       GLU   9 -10.780  11.138  -6.372
   56   1HB   GLU   9          1HB       GLU   9 -11.158   9.812  -4.521
   57   2HB   GLU   9          2HB       GLU   9 -11.867   8.810  -5.779
   58   1HG   GLU   9          1HG       GLU   9  -8.950   8.306  -4.981
   59   2HG   GLU   9          2HG       GLU   9 -10.085   7.203  -5.751
   60    H    ALA  10           H        ALA  10  -8.514   8.621  -7.413
   61    HA   ALA  10           HA       ALA  10  -6.226   9.439  -5.730
   62   1HB   ALA  10          1HB       ALA  10  -4.904   7.871  -7.141
   63   2HB   ALA  10          2HB       ALA  10  -6.429   7.133  -6.614
   64   3HB   ALA  10          3HB       ALA  10  -6.255   7.714  -8.290
   65    NH1  ARG  11           NH1      ARG  11 -10.170  13.199 -14.653
   66    NH2  ARG  11           NH2      ARG  11  -9.438  11.114 -15.177
   67    H    ARG  11           H        ARG  11  -7.506  10.464  -8.812
   68    HA   ARG  11           HA       ARG  11  -5.046  11.681  -9.971
   69   1HB   ARG  11          1HB       ARG  11  -6.842  10.949 -11.479
   70   2HB   ARG  11          2HB       ARG  11  -8.020  11.967 -10.664
   71   1HG   ARG  11          1HG       ARG  11  -6.336  13.966 -11.364
   72   2HG   ARG  11          2HG       ARG  11  -5.830  12.812 -12.600
   73   1HD   ARG  11          1HD       ARG  11  -8.814  13.383 -12.166
   74   2HD   ARG  11          2HD       ARG  11  -7.839  14.492 -13.133
   75    HE   ARG  11           HE       ARG  11  -7.247  12.031 -14.344
   76   1HH1  ARG  11          1HH1      ARG  11  -9.983  14.091 -14.181
   77   2HH1  ARG  11          2HH1      ARG  11 -11.019  12.944 -15.169
   78   1HH2  ARG  11          1HH2      ARG  11  -8.666  10.438 -15.162
   79   2HH2  ARG  11          2HH2      ARG  11 -10.361  10.984 -15.607
   80    H    ALA  12           H        ALA  12  -7.851  12.823  -8.121
   81    HA   ALA  12           HA       ALA  12  -7.177  15.727  -8.268
   82   1HB   ALA  12          1HB       ALA  12  -9.066  16.025  -6.678
   83   2HB   ALA  12          2HB       ALA  12  -9.532  14.996  -8.046
   84   3HB   ALA  12          3HB       ALA  12  -9.199  14.263  -6.457
   85    H    PHE  13           H        PHE  13  -6.622  13.040  -6.052
   86    HA   PHE  13           HA       PHE  13  -5.629  14.591  -3.758
   87   1HB   PHE  13          1HB       PHE  13  -5.083  11.638  -4.405
   88   2HB   PHE  13          2HB       PHE  13  -6.576  12.214  -3.710
   89    HD1  PHE  13           HD1      PHE  13  -5.770  10.425  -1.913
   90    HD2  PHE  13           HD2      PHE  13  -3.801  14.210  -2.489
   91    HE1  PHE  13           HE1      PHE  13  -4.703  10.220   0.295
   92    HE2  PHE  13           HE2      PHE  13  -2.744  13.984  -0.280
   93    HZ   PHE  13           HZ       PHE  13  -3.189  11.994   1.115
   94    H    LEU  14           H        LEU  14  -4.127  12.956  -6.525
   95    HA   LEU  14           HA       LEU  14  -1.312  13.814  -5.694
   96   1HB   LEU  14          1HB       LEU  14  -0.432  12.209  -7.244
   97   2HB   LEU  14          2HB       LEU  14  -1.951  12.035  -8.096
   98    HG   LEU  14           HG       LEU  14  -2.845  11.045  -5.761
   99   1HD1  LEU  14          1HD1      LEU  14  -2.256   8.753  -6.558
  100   2HD1  LEU  14          2HD1      LEU  14  -2.756   9.779  -7.914
  101   3HD1  LEU  14          3HD1      LEU  14  -1.029   9.423  -7.663
  102   1HD2  LEU  14          1HD2      LEU  14   0.193  10.506  -5.521
  103   2HD2  LEU  14          2HD2      LEU  14  -0.791  11.481  -4.402
  104   3HD2  LEU  14          3HD2      LEU  14  -1.079   9.740  -4.536
  105    H    SER  15           H        SER  15  -0.801  15.743  -6.364
  106    HA   SER  15           HA       SER  15  -2.052  17.184  -8.646
  107   1HB   SER  15          1HB       SER  15   0.517  18.144  -7.338
  108   2HB   SER  15          2HB       SER  15  -0.847  19.074  -7.962
  109    HG   SER  15           HG       SER  15  -1.247  19.103  -5.902
  110    H    GLU  16           H        GLU  16   0.121  18.473  -9.785
  111    HA   GLU  16           HA       GLU  16   1.041  16.453 -11.807
  112   1HB   GLU  16          1HB       GLU  16   0.205  18.654 -12.547
  113   2HB   GLU  16          2HB       GLU  16   1.476  19.486 -11.673
  114   1HG   GLU  16          1HG       GLU  16   1.818  17.647 -14.126
  115   2HG   GLU  16          2HG       GLU  16   3.185  18.216 -13.183
  116    H    GLU  17           H        GLU  17   2.317  18.332  -9.137
  117    HA   GLU  17           HA       GLU  17   5.209  17.943  -9.748
  118   1HB   GLU  17          1HB       GLU  17   3.911  19.738  -8.153
  119   2HB   GLU  17          2HB       GLU  17   4.422  18.604  -6.917
  120   1HG   GLU  17          1HG       GLU  17   6.837  18.861  -8.135
  121   2HG   GLU  17          2HG       GLU  17   6.284  19.984  -6.904
  122    H    MET  18           H        MET  18   2.747  16.347  -7.792
  123    HA   MET  18           HA       MET  18   4.631  14.445  -6.422
  124   1HB   MET  18          1HB       MET  18   1.554  14.429  -6.475
  125   2HB   MET  18          2HB       MET  18   2.562  13.360  -5.517
  126   1HG   MET  18          1HG       MET  18   2.809  16.402  -5.175
  127   2HG   MET  18          2HG       MET  18   3.302  15.124  -4.052
  128   1HE   MET  18          1HE       MET  18   1.947  14.487  -2.041
  129   2HE   MET  18          2HE       MET  18   0.200  14.115  -2.127
  130   3HE   MET  18          3HE       MET  18   1.353  13.221  -3.162
  131    H    ILE  19           H        ILE  19   2.401  14.500  -9.156
  132    HA   ILE  19           HA       ILE  19   2.405  11.632  -9.795
  133    HB   ILE  19           HB       ILE  19   1.641  14.103 -11.392
  134   1HG1  ILE  19          1HG1      ILE  19   0.127  12.946  -9.555
  135   2HG1  ILE  19          2HG1      ILE  19  -0.091  11.653 -10.716
  136   1HG2  ILE  19          1HG2      ILE  19   0.926  12.679 -13.328
  137   2HG2  ILE  19          2HG2      ILE  19   2.669  12.561 -13.097
  138   3HG2  ILE  19          3HG2      ILE  19   1.619  11.234 -12.551
  139   1HD1  ILE  19          1HD1      ILE  19  -1.162  13.154 -12.372
  140   2HD1  ILE  19          2HD1      ILE  19  -1.976  13.277 -10.798
  141   3HD1  ILE  19          3HD1      ILE  19  -0.866  14.566 -11.321
  142    H    ALA  20           H        ALA  20   4.484  14.371 -10.593
  143    HA   ALA  20           HA       ALA  20   6.122  13.187 -12.689
  144   1HB   ALA  20          1HB       ALA  20   7.750  15.004 -12.184
  145   2HB   ALA  20          2HB       ALA  20   6.088  15.623 -12.257
  146   3HB   ALA  20          3HB       ALA  20   6.887  15.400 -10.679
  147    H    GLU  21           H        GLU  21   6.249  13.010  -9.173
  148    HA   GLU  21           HA       GLU  21   8.985  12.047  -8.790
  149   1HB   GLU  21          1HB       GLU  21   8.030  11.108  -6.565
  150   2HB   GLU  21          2HB       GLU  21   6.488  11.793  -7.041
  151   1HG   GLU  21          1HG       GLU  21   7.384  14.083  -6.986
  152   2HG   GLU  21          2HG       GLU  21   9.040  13.512  -6.878
  153    H    PHE  22           H        PHE  22   5.918  10.487  -9.532
  154    HA   PHE  22           HA       PHE  22   7.034   7.684  -9.372
  155   1HB   PHE  22          1HB       PHE  22   4.205   8.558 -10.218
  156   2HB   PHE  22          2HB       PHE  22   4.735   6.933  -9.876
  157    HD1  PHE  22           HD1      PHE  22   6.034   6.744  -7.393
  158    HD2  PHE  22           HD2      PHE  22   2.933   9.537  -8.449
  159    HE1  PHE  22           HE1      PHE  22   5.560   7.134  -5.012
  160    HE2  PHE  22           HE2      PHE  22   2.472   9.910  -6.060
  161    HZ   PHE  22           HZ       PHE  22   3.816   8.752  -4.340
  162    H    LYS  23           H        LYS  23   6.373  10.168 -11.728
  163    HA   LYS  23           HA       LYS  23   5.997   8.786 -14.213
  164   1HB   LYS  23          1HB       LYS  23   6.997  11.471 -13.436
  165   2HB   LYS  23          2HB       LYS  23   7.818  10.878 -14.863
  166   1HG   LYS  23          1HG       LYS  23   5.080  10.340 -15.421
  167   2HG   LYS  23          2HG       LYS  23   5.042  11.852 -14.529
  168   1HD   LYS  23          1HD       LYS  23   5.195  12.155 -17.045
  169   2HD   LYS  23          2HD       LYS  23   6.786  11.386 -17.032
  170   1HE   LYS  23          1HE       LYS  23   7.806  13.202 -15.790
  171   2HE   LYS  23          2HE       LYS  23   6.245  13.845 -15.258
  172   1HZ   LYS  23          1HZ       LYS  23   5.860  14.155 -17.803
  173   2HZ   LYS  23          2HZ       LYS  23   7.505  14.052 -17.917
  174   3HZ   LYS  23          3HZ       LYS  23   6.813  15.233 -16.993
  175    H    ALA  24           H        ALA  24   9.043   9.582 -12.534
  176    HA   ALA  24           HA       ALA  24  10.905   8.558 -14.541
  177   1HB   ALA  24          1HB       ALA  24  12.616   8.663 -12.738
  178   2HB   ALA  24          2HB       ALA  24  11.623  10.132 -12.769
  179   3HB   ALA  24          3HB       ALA  24  11.351   8.902 -11.509
  180    H    ALA  25           H        ALA  25   9.765   7.129 -11.460
  181    HA   ALA  25           HA       ALA  25  11.071   4.495 -11.866
  182   1HB   ALA  25          1HB       ALA  25   9.889   3.835  -9.780
  183   2HB   ALA  25          2HB       ALA  25  10.680   5.412  -9.593
  184   3HB   ALA  25          3HB       ALA  25   8.914   5.324  -9.818
  185    H    PHE  26           H        PHE  26   8.331   5.862 -13.274
  186    HA   PHE  26           HA       PHE  26   6.455   3.529 -13.192
  187   1HB   PHE  26          1HB       PHE  26   5.440   5.722 -13.313
  188   2HB   PHE  26          2HB       PHE  26   6.377   6.199 -14.704
  189    HD1  PHE  26           HD1      PHE  26   5.119   6.256 -16.725
  190    HD2  PHE  26           HD2      PHE  26   4.104   3.268 -13.801
  191    HE1  PHE  26           HE1      PHE  26   3.295   5.447 -18.168
  192    HE2  PHE  26           HE2      PHE  26   2.286   2.473 -15.258
  193    HZ   PHE  26           HZ       PHE  26   1.905   3.531 -17.458
  194    H    ASP  27           H        ASP  27   8.473   5.147 -15.659
  195    HA   ASP  27           HA       ASP  27   8.034   3.209 -17.815
  196   1HB   ASP  27          1HB       ASP  27  10.087   4.230 -18.908
  197   2HB   ASP  27          2HB       ASP  27  10.351   5.192 -17.472
  198    H    MET  28           H        MET  28  10.500   3.539 -15.291
  199    HA   MET  28           HA       MET  28  12.338   1.406 -15.862
  200   1HB   MET  28          1HB       MET  28  11.298   2.482 -13.207
  201   2HB   MET  28          2HB       MET  28  12.881   2.660 -13.941
  202   1HG   MET  28          1HG       MET  28  11.781   0.295 -12.367
  203   2HG   MET  28          2HG       MET  28  13.022  -0.022 -13.591
  204   1HE   MET  28          1HE       MET  28  13.350  -0.518 -10.380
  205   2HE   MET  28          2HE       MET  28  14.068   0.839  -9.462
  206   3HE   MET  28          3HE       MET  28  12.359   0.921  -9.981
  207    H    PHE  29           H        PHE  29   9.268   1.205 -14.041
  208    HA   PHE  29           HA       PHE  29   9.218  -1.649 -13.590
  209   1HB   PHE  29          1HB       PHE  29   7.558   0.392 -12.812
  210   2HB   PHE  29          2HB       PHE  29   6.548  -0.295 -14.055
  211    HD1  PHE  29           HD1      PHE  29   8.119  -0.934 -10.741
  212    HD2  PHE  29           HD2      PHE  29   5.579  -2.602 -13.791
  213    HE1  PHE  29           HE1      PHE  29   7.245  -2.578  -9.131
  214    HE2  PHE  29           HE2      PHE  29   4.726  -4.242 -12.167
  215    HZ   PHE  29           HZ       PHE  29   5.535  -4.219  -9.834
  216    H    ASP  30           H        ASP  30   7.635   0.251 -16.180
  217    HA   ASP  30           HA       ASP  30   6.409  -1.983 -17.603
  218   1HB   ASP  30          1HB       ASP  30   5.679   0.398 -17.903
  219   2HB   ASP  30          2HB       ASP  30   7.167   0.763 -18.745
  220    H    ALA  31           H        ALA  31   8.934   0.033 -19.086
  221    HA   ALA  31           HA       ALA  31  11.082  -0.547 -20.077
  222   1HB   ALA  31          1HB       ALA  31  11.993  -2.855 -19.837
  223   2HB   ALA  31          2HB       ALA  31  11.464  -2.192 -18.279
  224   3HB   ALA  31          3HB       ALA  31  10.469  -3.415 -19.110
  225    H    ASP  32           H        ASP  32   8.343  -0.544 -21.238
  226    HA   ASP  32           HA       ASP  32   8.957  -1.974 -23.858
  227   1HB   ASP  32          1HB       ASP  32   6.225  -2.128 -22.460
  228   2HB   ASP  32          2HB       ASP  32   7.348  -3.447 -22.693
  229    H    GLY  33           H        GLY  33   9.391   0.704 -23.015
  230   1HA   GLY  33          1HA       GLY  33   9.304   2.643 -24.645
  231   2HA   GLY  33          2HA       GLY  33   7.678   2.154 -25.062
  232    H    GLY  34           H        GLY  34   6.548   1.854 -22.522
  233   1HA   GLY  34          1HA       GLY  34   6.285   3.054 -20.286
  234   2HA   GLY  34          2HA       GLY  34   6.960   4.503 -21.043
  235    H    GLY  35           H        GLY  35   4.233   2.239 -21.435
  236   1HA   GLY  35          1HA       GLY  35   2.310   4.587 -21.901
  237   2HA   GLY  35          2HA       GLY  35   2.348   3.260 -23.070
  238    H    ASP  36           H        ASP  36   2.688   1.066 -21.460
  239    HA   ASP  36           HA       ASP  36   0.751   0.931 -19.193
  240   1HB   ASP  36          1HB       ASP  36  -0.743  -0.830 -20.427
  241   2HB   ASP  36          2HB       ASP  36  -1.068   0.878 -20.613
  242    H    ILE  37           H        ILE  37   1.245  -0.725 -17.936
  243    HA   ILE  37           HA       ILE  37   3.482  -2.592 -18.724
  244    HB   ILE  37           HB       ILE  37   2.443  -3.095 -16.036
  245   1HG1  ILE  37          1HG1      ILE  37   2.810  -0.198 -16.724
  246   2HG1  ILE  37          2HG1      ILE  37   1.911  -0.949 -15.420
  247   1HG2  ILE  37          1HG2      ILE  37   4.825  -2.990 -15.418
  248   2HG2  ILE  37          2HG2      ILE  37   4.637  -3.906 -16.920
  249   3HG2  ILE  37          3HG2      ILE  37   5.244  -2.233 -16.974
  250   1HD1  ILE  37          1HD1      ILE  37   4.952  -0.472 -15.389
  251   2HD1  ILE  37          2HD1      ILE  37   3.710   0.381 -14.447
  252   3HD1  ILE  37          3HD1      ILE  37   4.046  -1.334 -14.116
  253    H    SER  38           H        SER  38   3.070  -4.843 -17.354
  254    HA   SER  38           HA       SER  38   0.331  -5.996 -17.974
  255   1HB   SER  38          1HB       SER  38   0.977  -7.588 -19.565
  256   2HB   SER  38          2HB       SER  38   1.859  -6.147 -20.078
  257    HG   SER  38           HG       SER  38   2.974  -8.274 -19.851
  258    H    THR  39           H        THR  39   0.971  -8.647 -17.687
  259    HA   THR  39           HA       THR  39   1.523  -8.872 -14.734
  260    HB   THR  39           HB       THR  39   1.060 -11.452 -15.372
  261    HG1  THR  39           HG1      THR  39   0.872 -10.623 -17.630
  262   1HG2  THR  39          1HG2      THR  39  -1.315 -11.168 -14.819
  263   2HG2  THR  39          2HG2      THR  39  -0.357 -10.080 -13.788
  264   3HG2  THR  39          3HG2      THR  39  -1.256  -9.428 -15.184
  265    H    LYS  40           H        LYS  40   2.884  -9.960 -17.831
  266    HA   LYS  40           HA       LYS  40   5.092 -11.569 -16.703
  267   1HB   LYS  40          1HB       LYS  40   3.987 -11.606 -19.092
  268   2HB   LYS  40          2HB       LYS  40   5.137 -10.368 -19.527
  269   1HG   LYS  40          1HG       LYS  40   5.923 -13.079 -18.272
  270   2HG   LYS  40          2HG       LYS  40   7.010 -11.943 -19.028
  271   1HD   LYS  40          1HD       LYS  40   6.075 -14.202 -20.294
  272   2HD   LYS  40          2HD       LYS  40   4.808 -13.094 -20.735
  273   1HE   LYS  40          1HE       LYS  40   5.982 -12.108 -22.355
  274   2HE   LYS  40          2HE       LYS  40   7.348 -11.752 -21.306
  275   1HZ   LYS  40          1HZ       LYS  40   7.053 -14.528 -22.239
  276   2HZ   LYS  40          2HZ       LYS  40   8.428 -13.642 -22.002
  277   3HZ   LYS  40          3HZ       LYS  40   7.511 -13.398 -23.354
  278    H    GLU  41           H        GLU  41   5.040  -8.420 -18.420
  279    HA   GLU  41           HA       GLU  41   7.741  -7.563 -18.046
  280   1HB   GLU  41          1HB       GLU  41   7.159  -5.452 -18.743
  281   2HB   GLU  41          2HB       GLU  41   5.670  -5.403 -17.824
  282   1HG   GLU  41          1HG       GLU  41   6.027  -7.064 -20.399
  283   2HG   GLU  41          2HG       GLU  41   4.543  -6.884 -19.488
  284    H    LEU  42           H        LEU  42   4.976  -7.319 -15.852
  285    HA   LEU  42           HA       LEU  42   6.228  -5.641 -13.779
  286   1HB   LEU  42          1HB       LEU  42   3.930  -5.589 -13.541
  287   2HB   LEU  42          2HB       LEU  42   3.703  -7.258 -14.017
  288    HG   LEU  42           HG       LEU  42   4.165  -8.108 -11.810
  289   1HD1  LEU  42          1HD1      LEU  42   5.045  -6.710  -9.920
  290   2HD1  LEU  42          2HD1      LEU  42   6.201  -6.786 -11.259
  291   3HD1  LEU  42          3HD1      LEU  42   5.224  -5.316 -11.016
  292   1HD2  LEU  42          1HD2      LEU  42   2.561  -5.489 -11.423
  293   2HD2  LEU  42          2HD2      LEU  42   1.899  -7.048 -11.975
  294   3HD2  LEU  42          3HD2      LEU  42   2.545  -6.899 -10.331
  295    H    GLY  43           H        GLY  43   5.793  -9.148 -14.193
  296   1HA   GLY  43          1HA       GLY  43   6.691 -10.210 -11.691
  297   2HA   GLY  43          2HA       GLY  43   6.939 -11.044 -13.230
  298    H    THR  44           H        THR  44   8.546  -8.882 -14.376
  299    HA   THR  44           HA       THR  44  11.183  -9.941 -13.744
  300    HB   THR  44           HB       THR  44  10.619  -7.312 -15.207
  301    HG1  THR  44           HG1      THR  44  11.155  -9.723 -16.482
  302   1HG2  THR  44          1HG2      THR  44  12.762  -7.766 -16.414
  303   2HG2  THR  44          2HG2      THR  44  13.042  -7.528 -14.676
  304   3HG2  THR  44          3HG2      THR  44  13.070  -9.172 -15.365
  305    H    VAL  45           H        VAL  45   9.867  -6.668 -13.146
  306    HA   VAL  45           HA       VAL  45  12.111  -5.645 -11.592
  307    HB   VAL  45           HB       VAL  45   9.421  -4.667 -12.285
  308   1HG1  VAL  45          1HG1      VAL  45   9.166  -3.006 -10.441
  309   2HG1  VAL  45          2HG1      VAL  45   9.030  -4.651  -9.809
  310   3HG1  VAL  45          3HG1      VAL  45  10.533  -3.735  -9.558
  311   1HG2  VAL  45          1HG2      VAL  45  12.045  -3.153 -11.670
  312   2HG2  VAL  45          2HG2      VAL  45  11.501  -3.681 -13.280
  313   3HG2  VAL  45          3HG2      VAL  45  10.578  -2.452 -12.403
  314    H    MET  46           H        MET  46   9.191  -7.442 -10.750
  315    HA   MET  46           HA       MET  46   9.242  -7.134  -7.841
  316   1HB   MET  46          1HB       MET  46   8.041  -9.624  -8.170
  317   2HB   MET  46          2HB       MET  46   7.806  -8.927  -9.762
  318   1HG   MET  46          1HG       MET  46   7.070  -6.846  -7.885
  319   2HG   MET  46          2HG       MET  46   6.023  -7.748  -8.994
  320   1HE   MET  46          1HE       MET  46   5.896  -6.587  -5.648
  321   2HE   MET  46          2HE       MET  46   5.912  -7.959  -4.500
  322   3HE   MET  46          3HE       MET  46   7.430  -7.438  -5.286
  323    NH1  ARG  47           NH1      ARG  47  14.889 -15.750 -10.030
  324    NH2  ARG  47           NH2      ARG  47  16.843 -14.642 -10.370
  325    H    ARG  47           H        ARG  47  10.757  -9.406 -10.079
  326    HA   ARG  47           HA       ARG  47  11.722 -11.426  -8.203
  327   1HB   ARG  47          1HB       ARG  47  11.772 -11.153 -10.974
  328   2HB   ARG  47          2HB       ARG  47  13.467 -10.910 -10.575
  329   1HG   ARG  47          1HG       ARG  47  11.767 -13.378  -9.890
  330   2HG   ARG  47          2HG       ARG  47  13.114 -13.280 -11.025
  331   1HD   ARG  47          1HD       ARG  47  13.711 -12.513  -8.130
  332   2HD   ARG  47          2HD       ARG  47  13.398 -14.209  -8.468
  333    HE   ARG  47           HE       ARG  47  15.785 -12.691  -9.461
  334   1HH1  ARG  47          1HH1      ARG  47  13.920 -15.713  -9.693
  335   2HH1  ARG  47          2HH1      ARG  47  15.372 -16.565 -10.424
  336   1HH2  ARG  47          1HH2      ARG  47  17.367 -13.763 -10.295
  337   2HH2  ARG  47          2HH2      ARG  47  17.189 -15.534 -10.740
  338    H    MET  48           H        MET  48  12.966  -8.295  -9.204
  339    HA   MET  48           HA       MET  48  15.726  -8.342  -8.510
  340   1HB   MET  48          1HB       MET  48  15.749  -6.055  -8.609
  341   2HB   MET  48          2HB       MET  48  14.183  -6.326  -9.350
  342   1HG   MET  48          1HG       MET  48  13.263  -4.921  -7.812
  343   2HG   MET  48          2HG       MET  48  13.594  -6.123  -6.554
  344   1HE   MET  48          1HE       MET  48  14.024  -2.529  -7.449
  345   2HE   MET  48          2HE       MET  48  15.753  -2.127  -7.231
  346   3HE   MET  48          3HE       MET  48  15.233  -3.091  -8.645
  347    H    LEU  49           H        LEU  49  12.909  -8.225  -6.397
  348    HA   LEU  49           HA       LEU  49  13.971  -7.595  -3.826
  349   1HB   LEU  49          1HB       LEU  49  12.245  -9.867  -3.404
  350   2HB   LEU  49          2HB       LEU  49  11.614  -9.042  -4.812
  351    HG   LEU  49           HG       LEU  49  11.875  -7.987  -1.955
  352   1HD1  LEU  49          1HD1      LEU  49  11.325  -5.678  -2.729
  353   2HD1  LEU  49          2HD1      LEU  49  12.892  -6.198  -3.375
  354   3HD1  LEU  49          3HD1      LEU  49  11.458  -6.187  -4.431
  355   1HD2  LEU  49          1HD2      LEU  49   9.518  -7.995  -3.960
  356   2HD2  LEU  49          2HD2      LEU  49   9.711  -9.084  -2.565
  357   3HD2  LEU  49          3HD2      LEU  49   9.466  -7.351  -2.300
  358    H    GLY  50           H        GLY  50  13.384 -11.000  -4.689
  359   1HA   GLY  50          1HA       GLY  50  15.867 -12.274  -4.751
  360   2HA   GLY  50          2HA       GLY  50  15.753 -11.904  -3.026
  361    H    GLN  51           H        GLN  51  13.970 -13.455  -5.676
  362    HA   GLN  51           HA       GLN  51  13.046 -15.756  -3.941
  363   1HB   GLN  51          1HB       GLN  51  10.611 -14.839  -5.147
  364   2HB   GLN  51          2HB       GLN  51  11.330 -13.425  -4.398
  365   1HG   GLN  51          1HG       GLN  51  10.279 -15.951  -3.096
  366   2HG   GLN  51          2HG       GLN  51  11.640 -15.185  -2.308
  367   1HE2  GLN  51          1HE2      GLN  51   9.540 -12.050  -1.825
  368   2HE2  GLN  51          2HE2      GLN  51  11.107 -12.465  -2.687
  369    H    ASN  52           H        ASN  52  11.066 -16.675  -5.626
  370    HA   ASN  52           HA       ASN  52  12.142 -16.695  -8.447
  371   1HB   ASN  52          1HB       ASN  52  13.129 -18.639  -6.946
  372   2HB   ASN  52          2HB       ASN  52  11.568 -19.408  -7.135
  373   1HD2  ASN  52          1HD2      ASN  52  13.094 -20.868 -10.069
  374   2HD2  ASN  52          2HD2      ASN  52  12.213 -21.086  -8.474
  375    HA   PRO  53           HA       PRO  53   7.406 -16.673  -8.254
  376   1HB   PRO  53          1HB       PRO  53   7.367 -14.339  -8.512
  377   2HB   PRO  53          2HB       PRO  53   6.951 -14.773 -10.178
  378   1HG   PRO  53          1HG       PRO  53   9.112 -14.448 -11.030
  379   2HG   PRO  53          2HG       PRO  53   9.154 -13.226  -9.738
  380   1HD   PRO  53          1HD       PRO  53  10.585 -14.596  -8.377
  381   2HD   PRO  53          2HD       PRO  53  10.966 -15.395  -9.931
  382    H    THR  54           H        THR  54   5.767 -16.744 -10.223
  383    HA   THR  54           HA       THR  54   6.810 -18.312 -12.610
  384    HB   THR  54           HB       THR  54   5.927 -19.777 -10.505
  385    HG1  THR  54           HG1      THR  54   5.459 -20.321 -13.242
  386   1HG2  THR  54          1HG2      THR  54   3.662 -20.678 -10.928
  387   2HG2  THR  54          2HG2      THR  54   3.558 -18.941 -10.561
  388   3HG2  THR  54          3HG2      THR  54   3.394 -19.508 -12.243
  389    H    LYS  55           H        LYS  55   5.077 -18.613 -14.236
  390    HA   LYS  55           HA       LYS  55   3.952 -16.006 -14.947
  391   1HB   LYS  55          1HB       LYS  55   3.444 -18.773 -16.214
  392   2HB   LYS  55          2HB       LYS  55   2.874 -17.266 -16.901
  393   1HG   LYS  55          1HG       LYS  55   4.931 -16.648 -17.711
  394   2HG   LYS  55          2HG       LYS  55   5.832 -17.322 -16.365
  395   1HD   LYS  55          1HD       LYS  55   6.459 -18.711 -18.228
  396   2HD   LYS  55          2HD       LYS  55   4.840 -18.683 -18.909
  397   1HE   LYS  55          1HE       LYS  55   4.995 -20.021 -16.229
  398   2HE   LYS  55          2HE       LYS  55   4.095 -20.502 -17.666
  399   1HZ   LYS  55          1HZ       LYS  55   6.615 -21.426 -16.760
  400   2HZ   LYS  55          2HZ       LYS  55   6.811 -20.801 -18.277
  401   3HZ   LYS  55          3HZ       LYS  55   5.705 -21.999 -18.014
  402    H    GLU  56           H        GLU  56   2.570 -19.025 -13.702
  403    HA   GLU  56           HA       GLU  56  -0.270 -18.301 -13.927
  404   1HB   GLU  56          1HB       GLU  56   1.275 -20.523 -12.618
  405   2HB   GLU  56          2HB       GLU  56  -0.314 -20.205 -11.951
  406   1HG   GLU  56          1HG       GLU  56  -0.258 -20.375 -14.962
  407   2HG   GLU  56          2HG       GLU  56   0.246 -21.846 -14.147
  408    H    GLU  57           H        GLU  57   2.156 -18.074 -11.345
  409    HA   GLU  57           HA       GLU  57   0.346 -17.215  -9.175
  410   1HB   GLU  57          1HB       GLU  57   3.373 -17.172  -9.457
  411   2HB   GLU  57          2HB       GLU  57   2.370 -18.245  -8.506
  412   1HG   GLU  57          1HG       GLU  57   2.377 -15.259  -7.807
  413   2HG   GLU  57          2HG       GLU  57   2.027 -16.628  -6.759
  414    H    LEU  58           H        LEU  58   2.225 -15.576 -11.661
  415    HA   LEU  58           HA       LEU  58   2.147 -12.863 -10.579
  416   1HB   LEU  58          1HB       LEU  58   2.754 -14.055 -13.315
  417   2HB   LEU  58          2HB       LEU  58   2.546 -12.321 -13.172
  418    HG   LEU  58           HG       LEU  58   4.580 -13.998 -11.561
  419   1HD1  LEU  58          1HD1      LEU  58   4.483 -10.920 -11.824
  420   2HD1  LEU  58          2HD1      LEU  58   3.854 -11.795 -10.421
  421   3HD1  LEU  58          3HD1      LEU  58   5.589 -11.880 -10.809
  422   1HD2  LEU  58          1HD2      LEU  58   6.311 -13.127 -13.088
  423   2HD2  LEU  58          2HD2      LEU  58   5.037 -13.901 -14.063
  424   3HD2  LEU  58          3HD2      LEU  58   5.115 -12.133 -13.958
  425    H    ASP  59           H        ASP  59   0.004 -14.755 -12.635
  426    HA   ASP  59           HA       ASP  59  -1.737 -12.590 -13.593
  427   1HB   ASP  59          1HB       ASP  59  -2.462 -15.569 -13.399
  428   2HB   ASP  59          2HB       ASP  59  -1.526 -14.864 -14.697
  429    H    ALA  60           H        ALA  60  -1.708 -14.650 -10.743
  430    HA   ALA  60           HA       ALA  60  -4.346 -13.806  -9.643
  431   1HB   ALA  60          1HB       ALA  60  -3.616 -14.985  -7.576
  432   2HB   ALA  60          2HB       ALA  60  -3.367 -15.989  -9.017
  433   3HB   ALA  60          3HB       ALA  60  -1.976 -15.194  -8.237
  434    H    ILE  61           H        ILE  61  -0.975 -12.807  -9.339
  435    HA   ILE  61           HA       ILE  61  -1.146 -11.022  -7.047
  436    HB   ILE  61           HB       ILE  61   0.845 -11.542  -9.169
  437   1HG1  ILE  61          1HG1      ILE  61   1.981 -12.233  -7.327
  438   2HG1  ILE  61          2HG1      ILE  61   0.663 -11.701  -6.305
  439   1HG2  ILE  61          1HG2      ILE  61   2.143  -9.405  -8.931
  440   2HG2  ILE  61          2HG2      ILE  61   0.575  -9.098  -9.675
  441   3HG2  ILE  61          3HG2      ILE  61   0.829  -8.694  -7.961
  442   1HD1  ILE  61          1HD1      ILE  61   1.668  -9.457  -5.972
  443   2HD1  ILE  61          2HD1      ILE  61   2.833 -10.735  -5.563
  444   3HD1  ILE  61          3HD1      ILE  61   2.990  -9.857  -7.103
  445    H    ILE  62           H        ILE  62  -1.606 -10.493 -10.537
  446    HA   ILE  62           HA       ILE  62  -2.214  -7.574 -10.278
  447    HB   ILE  62           HB       ILE  62  -2.239  -9.500 -12.638
  448   1HG1  ILE  62          1HG1      ILE  62   0.006  -8.752 -12.097
  449   2HG1  ILE  62          2HG1      ILE  62  -0.505  -7.100 -11.819
  450   1HG2  ILE  62          1HG2      ILE  62  -2.887  -7.617 -14.167
  451   2HG2  ILE  62          2HG2      ILE  62  -4.188  -7.954 -13.027
  452   3HG2  ILE  62          3HG2      ILE  62  -3.138  -6.542 -12.769
  453   1HD1  ILE  62          1HD1      ILE  62  -0.897  -6.684 -14.231
  454   2HD1  ILE  62          2HD1      ILE  62   0.740  -7.317 -13.962
  455   3HD1  ILE  62          3HD1      ILE  62  -0.523  -8.388 -14.610
  456    H    GLU  63           H        GLU  63  -3.947 -10.635 -10.573
  457    HA   GLU  63           HA       GLU  63  -6.638  -9.897 -11.052
  458   1HB   GLU  63          1HB       GLU  63  -5.535 -12.252 -10.486
  459   2HB   GLU  63          2HB       GLU  63  -6.095 -11.931  -8.856
  460   1HG   GLU  63          1HG       GLU  63  -8.063 -11.709 -11.201
  461   2HG   GLU  63          2HG       GLU  63  -7.604 -13.292 -10.596
  462    H    GLU  64           H        GLU  64  -4.719  -9.475  -8.129
  463    HA   GLU  64           HA       GLU  64  -6.806  -8.513  -6.308
  464   1HB   GLU  64          1HB       GLU  64  -3.786  -8.354  -6.344
  465   2HB   GLU  64          2HB       GLU  64  -4.641  -7.261  -5.274
  466   1HG   GLU  64          1HG       GLU  64  -3.947 -10.001  -4.798
  467   2HG   GLU  64          2HG       GLU  64  -5.690 -10.027  -5.001
  468    H    VAL  65           H        VAL  65  -4.261  -6.617  -7.972
  469    HA   VAL  65           HA       VAL  65  -6.032  -4.145  -7.956
  470    HB   VAL  65           HB       VAL  65  -3.280  -3.836  -9.052
  471   1HG1  VAL  65          1HG1      VAL  65  -3.520  -4.429  -6.033
  472   2HG1  VAL  65          2HG1      VAL  65  -2.902  -5.594  -7.218
  473   3HG1  VAL  65          3HG1      VAL  65  -2.041  -4.059  -6.953
  474   1HG2  VAL  65          1HG2      VAL  65  -3.260  -1.766  -7.750
  475   2HG2  VAL  65          2HG2      VAL  65  -4.888  -1.898  -8.457
  476   3HG2  VAL  65          3HG2      VAL  65  -4.638  -2.289  -6.750
  477    H    ASP  66           H        ASP  66  -7.404  -5.300  -9.533
  478    HA   ASP  66           HA       ASP  66  -7.008  -4.290 -12.276
  479   1HB   ASP  66          1HB       ASP  66  -6.709  -7.338 -12.051
  480   2HB   ASP  66          2HB       ASP  66  -5.370  -6.238 -12.284
  481    H    GLU  67           H        GLU  67  -8.933  -3.945 -10.434
  482    HA   GLU  67           HA       GLU  67 -11.294  -5.761 -10.901
  483   1HB   GLU  67          1HB       GLU  67 -11.361  -3.154  -9.317
  484   2HB   GLU  67          2HB       GLU  67 -10.591  -4.583  -8.655
  485   1HG   GLU  67          1HG       GLU  67 -13.461  -4.819  -9.697
  486   2HG   GLU  67          2HG       GLU  67 -12.656  -5.782  -8.470
  487    H    ASP  68           H        ASP  68 -10.275  -4.503 -13.236
  488    HA   ASP  68           HA       ASP  68 -12.513  -2.560 -13.996
  489   1HB   ASP  68          1HB       ASP  68 -11.116  -1.146 -15.233
  490   2HB   ASP  68          2HB       ASP  68 -10.202  -1.455 -13.775
  491    H    GLY  69           H        GLY  69 -10.081  -4.876 -15.237
  492   1HA   GLY  69          1HA       GLY  69 -12.037  -5.706 -17.463
  493   2HA   GLY  69          2HA       GLY  69 -11.207  -6.919 -16.489
  494    H    SER  70           H        SER  70  -9.814  -3.889 -17.665
  495    HA   SER  70           HA       SER  70  -8.689  -4.464 -20.161
  496   1HB   SER  70          1HB       SER  70  -8.520  -2.271 -18.927
  497   2HB   SER  70          2HB       SER  70  -7.053  -2.735 -19.794
  498    HG   SER  70           HG       SER  70  -6.050  -3.130 -17.963
  499    H    GLY  71           H        GLY  71  -7.205  -5.264 -17.004
  500   1HA   GLY  71          1HA       GLY  71  -6.042  -7.454 -16.545
  501   2HA   GLY  71          2HA       GLY  71  -5.728  -7.609 -18.278
  502    H    THR  72           H        THR  72  -4.881  -4.847 -18.615
  503    HA   THR  72           HA       THR  72  -1.986  -5.137 -17.910
  504    HB   THR  72           HB       THR  72  -1.829  -2.781 -19.030
  505    HG1  THR  72           HG1      THR  72  -4.244  -3.577 -20.209
  506   1HG2  THR  72          1HG2      THR  72  -1.805  -3.685 -21.319
  507   2HG2  THR  72          2HG2      THR  72  -1.052  -4.868 -20.227
  508   3HG2  THR  72          3HG2      THR  72  -2.709  -5.135 -20.830
  509    H    ILE  73           H        ILE  73  -1.064  -2.727 -17.292
  510    HA   ILE  73           HA       ILE  73  -2.581  -1.608 -14.896
  511    HB   ILE  73           HB       ILE  73   0.262  -2.728 -14.716
  512   1HG1  ILE  73          1HG1      ILE  73  -2.349  -3.524 -13.272
  513   2HG1  ILE  73          2HG1      ILE  73  -0.763  -4.050 -12.751
  514   1HG2  ILE  73          1HG2      ILE  73   0.383  -1.847 -12.389
  515   2HG2  ILE  73          2HG2      ILE  73   0.112  -0.508 -13.513
  516   3HG2  ILE  73          3HG2      ILE  73  -1.236  -1.124 -12.527
  517   1HD1  ILE  73          1HD1      ILE  73  -0.358  -5.303 -14.853
  518   2HD1  ILE  73          2HD1      ILE  73  -1.890  -5.801 -14.103
  519   3HD1  ILE  73          3HD1      ILE  73  -1.910  -4.727 -15.522
  520    H    ASP  74           H        ASP  74  -2.864  -0.093 -16.729
  521    HA   ASP  74           HA       ASP  74  -0.620   1.526 -17.763
  522   1HB   ASP  74          1HB       ASP  74  -2.288   1.803 -19.278
  523   2HB   ASP  74          2HB       ASP  74  -2.676   3.190 -18.286
  524    H    PHE  75           H        PHE  75  -0.586   3.939 -17.425
  525    HA   PHE  75           HA       PHE  75   0.173   4.612 -14.697
  526   1HB   PHE  75          1HB       PHE  75   0.787   5.811 -16.966
  527   2HB   PHE  75          2HB       PHE  75  -0.687   6.718 -16.753
  528    HD1  PHE  75           HD1      PHE  75   2.558   5.891 -14.994
  529    HD2  PHE  75           HD2      PHE  75  -0.719   8.662 -15.317
  530    HE1  PHE  75           HE1      PHE  75   3.689   7.425 -13.438
  531    HE2  PHE  75           HE2      PHE  75   0.434  10.187 -13.763
  532    HZ   PHE  75           HZ       PHE  75   2.623   9.564 -12.806
  533    H    GLU  76           H        GLU  76  -2.904   4.616 -16.350
  534    HA   GLU  76           HA       GLU  76  -4.316   6.271 -14.242
  535   1HB   GLU  76          1HB       GLU  76  -5.300   6.921 -16.168
  536   2HB   GLU  76          2HB       GLU  76  -6.384   5.614 -15.744
  537   1HG   GLU  76          1HG       GLU  76  -4.099   5.368 -17.800
  538   2HG   GLU  76          2HG       GLU  76  -5.224   4.095 -17.378
  539    H    GLU  77           H        GLU  77  -3.132   4.006 -13.238
  540    HA   GLU  77           HA       GLU  77  -5.417   2.644 -11.902
  541   1HB   GLU  77          1HB       GLU  77  -5.139   1.350 -14.108
  542   2HB   GLU  77          2HB       GLU  77  -3.594   0.796 -13.505
  543   1HG   GLU  77          1HG       GLU  77  -6.092   0.343 -11.792
  544   2HG   GLU  77          2HG       GLU  77  -4.580  -0.559 -11.780
  545    H    PHE  78           H        PHE  78  -1.944   2.656 -12.626
  546    HA   PHE  78           HA       PHE  78  -0.939   1.393 -10.221
  547   1HB   PHE  78          1HB       PHE  78   0.435   1.882 -12.293
  548   2HB   PHE  78          2HB       PHE  78   0.451   3.582 -11.900
  549    HD1  PHE  78           HD1      PHE  78   3.025   3.264 -11.993
  550    HD2  PHE  78           HD2      PHE  78   0.630   1.326  -8.990
  551    HE1  PHE  78           HE1      PHE  78   5.042   2.823 -10.652
  552    HE2  PHE  78           HE2      PHE  78   2.658   0.886  -7.668
  553    HZ   PHE  78           HZ       PHE  78   4.863   1.639  -8.489
  554    H    LEU  79           H        LEU  79  -1.871   4.720 -10.940
  555    HA   LEU  79           HA       LEU  79  -0.867   5.981  -8.466
  556   1HB   LEU  79          1HB       LEU  79  -2.601   7.839  -9.130
  557   2HB   LEU  79          2HB       LEU  79  -2.911   6.887 -10.565
  558    HG   LEU  79           HG       LEU  79  -0.784   7.313 -11.520
  559   1HD1  LEU  79          1HD1      LEU  79  -0.452   9.784 -11.404
  560   2HD1  LEU  79          2HD1      LEU  79  -2.179   9.388 -11.465
  561   3HD1  LEU  79          3HD1      LEU  79  -1.436   9.875  -9.921
  562   1HD2  LEU  79          1HD2      LEU  79   0.298   8.179  -8.753
  563   2HD2  LEU  79          2HD2      LEU  79   0.701   6.672  -9.612
  564   3HD2  LEU  79          3HD2      LEU  79   1.208   8.228 -10.284
  565    H    VAL  80           H        VAL  80  -3.882   4.444  -9.443
  566    HA   VAL  80           HA       VAL  80  -5.524   5.192  -7.122
  567    HB   VAL  80           HB       VAL  80  -6.023   2.628  -8.679
  568   1HG1  VAL  80          1HG1      VAL  80  -6.856   5.401  -9.734
  569   2HG1  VAL  80          2HG1      VAL  80  -5.456   4.515 -10.352
  570   3HG1  VAL  80          3HG1      VAL  80  -7.083   3.817 -10.520
  571   1HG2  VAL  80          1HG2      VAL  80  -8.399   3.121  -8.332
  572   2HG2  VAL  80          2HG2      VAL  80  -7.601   3.274  -6.750
  573   3HG2  VAL  80          3HG2      VAL  80  -8.039   4.729  -7.657
  574    H    MET  81           H        MET  81  -3.272   2.576  -7.854
  575    HA   MET  81           HA       MET  81  -3.782   0.781  -5.581
  576   1HB   MET  81          1HB       MET  81  -2.350   0.305  -7.722
  577   2HB   MET  81          2HB       MET  81  -1.042   1.134  -6.896
  578   1HG   MET  81          1HG       MET  81  -2.427  -1.141  -5.402
  579   2HG   MET  81          2HG       MET  81  -1.319  -1.536  -6.727
  580   1HE   MET  81          1HE       MET  81   0.904  -2.295  -6.097
  581   2HE   MET  81          2HE       MET  81   1.667  -1.997  -4.506
  582   3HE   MET  81          3HE       MET  81   0.099  -2.851  -4.596
  583    H    MET  82           H        MET  82  -1.109   3.108  -6.081
  584    HA   MET  82           HA       MET  82  -0.016   2.978  -3.389
  585   1HB   MET  82          1HB       MET  82   0.883   5.417  -4.091
  586   2HB   MET  82          2HB       MET  82   0.278   4.962  -5.673
  587   1HG   MET  82          1HG       MET  82   1.699   2.738  -5.369
  588   2HG   MET  82          2HG       MET  82   2.518   4.249  -5.782
  589   1HE   MET  82          1HE       MET  82   4.794   2.060  -3.739
  590   2HE   MET  82          2HE       MET  82   3.351   1.529  -4.653
  591   3HE   MET  82          3HE       MET  82   3.409   1.316  -2.878
  592    H    VAL  83           H        VAL  83  -2.587   4.915  -4.814
  593    HA   VAL  83           HA       VAL  83  -2.801   6.989  -2.732
  594    HB   VAL  83           HB       VAL  83  -4.479   6.195  -5.097
  595   1HG1  VAL  83          1HG1      VAL  83  -6.354   7.726  -4.471
  596   2HG1  VAL  83          2HG1      VAL  83  -6.258   6.366  -3.344
  597   3HG1  VAL  83          3HG1      VAL  83  -5.650   7.963  -2.851
  598   1HG2  VAL  83          1HG2      VAL  83  -3.505   8.950  -4.088
  599   2HG2  VAL  83          2HG2      VAL  83  -2.737   7.982  -5.368
  600   3HG2  VAL  83          3HG2      VAL  83  -4.360   8.640  -5.621
  601    NH1  ARG  84           NH1      ARG  84  -7.293  -1.253  -6.101
  602    NH2  ARG  84           NH2      ARG  84  -9.053  -1.989  -4.869
  603    H    ARG  84           H        ARG  84  -4.216   3.802  -3.269
  604    HA   ARG  84           HA       ARG  84  -6.440   3.735  -1.432
  605   1HB   ARG  84          1HB       ARG  84  -4.651   1.654  -2.662
  606   2HB   ARG  84          2HB       ARG  84  -5.407   1.177  -1.149
  607   1HG   ARG  84          1HG       ARG  84  -7.535   1.079  -2.018
  608   2HG   ARG  84          2HG       ARG  84  -7.317   2.483  -3.065
  609   1HD   ARG  84          1HD       ARG  84  -6.858   1.178  -4.877
  610   2HD   ARG  84          2HD       ARG  84  -5.558   0.333  -4.036
  611    HE   ARG  84           HE       ARG  84  -7.793  -0.964  -2.977
  612   1HH1  ARG  84          1HH1      ARG  84  -6.463  -0.652  -6.154
  613   2HH1  ARG  84          2HH1      ARG  84  -7.669  -1.849  -6.847
  614   1HH2  ARG  84          1HH2      ARG  84  -9.539  -1.989  -3.965
  615   2HH2  ARG  84          2HH2      ARG  84  -9.331  -2.496  -5.716
  616    H    GLN  85           H        GLN  85  -3.007   2.920  -0.834
  617    HA   GLN  85           HA       GLN  85  -3.330   2.351   2.057
  618   1HB   GLN  85          1HB       GLN  85  -0.816   2.354   2.121
  619   2HB   GLN  85          2HB       GLN  85  -0.772   2.952   0.473
  620   1HG   GLN  85          1HG       GLN  85  -2.433   0.564   0.463
  621   2HG   GLN  85          2HG       GLN  85  -0.927   0.860  -0.378
  622   1HE2  GLN  85          1HE2      GLN  85  -0.348  -0.698   3.440
  623   2HE2  GLN  85          2HE2      GLN  85  -1.379   0.797   3.177
  624    H    MET  86           H        MET  86  -2.436   5.146   0.099
  625    HA   MET  86           HA       MET  86  -1.334   6.933   2.088
  626   1HB   MET  86          1HB       MET  86  -2.279   7.203  -0.674
  627   2HB   MET  86          2HB       MET  86  -2.848   8.567   0.270
  628   1HG   MET  86          1HG       MET  86  -0.134   8.380   1.072
  629   2HG   MET  86          2HG       MET  86  -0.084   7.933  -0.641
  630   1HE   MET  86          1HE       MET  86  -2.865   9.525  -1.621
  631   2HE   MET  86          2HE       MET  86  -2.138  11.033  -2.249
  632   3HE   MET  86          3HE       MET  86  -1.384   9.456  -2.625
  633    H    LYS  87           H        LYS  87  -4.660   6.128   1.246
  634    HA   LYS  87           HA       LYS  87  -6.145   8.279   2.508
  635   1HB   LYS  87          1HB       LYS  87  -8.090   7.006   2.277
  636   2HB   LYS  87          2HB       LYS  87  -7.058   6.325   1.028
  637   1HG   LYS  87          1HG       LYS  87  -6.373   4.543   2.891
  638   2HG   LYS  87          2HG       LYS  87  -7.847   5.055   3.695
  639   1HD   LYS  87          1HD       LYS  87  -7.868   4.182   0.747
  640   2HD   LYS  87          2HD       LYS  87  -7.852   2.997   2.048
  641   1HE   LYS  87          1HE       LYS  87 -10.019   5.194   1.888
  642   2HE   LYS  87          2HE       LYS  87 -10.202   3.620   1.102
  643   1HZ   LYS  87          1HZ       LYS  87  -9.440   3.586   3.930
  644   2HZ   LYS  87          2HZ       LYS  87 -10.444   2.574   3.095
  645   3HZ   LYS  87          3HZ       LYS  87 -10.983   4.059   3.577
  646    H    GLU  88           H        GLU  88  -6.199   8.899   4.521
  647    HA   GLU  88           HA       GLU  88  -5.894   8.991   6.899
  648   1HB   GLU  88          1HB       GLU  88  -7.347   6.305   6.649
  649   2HB   GLU  88          2HB       GLU  88  -8.097   7.887   6.731
  650   1HG   GLU  88          1HG       GLU  88  -6.305   6.878   9.020
  651   2HG   GLU  88          2HG       GLU  88  -7.476   8.184   9.068
  652    H    ASP  89           H        ASP  89  -5.672   5.514   7.072
  653    HA   ASP  89           HA       ASP  89  -2.657   5.650   7.572
  654   1HB   ASP  89          1HB       ASP  89  -4.352   5.603   9.707
  655   2HB   ASP  89          2HB       ASP  89  -4.281   3.882   9.408
  656    H    ALA  90           H        ALA  90  -5.525   3.610   7.059
  657    HA   ALA  90           HA       ALA  90  -5.900   1.754   5.558
  658   1HB   ALA  90          1HB       ALA  90  -4.227   1.316   3.740
  659   2HB   ALA  90          2HB       ALA  90  -4.598   3.048   3.848
  660   3HB   ALA  90          3HB       ALA  90  -3.063   2.428   4.503
   
  Start of MODEL           2
 Raw file had  660 H/Q atoms
  Start of MODEL    2
    1   1H    ALA   1          1H        ALA   1 -23.685   4.736 -10.189
    2   2H    ALA   1          2H        ALA   1 -22.820   4.384  -8.790
    3   3H    ALA   1          3H        ALA   1 -22.481   5.784  -9.658
    4    HA   ALA   1           HA       ALA   1 -22.234   3.102 -10.849
    5   1HB   ALA   1          1HB       ALA   1 -20.588   5.543 -11.645
    6   2HB   ALA   1          2HB       ALA   1 -22.286   5.463 -12.150
    7   3HB   ALA   1          3HB       ALA   1 -21.148   4.188 -12.655
    8    H    SER   2           H        SER   2 -19.519   3.303 -11.361
    9    HA   SER   2           HA       SER   2 -17.825   3.834  -8.980
   10   1HB   SER   2          1HB       SER   2 -19.147   1.129  -9.203
   11   2HB   SER   2          2HB       SER   2 -17.450   1.159  -8.717
   12    HG   SER   2           HG       SER   2 -19.490   1.594  -7.226
   13    H    MET   3           H        MET   3 -17.050   4.745 -11.138
   14    HA   MET   3           HA       MET   3 -14.983   2.876 -12.384
   15   1HB   MET   3          1HB       MET   3 -17.015   4.527 -13.989
   16   2HB   MET   3          2HB       MET   3 -15.585   3.791 -14.690
   17   1HG   MET   3          1HG       MET   3 -16.577   1.516 -13.630
   18   2HG   MET   3          2HG       MET   3 -18.089   2.433 -13.593
   19   1HE   MET   3          1HE       MET   3 -15.707   0.288 -15.571
   20   2HE   MET   3          2HE       MET   3 -14.968   1.784 -16.213
   21   3HE   MET   3          3HE       MET   3 -15.920   0.726 -17.295
   22    H    THR   4           H        THR   4 -16.295   6.179 -12.128
   23    HA   THR   4           HA       THR   4 -13.622   7.386 -12.838
   24    HB   THR   4           HB       THR   4 -16.424   8.335 -13.020
   25    HG1  THR   4           HG1      THR   4 -14.884   9.400 -14.764
   26   1HG2  THR   4          1HG2      THR   4 -15.018  10.161 -11.573
   27   2HG2  THR   4          2HG2      THR   4 -16.147  10.641 -12.860
   28   3HG2  THR   4          3HG2      THR   4 -14.395  10.584 -13.183
   29    H    ASP   5           H        ASP   5 -15.763   6.945 -10.119
   30    HA   ASP   5           HA       ASP   5 -14.605   9.072  -8.386
   31   1HB   ASP   5          1HB       ASP   5 -15.940   7.594  -6.550
   32   2HB   ASP   5          2HB       ASP   5 -16.703   6.925  -7.974
   33    H    GLN   6           H        GLN   6 -14.162   5.622  -8.883
   34    HA   GLN   6           HA       GLN   6 -12.782   4.746  -6.539
   35   1HB   GLN   6          1HB       GLN   6 -13.065   3.769  -9.290
   36   2HB   GLN   6          2HB       GLN   6 -12.961   2.888  -7.777
   37   1HG   GLN   6          1HG       GLN   6 -10.314   3.488  -8.010
   38   2HG   GLN   6          2HG       GLN   6 -11.037   2.045  -8.686
   39   1HE2  GLN   6          1HE2      GLN   6  -8.990   3.834 -11.361
   40   2HE2  GLN   6          2HE2      GLN   6  -8.658   3.391  -9.612
   41    H    GLN   7           H        GLN   7 -11.554   6.537  -9.339
   42    HA   GLN   7           HA       GLN   7  -8.722   6.645  -8.178
   43   1HB   GLN   7          1HB       GLN   7  -9.282   5.965 -10.699
   44   2HB   GLN   7          2HB       GLN   7  -7.879   6.945 -10.296
   45   1HG   GLN   7          1HG       GLN   7 -10.237   8.661 -10.836
   46   2HG   GLN   7          2HG       GLN   7  -8.602   8.771 -11.469
   47   1HE2  GLN   7          1HE2      GLN   7 -11.453   7.468 -13.945
   48   2HE2  GLN   7          2HE2      GLN   7 -11.647   8.529 -12.460
   49    H    ALA   8           H        ALA   8 -11.514   8.586  -9.091
   50    HA   ALA   8           HA       ALA   8 -10.599  11.259  -9.175
   51   1HB   ALA   8          1HB       ALA   8 -12.835  11.951  -8.327
   52   2HB   ALA   8          2HB       ALA   8 -12.973  10.638  -9.511
   53   3HB   ALA   8          3HB       ALA   8 -13.175  10.294  -7.774
   54    H    GLU   9           H        GLU   9 -10.948   9.173  -6.354
   55    HA   GLU   9           HA       GLU   9 -10.732  11.186  -4.232
   56   1HB   GLU   9          1HB       GLU   9 -10.427   9.394  -2.644
   57   2HB   GLU   9          2HB       GLU   9 -11.645   8.909  -3.815
   58   1HG   GLU   9          1HG       GLU   9  -9.785   7.572  -5.069
   59   2HG   GLU   9          2HG       GLU   9  -8.750   7.867  -3.677
   60    H    ALA  10           H        ALA  10  -8.290   8.878  -5.475
   61    HA   ALA  10           HA       ALA  10  -6.051   9.944  -3.884
   62   1HB   ALA  10          1HB       ALA  10  -4.634   8.418  -5.247
   63   2HB   ALA  10          2HB       ALA  10  -6.099   7.595  -4.679
   64   3HB   ALA  10          3HB       ALA  10  -5.978   8.122  -6.377
   65    NH1  ARG  11           NH1      ARG  11  -6.642  13.340 -14.350
   66    NH2  ARG  11           NH2      ARG  11  -5.799  15.410 -13.947
   67    H    ARG  11           H        ARG  11  -7.480  10.857  -6.916
   68    HA   ARG  11           HA       ARG  11  -5.068  12.156  -8.162
   69   1HB   ARG  11          1HB       ARG  11  -6.528  11.375  -9.827
   70   2HB   ARG  11          2HB       ARG  11  -7.974  11.787  -8.918
   71   1HG   ARG  11          1HG       ARG  11  -7.992  14.043  -9.579
   72   2HG   ARG  11          2HG       ARG  11  -6.255  14.105  -9.888
   73   1HD   ARG  11          1HD       ARG  11  -6.740  12.366 -11.835
   74   2HD   ARG  11          2HD       ARG  11  -8.432  12.837 -11.660
   75    HE   ARG  11           HE       ARG  11  -7.430  15.325 -12.027
   76   1HH1  ARG  11          1HH1      ARG  11  -5.726  16.206 -13.304
   77   2HH1  ARG  11          2HH1      ARG  11  -5.375  15.330 -14.878
   78   1HH2  ARG  11          1HH2      ARG  11  -7.142  12.522 -13.984
   79   2HH2  ARG  11          2HH2      ARG  11  -6.230  13.441 -15.284
   80    H    ALA  12           H        ALA  12  -7.966  13.099  -6.359
   81    HA   ALA  12           HA       ALA  12  -7.688  16.034  -6.714
   82   1HB   ALA  12          1HB       ALA  12  -9.488  16.210  -5.009
   83   2HB   ALA  12          2HB       ALA  12  -9.898  15.016  -6.257
   84   3HB   ALA  12          3HB       ALA  12  -9.360  14.471  -4.648
   85    H    PHE  13           H        PHE  13  -6.609  13.640  -4.362
   86    HA   PHE  13           HA       PHE  13  -5.668  15.570  -2.309
   87   1HB   PHE  13          1HB       PHE  13  -5.033  12.577  -2.592
   88   2HB   PHE  13          2HB       PHE  13  -6.464  13.211  -1.824
   89    HD1  PHE  13           HD1      PHE  13  -3.258  15.072  -1.396
   90    HD2  PHE  13           HD2      PHE  13  -5.779  12.018   0.292
   91    HE1  PHE  13           HE1      PHE  13  -2.009  15.194   0.722
   92    HE2  PHE  13           HE2      PHE  13  -4.519  12.157   2.400
   93    HZ   PHE  13           HZ       PHE  13  -2.638  13.743   2.622
   94    H    LEU  14           H        LEU  14  -4.153  13.494  -4.780
   95    HA   LEU  14           HA       LEU  14  -1.394  14.714  -4.308
   96   1HB   LEU  14          1HB       LEU  14  -1.916  12.486  -6.318
   97   2HB   LEU  14          2HB       LEU  14  -0.439  12.878  -5.466
   98    HG   LEU  14           HG       LEU  14  -2.749  11.964  -3.733
   99   1HD1  LEU  14          1HD1      LEU  14   0.237  11.197  -3.709
  100   2HD1  LEU  14          2HD1      LEU  14  -0.450  12.561  -2.808
  101   3HD1  LEU  14          3HD1      LEU  14  -0.956  10.897  -2.420
  102   1HD2  LEU  14          1HD2      LEU  14  -2.454   9.571  -4.225
  103   2HD2  LEU  14          2HD2      LEU  14  -2.821  10.385  -5.765
  104   3HD2  LEU  14          3HD2      LEU  14  -1.156   9.911  -5.398
  105    H    SER  15           H        SER  15  -1.093  16.516  -5.360
  106    HA   SER  15           HA       SER  15  -2.535  17.369  -7.802
  107   1HB   SER  15          1HB       SER  15  -1.599  19.447  -7.474
  108   2HB   SER  15          2HB       SER  15  -1.439  18.799  -5.839
  109    HG   SER  15           HG       SER  15   0.596  18.981  -6.043
  110    H    GLU  16           H        GLU  16  -0.457  18.608  -9.235
  111    HA   GLU  16           HA       GLU  16   0.473  16.356 -10.962
  112   1HB   GLU  16          1HB       GLU  16  -0.454  18.462 -11.915
  113   2HB   GLU  16          2HB       GLU  16   0.901  19.377 -11.284
  114   1HG   GLU  16          1HG       GLU  16   1.418  17.019 -13.180
  115   2HG   GLU  16          2HG       GLU  16   2.458  18.392 -12.843
  116    H    GLU  17           H        GLU  17   1.832  18.623  -8.655
  117    HA   GLU  17           HA       GLU  17   4.701  18.161  -9.344
  118   1HB   GLU  17          1HB       GLU  17   5.054  19.317  -6.988
  119   2HB   GLU  17          2HB       GLU  17   3.340  19.672  -7.079
  120   1HG   GLU  17          1HG       GLU  17   4.018  20.649  -9.531
  121   2HG   GLU  17          2HG       GLU  17   5.618  20.729  -8.813
  122    H    MET  18           H        MET  18   2.354  16.915  -7.026
  123    HA   MET  18           HA       MET  18   4.243  15.117  -5.553
  124   1HB   MET  18          1HB       MET  18   1.258  14.578  -5.521
  125   2HB   MET  18          2HB       MET  18   2.450  14.412  -4.245
  126   1HG   MET  18          1HG       MET  18   1.036  16.274  -3.620
  127   2HG   MET  18          2HG       MET  18   1.147  17.014  -5.226
  128   1HE   MET  18          1HE       MET  18   2.847  16.454  -1.737
  129   2HE   MET  18          2HE       MET  18   3.709  18.021  -1.697
  130   3HE   MET  18          3HE       MET  18   1.940  17.982  -1.962
  131    H    ILE  19           H        ILE  19   2.032  14.942  -8.292
  132    HA   ILE  19           HA       ILE  19   1.992  12.055  -8.723
  133    HB   ILE  19           HB       ILE  19   1.334  14.437 -10.450
  134   1HG1  ILE  19          1HG1      ILE  19  -0.515  12.093 -10.439
  135   2HG1  ILE  19          2HG1      ILE  19  -0.848  13.788 -10.158
  136   1HG2  ILE  19          1HG2      ILE  19   0.887  13.023 -12.473
  137   2HG2  ILE  19          2HG2      ILE  19   2.604  12.990 -12.075
  138   3HG2  ILE  19          3HG2      ILE  19   1.578  11.599 -11.658
  139   1HD1  ILE  19          1HD1      ILE  19  -0.184  13.649  -7.774
  140   2HD1  ILE  19          2HD1      ILE  19  -1.396  12.410  -8.159
  141   3HD1  ILE  19          3HD1      ILE  19   0.314  11.948  -7.986
  142    H    ALA  20           H        ALA  20   4.232  14.629  -9.624
  143    HA   ALA  20           HA       ALA  20   5.863  13.233 -11.584
  144   1HB   ALA  20          1HB       ALA  20   7.548  15.026 -11.184
  145   2HB   ALA  20          2HB       ALA  20   5.910  15.696 -11.319
  146   3HB   ALA  20          3HB       ALA  20   6.685  15.555  -9.721
  147    H    GLU  21           H        GLU  21   5.784  13.069  -8.097
  148    HA   GLU  21           HA       GLU  21   8.509  12.005  -7.652
  149   1HB   GLU  21          1HB       GLU  21   6.034  12.214  -5.885
  150   2HB   GLU  21          2HB       GLU  21   7.440  11.318  -5.343
  151   1HG   GLU  21          1HG       GLU  21   7.228  14.323  -5.947
  152   2HG   GLU  21          2HG       GLU  21   8.800  13.543  -5.889
  153    H    PHE  22           H        PHE  22   5.360  10.637  -8.391
  154    HA   PHE  22           HA       PHE  22   6.165   7.805  -7.725
  155   1HB   PHE  22          1HB       PHE  22   3.518   9.006  -8.734
  156   2HB   PHE  22          2HB       PHE  22   3.776   7.290  -8.576
  157    HD1  PHE  22           HD1      PHE  22   3.030   6.256  -6.596
  158    HD2  PHE  22           HD2      PHE  22   4.256  10.377  -6.402
  159    HE1  PHE  22           HE1      PHE  22   2.523   6.304  -4.190
  160    HE2  PHE  22           HE2      PHE  22   3.726  10.410  -3.999
  161    HZ   PHE  22           HZ       PHE  22   2.854   8.380  -2.891
  162    H    LYS  23           H        LYS  23   5.654   9.885 -10.518
  163    HA   LYS  23           HA       LYS  23   5.434   7.828 -12.629
  164   1HB   LYS  23          1HB       LYS  23   5.990   9.669 -14.243
  165   2HB   LYS  23          2HB       LYS  23   4.641  10.036 -13.190
  166   1HG   LYS  23          1HG       LYS  23   6.312  11.398 -11.721
  167   2HG   LYS  23          2HG       LYS  23   5.804  12.054 -13.268
  168   1HD   LYS  23          1HD       LYS  23   8.201  10.446 -13.733
  169   2HD   LYS  23          2HD       LYS  23   8.515  11.523 -12.367
  170   1HE   LYS  23          1HE       LYS  23   9.012  13.108 -13.971
  171   2HE   LYS  23          2HE       LYS  23   7.260  13.300 -14.129
  172   1HZ   LYS  23          1HZ       LYS  23   7.375  11.497 -15.864
  173   2HZ   LYS  23          2HZ       LYS  23   9.024  11.582 -15.798
  174   3HZ   LYS  23          3HZ       LYS  23   8.147  12.898 -16.278
  175    H    ALA  24           H        ALA  24   8.115   9.571 -11.116
  176    HA   ALA  24           HA       ALA  24  10.379   8.825 -12.723
  177   1HB   ALA  24          1HB       ALA  24  11.748   9.058 -10.660
  178   2HB   ALA  24          2HB       ALA  24  10.568  10.374 -10.801
  179   3HB   ALA  24          3HB       ALA  24  10.283   9.044  -9.649
  180    H    ALA  25           H        ALA  25   9.181   7.104  -9.816
  181    HA   ALA  25           HA       ALA  25  10.847   4.680 -10.281
  182   1HB   ALA  25          1HB       ALA  25   9.737   3.800  -8.236
  183   2HB   ALA  25          2HB       ALA  25  10.325   5.454  -7.982
  184   3HB   ALA  25          3HB       ALA  25   8.586   5.157  -8.233
  185    H    PHE  26           H        PHE  26   7.838   5.751 -11.496
  186    HA   PHE  26           HA       PHE  26   6.326   3.194 -11.568
  187   1HB   PHE  26          1HB       PHE  26   4.988   5.176 -11.628
  188   2HB   PHE  26          2HB       PHE  26   5.896   5.903 -12.926
  189    HD1  PHE  26           HD1      PHE  26   5.331   5.366 -15.282
  190    HD2  PHE  26           HD2      PHE  26   3.432   3.200 -12.088
  191    HE1  PHE  26           HE1      PHE  26   3.654   4.491 -16.858
  192    HE2  PHE  26           HE2      PHE  26   1.767   2.330 -13.679
  193    HZ   PHE  26           HZ       PHE  26   1.902   2.935 -16.071
  194    H    ASP  27           H        ASP  27   8.402   5.011 -13.808
  195    HA   ASP  27           HA       ASP  27   8.152   3.102 -16.082
  196   1HB   ASP  27          1HB       ASP  27   8.799   5.618 -16.255
  197   2HB   ASP  27          2HB       ASP  27   9.565   4.461 -17.319
  198    H    MET  28           H        MET  28  10.289   3.578 -13.331
  199    HA   MET  28           HA       MET  28  12.405   1.629 -13.971
  200   1HB   MET  28          1HB       MET  28  11.544   2.014 -11.081
  201   2HB   MET  28          2HB       MET  28  12.193   3.394 -11.948
  202   1HG   MET  28          1HG       MET  28  14.346   2.279 -12.339
  203   2HG   MET  28          2HG       MET  28  13.713   0.721 -11.780
  204   1HE   MET  28          1HE       MET  28  12.232   3.803  -9.934
  205   2HE   MET  28          2HE       MET  28  13.499   4.260  -8.757
  206   3HE   MET  28          3HE       MET  28  13.752   4.564 -10.501
  207    H    PHE  29           H        PHE  29   9.154   1.413 -12.630
  208    HA   PHE  29           HA       PHE  29   9.287  -1.420 -11.728
  209   1HB   PHE  29          1HB       PHE  29   7.613   0.446 -10.939
  210   2HB   PHE  29          2HB       PHE  29   6.704   0.099 -12.385
  211    HD1  PHE  29           HD1      PHE  29   5.306  -1.910 -12.547
  212    HD2  PHE  29           HD2      PHE  29   7.939  -1.430  -9.175
  213    HE1  PHE  29           HE1      PHE  29   4.154  -3.740 -11.371
  214    HE2  PHE  29           HE2      PHE  29   6.767  -3.256  -8.015
  215    HZ   PHE  29           HZ       PHE  29   4.880  -4.414  -9.107
  216    H    ASP  30           H        ASP  30   8.358   0.331 -14.646
  217    HA   ASP  30           HA       ASP  30   7.201  -1.983 -16.113
  218   1HB   ASP  30          1HB       ASP  30   8.220   0.402 -17.668
  219   2HB   ASP  30          2HB       ASP  30   6.956   0.705 -16.499
  220    H    ALA  31           H        ALA  31   8.134  -2.992 -17.949
  221    HA   ALA  31           HA       ALA  31  11.175  -2.884 -18.242
  222   1HB   ALA  31          1HB       ALA  31  11.348  -5.367 -18.059
  223   2HB   ALA  31          2HB       ALA  31  10.725  -4.642 -16.564
  224   3HB   ALA  31          3HB       ALA  31   9.616  -5.491 -17.672
  225    H    ASP  32           H        ASP  32   8.608  -2.223 -19.832
  226    HA   ASP  32           HA       ASP  32   9.595  -3.401 -22.466
  227   1HB   ASP  32          1HB       ASP  32   6.946  -3.248 -23.081
  228   2HB   ASP  32          2HB       ASP  32   7.761  -4.712 -22.565
  229    H    GLY  33           H        GLY  33   6.793  -1.341 -21.765
  230   1HA   GLY  33          1HA       GLY  33   8.008   0.929 -23.434
  231   2HA   GLY  33          2HA       GLY  33   6.294   0.652 -23.222
  232    H    GLY  34           H        GLY  34   5.266   1.674 -21.587
  233   1HA   GLY  34          1HA       GLY  34   6.416   4.032 -20.330
  234   2HA   GLY  34          2HA       GLY  34   6.466   2.755 -19.110
  235    H    GLY  35           H        GLY  35   4.020   3.108 -21.641
  236   1HA   GLY  35          1HA       GLY  35   1.605   3.387 -21.538
  237   2HA   GLY  35          2HA       GLY  35   2.010   4.696 -20.423
  238    H    ASP  36           H        ASP  36   2.239   1.139 -20.200
  239    HA   ASP  36           HA       ASP  36   0.786   1.172 -17.522
  240   1HB   ASP  36          1HB       ASP  36  -0.642  -0.829 -18.326
  241   2HB   ASP  36          2HB       ASP  36  -1.122   0.784 -18.802
  242    H    ILE  37           H        ILE  37   1.082  -0.753 -16.318
  243    HA   ILE  37           HA       ILE  37   3.623  -2.303 -16.971
  244    HB   ILE  37           HB       ILE  37   2.379  -2.861 -14.340
  245   1HG1  ILE  37          1HG1      ILE  37   2.891  -0.006 -15.028
  246   2HG1  ILE  37          2HG1      ILE  37   1.980  -0.708 -13.704
  247   1HG2  ILE  37          1HG2      ILE  37   4.721  -2.897 -13.573
  248   2HG2  ILE  37          2HG2      ILE  37   4.570  -3.816 -15.078
  249   3HG2  ILE  37          3HG2      ILE  37   5.282  -2.185 -15.106
  250   1HD1  ILE  37          1HD1      ILE  37   5.033  -0.324 -13.704
  251   2HD1  ILE  37          2HD1      ILE  37   3.825   0.582 -12.767
  252   3HD1  ILE  37          3HD1      ILE  37   4.112  -1.136 -12.410
  253    H    SER  38           H        SER  38   3.239  -4.612 -15.606
  254    HA   SER  38           HA       SER  38   0.626  -5.927 -16.298
  255   1HB   SER  38          1HB       SER  38   2.313  -5.806 -18.427
  256   2HB   SER  38          2HB       SER  38   1.161  -7.117 -18.162
  257    HG   SER  38           HG       SER  38   2.956  -8.185 -18.382
  258    H    THR  39           H        THR  39   1.486  -8.546 -16.271
  259    HA   THR  39           HA       THR  39   2.194  -8.956 -13.371
  260    HB   THR  39           HB       THR  39   1.938 -11.522 -14.440
  261    HG1  THR  39           HG1      THR  39   0.650 -11.485 -16.025
  262   1HG2  THR  39          1HG2      THR  39  -0.264 -11.623 -13.358
  263   2HG2  THR  39          2HG2      THR  39   0.837 -10.689 -12.319
  264   3HG2  THR  39          3HG2      THR  39  -0.390  -9.850 -13.306
  265    H    LYS  40           H        LYS  40   3.433  -9.895 -16.589
  266    HA   LYS  40           HA       LYS  40   5.724 -11.421 -15.945
  267   1HB   LYS  40          1HB       LYS  40   5.151  -9.477 -18.202
  268   2HB   LYS  40          2HB       LYS  40   5.180 -11.220 -18.262
  269   1HG   LYS  40          1HG       LYS  40   7.762  -9.703 -17.634
  270   2HG   LYS  40          2HG       LYS  40   7.109  -9.535 -19.242
  271   1HD   LYS  40          1HD       LYS  40   7.296 -12.073 -19.575
  272   2HD   LYS  40          2HD       LYS  40   8.777 -11.181 -19.382
  273   1HE   LYS  40          1HE       LYS  40   9.359 -12.870 -17.995
  274   2HE   LYS  40          2HE       LYS  40   8.570 -11.881 -16.774
  275   1HZ   LYS  40          1HZ       LYS  40   7.044 -13.942 -18.276
  276   2HZ   LYS  40          2HZ       LYS  40   6.703 -13.291 -16.797
  277   3HZ   LYS  40          3HZ       LYS  40   7.960 -14.351 -16.963
  278    H    GLU  41           H        GLU  41   5.765  -7.882 -16.541
  279    HA   GLU  41           HA       GLU  41   8.510  -7.445 -15.569
  280   1HB   GLU  41          1HB       GLU  41   8.311  -5.257 -16.170
  281   2HB   GLU  41          2HB       GLU  41   6.684  -5.085 -15.548
  282   1HG   GLU  41          1HG       GLU  41   7.482  -5.349 -18.284
  283   2HG   GLU  41          2HG       GLU  41   6.703  -6.870 -17.906
  284    H    LEU  42           H        LEU  42   5.291  -7.149 -14.129
  285    HA   LEU  42           HA       LEU  42   5.792  -5.754 -11.683
  286   1HB   LEU  42          1HB       LEU  42   3.525  -6.213 -12.039
  287   2HB   LEU  42          2HB       LEU  42   3.792  -7.887 -12.477
  288    HG   LEU  42           HG       LEU  42   4.518  -8.056  -9.833
  289   1HD1  LEU  42          1HD1      LEU  42   2.972  -6.656  -8.439
  290   2HD1  LEU  42          2HD1      LEU  42   4.127  -5.650  -9.327
  291   3HD1  LEU  42          3HD1      LEU  42   2.441  -5.770  -9.891
  292   1HD2  LEU  42          1HD2      LEU  42   1.594  -8.149 -10.845
  293   2HD2  LEU  42          2HD2      LEU  42   2.772  -9.483 -10.928
  294   3HD2  LEU  42          3HD2      LEU  42   2.210  -8.901  -9.350
  295    H    GLY  43           H        GLY  43   6.480  -9.097 -12.566
  296   1HA   GLY  43          1HA       GLY  43   7.264 -10.012  -9.827
  297   2HA   GLY  43          2HA       GLY  43   7.425 -10.950 -11.316
  298    H    THR  44           H        THR  44   8.876  -8.930 -12.783
  299    HA   THR  44           HA       THR  44  11.571  -9.843 -12.310
  300    HB   THR  44           HB       THR  44  10.605  -7.423 -13.905
  301    HG1  THR  44           HG1      THR  44  11.489 -10.031 -14.541
  302   1HG2  THR  44          1HG2      THR  44  12.832  -7.396 -15.043
  303   2HG2  THR  44          2HG2      THR  44  12.981  -6.947 -13.331
  304   3HG2  THR  44          3HG2      THR  44  13.463  -8.576 -13.868
  305    H    VAL  45           H        VAL  45   9.986  -6.792 -11.398
  306    HA   VAL  45           HA       VAL  45  12.327  -5.466 -10.228
  307    HB   VAL  45           HB       VAL  45   9.425  -4.871 -10.394
  308   1HG1  VAL  45          1HG1      VAL  45  11.832  -2.945 -10.340
  309   2HG1  VAL  45          2HG1      VAL  45  11.291  -3.782 -11.800
  310   3HG1  VAL  45          3HG1      VAL  45  10.201  -2.634 -10.990
  311   1HG2  VAL  45          1HG2      VAL  45   9.258  -3.248  -8.578
  312   2HG2  VAL  45          2HG2      VAL  45   9.758  -4.783  -7.831
  313   3HG2  VAL  45          3HG2      VAL  45  10.953  -3.504  -8.089
  314    H    MET  46           H        MET  46   9.847  -7.656  -9.001
  315    HA   MET  46           HA       MET  46  10.451  -7.508  -6.132
  316   1HB   MET  46          1HB       MET  46   9.173  -9.797  -7.740
  317   2HB   MET  46          2HB       MET  46   9.333  -9.792  -5.993
  318   1HG   MET  46          1HG       MET  46   7.107  -8.857  -7.334
  319   2HG   MET  46          2HG       MET  46   7.989  -7.336  -7.121
  320   1HE   MET  46          1HE       MET  46   5.270  -9.296  -5.670
  321   2HE   MET  46          2HE       MET  46   5.120  -8.370  -4.148
  322   3HE   MET  46          3HE       MET  46   5.199  -7.507  -5.712
  323    NH1  ARG  47           NH1      ARG  47  17.408 -13.898 -12.171
  324    NH2  ARG  47           NH2      ARG  47  16.481 -15.943 -11.817
  325    H    ARG  47           H        ARG  47  11.798  -9.313  -8.836
  326    HA   ARG  47           HA       ARG  47  13.326 -11.350  -7.399
  327   1HB   ARG  47          1HB       ARG  47  12.764 -11.027 -10.017
  328   2HB   ARG  47          2HB       ARG  47  14.346 -10.260 -10.037
  329   1HG   ARG  47          1HG       ARG  47  15.212 -12.432  -8.785
  330   2HG   ARG  47          2HG       ARG  47  13.692 -13.159  -9.306
  331   1HD   ARG  47          1HD       ARG  47  14.377 -12.260 -11.748
  332   2HD   ARG  47          2HD       ARG  47  15.985 -12.124 -11.053
  333    HE   ARG  47           HE       ARG  47  14.598 -14.817 -10.850
  334   1HH1  ARG  47          1HH1      ARG  47  17.319 -12.881 -12.078
  335   2HH1  ARG  47          2HH1      ARG  47  18.197 -14.412 -12.579
  336   1HH2  ARG  47          1HH2      ARG  47  15.689 -16.487 -11.457
  337   2HH2  ARG  47          2HH2      ARG  47  17.335 -16.313 -12.250
  338    H    MET  48           H        MET  48  13.946  -7.981  -8.130
  339    HA   MET  48           HA       MET  48  16.769  -7.691  -8.094
  340   1HB   MET  48          1HB       MET  48  14.527  -5.859  -7.346
  341   2HB   MET  48          2HB       MET  48  16.042  -5.488  -6.543
  342   1HG   MET  48          1HG       MET  48  15.308  -5.153  -9.428
  343   2HG   MET  48          2HG       MET  48  16.923  -5.838  -9.183
  344   1HE   MET  48          1HE       MET  48  15.569  -2.709 -10.153
  345   2HE   MET  48          2HE       MET  48  16.980  -1.710  -9.698
  346   3HE   MET  48          3HE       MET  48  17.222  -3.240 -10.592
  347    H    LEU  49           H        LEU  49  14.787  -7.191  -5.151
  348    HA   LEU  49           HA       LEU  49  16.880  -7.125  -3.205
  349   1HB   LEU  49          1HB       LEU  49  14.944  -6.534  -2.152
  350   2HB   LEU  49          2HB       LEU  49  15.008  -8.197  -1.613
  351    HG   LEU  49           HG       LEU  49  13.532  -8.178  -4.122
  352   1HD1  LEU  49          1HD1      LEU  49  12.401  -6.141  -2.102
  353   2HD1  LEU  49          2HD1      LEU  49  13.188  -5.701  -3.629
  354   3HD1  LEU  49          3HD1      LEU  49  11.670  -6.632  -3.651
  355   1HD2  LEU  49          1HD2      LEU  49  11.729  -9.180  -2.782
  356   2HD2  LEU  49          2HD2      LEU  49  13.268  -9.812  -2.148
  357   3HD2  LEU  49          3HD2      LEU  49  12.414  -8.538  -1.267
  358    H    GLY  50           H        GLY  50  15.105  -9.933  -4.483
  359   1HA   GLY  50          1HA       GLY  50  17.257 -11.819  -3.348
  360   2HA   GLY  50          2HA       GLY  50  16.781 -11.901  -5.049
  361    H    GLN  51           H        GLN  51  15.019 -12.984  -5.654
  362    HA   GLN  51           HA       GLN  51  13.694 -14.849  -3.686
  363   1HB   GLN  51          1HB       GLN  51  11.828 -13.045  -5.308
  364   2HB   GLN  51          2HB       GLN  51  12.383 -12.581  -3.711
  365   1HG   GLN  51          1HG       GLN  51  11.480 -15.135  -3.145
  366   2HG   GLN  51          2HG       GLN  51  10.441 -14.758  -4.501
  367   1HE2  GLN  51          1HE2      GLN  51   8.345 -13.418  -1.856
  368   2HE2  GLN  51          2HE2      GLN  51   8.621 -14.760  -3.077
  369    H    ASN  52           H        ASN  52  11.877 -16.036  -5.108
  370    HA   ASN  52           HA       ASN  52  12.824 -16.429  -7.962
  371   1HB   ASN  52          1HB       ASN  52  13.769 -18.187  -6.214
  372   2HB   ASN  52          2HB       ASN  52  12.174 -18.906  -6.269
  373   1HD2  ASN  52          1HD2      ASN  52  14.060 -20.745  -8.869
  374   2HD2  ASN  52          2HD2      ASN  52  13.695 -20.690  -7.072
  375    HA   PRO  53           HA       PRO  53   8.112 -16.090  -7.539
  376   1HB   PRO  53          1HB       PRO  53   8.213 -13.792  -8.028
  377   2HB   PRO  53          2HB       PRO  53   7.648 -14.356  -9.609
  378   1HG   PRO  53          1HG       PRO  53   9.763 -14.298 -10.629
  379   2HG   PRO  53          2HG       PRO  53   9.968 -12.941  -9.497
  380   1HD   PRO  53          1HD       PRO  53  11.382 -14.248  -8.052
  381   2HD   PRO  53          2HD       PRO  53  11.640 -15.225  -9.527
  382    H    THR  54           H        THR  54   6.344 -16.237  -9.382
  383    HA   THR  54           HA       THR  54   7.095 -18.009 -11.721
  384    HB   THR  54           HB       THR  54   6.330 -19.261  -9.362
  385    HG1  THR  54           HG1      THR  54   5.719 -20.916 -11.139
  386   1HG2  THR  54          1HG2      THR  54   4.129 -20.322  -9.747
  387   2HG2  THR  54          2HG2      THR  54   3.926 -18.563  -9.576
  388   3HG2  THR  54          3HG2      THR  54   3.847 -19.317 -11.189
  389    H    LYS  55           H        LYS  55   5.471 -18.105 -13.303
  390    HA   LYS  55           HA       LYS  55   4.098 -15.528 -13.702
  391   1HB   LYS  55          1HB       LYS  55   5.106 -17.327 -15.456
  392   2HB   LYS  55          2HB       LYS  55   3.895 -16.145 -15.906
  393   1HG   LYS  55          1HG       LYS  55   2.159 -18.076 -15.268
  394   2HG   LYS  55          2HG       LYS  55   2.909 -17.990 -16.852
  395   1HD   LYS  55          1HD       LYS  55   3.234 -20.280 -16.336
  396   2HD   LYS  55          2HD       LYS  55   3.326 -19.976 -14.608
  397   1HE   LYS  55          1HE       LYS  55   5.504 -20.363 -16.477
  398   2HE   LYS  55          2HE       LYS  55   5.674 -18.733 -15.830
  399   1HZ   LYS  55          1HZ       LYS  55   6.045 -21.273 -14.515
  400   2HZ   LYS  55          2HZ       LYS  55   5.125 -20.240 -13.611
  401   3HZ   LYS  55          3HZ       LYS  55   6.635 -19.786 -14.104
  402    H    GLU  56           H        GLU  56   3.106 -18.783 -12.763
  403    HA   GLU  56           HA       GLU  56   0.197 -18.447 -13.073
  404   1HB   GLU  56          1HB       GLU  56   1.006 -20.462 -11.053
  405   2HB   GLU  56          2HB       GLU  56   1.920 -20.607 -12.542
  406   1HG   GLU  56          1HG       GLU  56  -1.157 -20.451 -12.563
  407   2HG   GLU  56          2HG       GLU  56  -0.106 -20.973 -13.869
  408    H    GLU  57           H        GLU  57   2.516 -17.864 -10.488
  409    HA   GLU  57           HA       GLU  57   0.484 -17.470  -8.320
  410   1HB   GLU  57          1HB       GLU  57   2.960 -18.340  -8.095
  411   2HB   GLU  57          2HB       GLU  57   2.167 -17.445  -6.817
  412   1HG   GLU  57          1HG       GLU  57   4.582 -16.720  -8.439
  413   2HG   GLU  57          2HG       GLU  57   3.459 -15.376  -8.275
  414    H    LEU  58           H        LEU  58   2.368 -15.504 -10.549
  415    HA   LEU  58           HA       LEU  58   2.083 -12.903  -9.221
  416   1HB   LEU  58          1HB       LEU  58   3.127 -13.929 -11.823
  417   2HB   LEU  58          2HB       LEU  58   2.448 -12.318 -11.937
  418    HG   LEU  58           HG       LEU  58   4.386 -12.875  -9.649
  419   1HD1  LEU  58          1HD1      LEU  58   4.187 -10.422 -11.519
  420   2HD1  LEU  58          2HD1      LEU  58   3.294 -10.559  -9.997
  421   3HD1  LEU  58          3HD1      LEU  58   5.074 -10.534  -9.977
  422   1HD2  LEU  58          1HD2      LEU  58   6.377 -12.618 -11.083
  423   2HD2  LEU  58          2HD2      LEU  58   5.412 -13.983 -11.698
  424   3HD2  LEU  58          3HD2      LEU  58   5.367 -12.421 -12.537
  425    H    ASP  59           H        ASP  59   0.175 -14.735 -11.547
  426    HA   ASP  59           HA       ASP  59  -1.718 -12.699 -12.435
  427   1HB   ASP  59          1HB       ASP  59  -2.138 -15.735 -12.231
  428   2HB   ASP  59          2HB       ASP  59  -1.496 -14.867 -13.606
  429    H    ALA  60           H        ALA  60  -1.535 -14.739  -9.573
  430    HA   ALA  60           HA       ALA  60  -4.233 -14.248  -8.501
  431   1HB   ALA  60          1HB       ALA  60  -3.351 -15.232  -6.391
  432   2HB   ALA  60          2HB       ALA  60  -2.896 -16.208  -7.801
  433   3HB   ALA  60          3HB       ALA  60  -1.686 -15.161  -7.017
  434    H    ILE  61           H        ILE  61  -1.125 -12.619  -8.237
  435    HA   ILE  61           HA       ILE  61  -1.719 -10.826  -5.982
  436    HB   ILE  61           HB       ILE  61   0.435 -10.887  -8.102
  437   1HG1  ILE  61          1HG1      ILE  61   1.197 -12.179  -6.319
  438   2HG1  ILE  61          2HG1      ILE  61   0.223 -11.343  -5.128
  439   1HG2  ILE  61          1HG2      ILE  61   1.456  -8.748  -7.269
  440   2HG2  ILE  61          2HG2      ILE  61  -0.119  -8.441  -7.999
  441   3HG2  ILE  61          3HG2      ILE  61   0.040  -8.457  -6.228
  442   1HD1  ILE  61          1HD1      ILE  61   1.811  -9.443  -4.988
  443   2HD1  ILE  61          2HD1      ILE  61   2.652 -10.985  -4.727
  444   3HD1  ILE  61          3HD1      ILE  61   2.807 -10.150  -6.290
  445    H    ILE  62           H        ILE  62  -2.143 -10.673  -9.488
  446    HA   ILE  62           HA       ILE  62  -3.057  -7.828  -9.583
  447    HB   ILE  62           HB       ILE  62  -3.206 -10.002 -11.736
  448   1HG1  ILE  62          1HG1      ILE  62  -0.883  -9.644 -11.514
  449   2HG1  ILE  62          2HG1      ILE  62  -1.060  -7.990 -10.967
  450   1HG2  ILE  62          1HG2      ILE  62  -3.624  -8.148 -13.376
  451   2HG2  ILE  62          2HG2      ILE  62  -4.921  -8.214 -12.184
  452   3HG2  ILE  62          3HG2      ILE  62  -3.668  -6.959 -12.051
  453   1HD1  ILE  62          1HD1      ILE  62  -1.529  -7.154 -13.254
  454   2HD1  ILE  62          2HD1      ILE  62  -0.023  -8.095 -13.227
  455   3HD1  ILE  62          3HD1      ILE  62  -1.504  -8.821 -13.894
  456    H    GLU  63           H        GLU  63  -4.467 -11.036  -9.269
  457    HA   GLU  63           HA       GLU  63  -7.228 -10.687  -9.784
  458   1HB   GLU  63          1HB       GLU  63  -6.247 -12.190  -7.307
  459   2HB   GLU  63          2HB       GLU  63  -6.013 -12.802  -8.933
  460   1HG   GLU  63          1HG       GLU  63  -8.684 -12.337  -7.474
  461   2HG   GLU  63          2HG       GLU  63  -8.629 -12.594  -9.209
  462    H    GLU  64           H        GLU  64  -5.512  -9.913  -6.744
  463    HA   GLU  64           HA       GLU  64  -7.804  -8.394  -5.568
  464   1HB   GLU  64          1HB       GLU  64  -5.855  -9.730  -4.352
  465   2HB   GLU  64          2HB       GLU  64  -6.660  -8.366  -3.602
  466   1HG   GLU  64          1HG       GLU  64  -3.822  -8.578  -4.675
  467   2HG   GLU  64          2HG       GLU  64  -4.585  -7.002  -4.785
  468    H    VAL  65           H        VAL  65  -7.564  -6.116  -4.956
  469    HA   VAL  65           HA       VAL  65  -7.652  -3.855  -5.763
  470    HB   VAL  65           HB       VAL  65  -5.347  -3.977  -4.810
  471   1HG1  VAL  65          1HG1      VAL  65  -5.461  -2.047  -7.216
  472   2HG1  VAL  65          2HG1      VAL  65  -6.388  -1.814  -5.722
  473   3HG1  VAL  65          3HG1      VAL  65  -4.609  -1.810  -5.670
  474   1HG2  VAL  65          1HG2      VAL  65  -3.320  -4.150  -6.165
  475   2HG2  VAL  65          2HG2      VAL  65  -4.313  -5.571  -6.567
  476   3HG2  VAL  65          3HG2      VAL  65  -4.245  -4.202  -7.686
  477    H    ASP  66           H        ASP  66  -9.138  -4.380  -7.402
  478    HA   ASP  66           HA       ASP  66  -8.318  -3.718 -10.155
  479   1HB   ASP  66          1HB       ASP  66  -9.542  -6.321 -10.599
  480   2HB   ASP  66          2HB       ASP  66  -8.172  -6.541  -9.535
  481    H    GLU  67           H        GLU  67  -9.887  -2.206  -9.255
  482    HA   GLU  67           HA       GLU  67 -12.769  -3.041  -9.008
  483   1HB   GLU  67          1HB       GLU  67 -12.021  -1.392  -7.428
  484   2HB   GLU  67          2HB       GLU  67 -11.353  -0.353  -8.672
  485   1HG   GLU  67          1HG       GLU  67 -13.921  -0.243  -9.529
  486   2HG   GLU  67          2HG       GLU  67 -13.318   0.808  -8.259
  487    H    ASP  68           H        ASP  68 -10.602  -1.449 -11.278
  488    HA   ASP  68           HA       ASP  68 -12.765  -0.601 -13.186
  489   1HB   ASP  68          1HB       ASP  68 -11.244   0.723 -14.212
  490   2HB   ASP  68          2HB       ASP  68 -10.318   0.484 -12.748
  491    H    GLY  69           H        GLY  69 -10.430  -3.206 -12.784
  492   1HA   GLY  69          1HA       GLY  69 -11.956  -5.131 -14.433
  493   2HA   GLY  69          2HA       GLY  69 -10.347  -5.417 -13.755
  494    H    SER  70           H        SER  70  -8.680  -5.489 -15.051
  495    HA   SER  70           HA       SER  70  -8.912  -5.011 -18.012
  496   1HB   SER  70          1HB       SER  70  -6.878  -3.356 -17.925
  497   2HB   SER  70          2HB       SER  70  -8.510  -2.747 -17.637
  498    HG   SER  70           HG       SER  70  -7.326  -1.969 -16.027
  499    H    GLY  71           H        GLY  71  -6.618  -5.345 -15.279
  500   1HA   GLY  71          1HA       GLY  71  -5.185  -7.634 -16.755
  501   2HA   GLY  71          2HA       GLY  71  -5.379  -7.577 -14.998
  502    H    THR  72           H        THR  72  -4.624  -4.752 -16.941
  503    HA   THR  72           HA       THR  72  -1.688  -4.809 -16.175
  504    HB   THR  72           HB       THR  72  -1.488  -2.781 -17.699
  505    HG1  THR  72           HG1      THR  72  -4.021  -2.767 -17.570
  506   1HG2  THR  72          1HG2      THR  72  -1.548  -4.007 -19.834
  507   2HG2  THR  72          2HG2      THR  72  -0.858  -5.064 -18.583
  508   3HG2  THR  72          3HG2      THR  72  -2.535  -5.310 -19.136
  509    H    ILE  73           H        ILE  73  -0.699  -3.023 -15.158
  510    HA   ILE  73           HA       ILE  73  -2.505  -1.435 -13.267
  511    HB   ILE  73           HB       ILE  73   0.423  -2.268 -12.992
  512   1HG1  ILE  73          1HG1      ILE  73  -2.185  -3.219 -11.745
  513   2HG1  ILE  73          2HG1      ILE  73  -0.806  -4.148 -12.291
  514   1HG2  ILE  73          1HG2      ILE  73   0.515  -1.065 -10.812
  515   2HG2  ILE  73          2HG2      ILE  73   0.135   0.083 -12.104
  516   3HG2  ILE  73          3HG2      ILE  73  -1.153  -0.479 -11.011
  517   1HD1  ILE  73          1HD1      ILE  73  -0.876  -2.548  -9.667
  518   2HD1  ILE  73          2HD1      ILE  73  -0.930  -4.313  -9.864
  519   3HD1  ILE  73          3HD1      ILE  73   0.550  -3.422 -10.291
  520    H    ASP  74           H        ASP  74  -3.039   0.045 -14.918
  521    HA   ASP  74           HA       ASP  74  -1.056   1.648 -16.421
  522   1HB   ASP  74          1HB       ASP  74  -3.849   2.738 -15.962
  523   2HB   ASP  74          2HB       ASP  74  -2.821   2.845 -17.373
  524    H    PHE  75           H        PHE  75  -1.130   4.111 -16.194
  525    HA   PHE  75           HA       PHE  75   0.040   4.915 -13.618
  526   1HB   PHE  75          1HB       PHE  75   0.339   5.966 -16.043
  527   2HB   PHE  75          2HB       PHE  75  -1.067   6.919 -15.651
  528    HD1  PHE  75           HD1      PHE  75   2.519   6.641 -15.260
  529    HD2  PHE  75           HD2      PHE  75  -0.970   8.372 -13.428
  530    HE1  PHE  75           HE1      PHE  75   3.942   8.206 -14.005
  531    HE2  PHE  75           HE2      PHE  75   0.472   9.935 -12.187
  532    HZ   PHE  75           HZ       PHE  75   2.925   9.847 -12.461
  533    H    GLU  76           H        GLU  76  -3.193   4.939 -14.971
  534    HA   GLU  76           HA       GLU  76  -4.355   6.644 -12.748
  535   1HB   GLU  76          1HB       GLU  76  -6.572   6.017 -14.097
  536   2HB   GLU  76          2HB       GLU  76  -5.516   7.344 -14.531
  537   1HG   GLU  76          1HG       GLU  76  -4.364   5.602 -16.189
  538   2HG   GLU  76          2HG       GLU  76  -5.794   4.630 -15.911
  539    H    GLU  77           H        GLU  77  -3.166   4.349 -11.847
  540    HA   GLU  77           HA       GLU  77  -5.402   2.976 -10.404
  541   1HB   GLU  77          1HB       GLU  77  -5.307   1.665 -12.533
  542   2HB   GLU  77          2HB       GLU  77  -3.635   1.265 -12.218
  543   1HG   GLU  77          1HG       GLU  77  -5.778   0.524 -10.154
  544   2HG   GLU  77          2HG       GLU  77  -4.181  -0.186 -10.363
  545    H    PHE  78           H        PHE  78  -1.944   3.040 -11.217
  546    HA   PHE  78           HA       PHE  78  -0.842   1.746  -8.891
  547   1HB   PHE  78          1HB       PHE  78   0.447   2.424 -10.985
  548   2HB   PHE  78          2HB       PHE  78   0.444   4.084 -10.446
  549    HD1  PHE  78           HD1      PHE  78   1.382   0.629  -9.118
  550    HD2  PHE  78           HD2      PHE  78   2.401   4.805  -9.295
  551    HE1  PHE  78           HE1      PHE  78   3.467   0.184  -7.887
  552    HE2  PHE  78           HE2      PHE  78   4.476   4.342  -8.055
  553    HZ   PHE  78           HZ       PHE  78   5.019   2.035  -7.360
  554    H    LEU  79           H        LEU  79  -1.789   5.118  -9.441
  555    HA   LEU  79           HA       LEU  79  -0.811   6.234  -6.897
  556   1HB   LEU  79          1HB       LEU  79  -3.137   7.410  -8.510
  557   2HB   LEU  79          2HB       LEU  79  -2.047   8.250  -7.429
  558    HG   LEU  79           HG       LEU  79  -1.226   7.024 -10.136
  559   1HD1  LEU  79          1HD1      LEU  79  -1.102   9.379 -10.954
  560   2HD1  LEU  79          2HD1      LEU  79  -2.748   8.989 -10.420
  561   3HD1  LEU  79          3HD1      LEU  79  -1.694   9.985  -9.386
  562   1HD2  LEU  79          1HD2      LEU  79   0.422   8.803  -8.214
  563   2HD2  LEU  79          2HD2      LEU  79   0.735   7.090  -8.586
  564   3HD2  LEU  79          3HD2      LEU  79   0.918   8.312  -9.853
  565    H    VAL  80           H        VAL  80  -3.921   4.923  -7.991
  566    HA   VAL  80           HA       VAL  80  -5.543   5.546  -5.621
  567    HB   VAL  80           HB       VAL  80  -5.994   3.190  -7.521
  568   1HG1  VAL  80          1HG1      VAL  80  -8.403   3.438  -6.887
  569   2HG1  VAL  80          2HG1      VAL  80  -7.415   3.072  -5.467
  570   3HG1  VAL  80          3HG1      VAL  80  -7.986   4.735  -5.737
  571   1HG2  VAL  80          1HG2      VAL  80  -7.082   6.064  -7.838
  572   2HG2  VAL  80          2HG2      VAL  80  -5.854   5.312  -8.882
  573   3HG2  VAL  80          3HG2      VAL  80  -7.499   4.660  -8.850
  574    H    MET  81           H        MET  81  -3.273   2.995  -6.475
  575    HA   MET  81           HA       MET  81  -3.770   1.079  -4.330
  576   1HB   MET  81          1HB       MET  81  -0.908   1.408  -5.220
  577   2HB   MET  81          2HB       MET  81  -2.073   1.090  -6.493
  578   1HG   MET  81          1HG       MET  81  -2.844  -0.883  -4.712
  579   2HG   MET  81          2HG       MET  81  -1.131  -0.737  -4.285
  580   1HE   MET  81          1HE       MET  81   0.763  -1.747  -5.505
  581   2HE   MET  81          2HE       MET  81   0.846  -2.001  -7.274
  582   3HE   MET  81          3HE       MET  81   0.744  -0.342  -6.617
  583    H    MET  82           H        MET  82  -1.075   3.420  -4.558
  584    HA   MET  82           HA       MET  82  -0.103   3.156  -1.849
  585   1HB   MET  82          1HB       MET  82   0.212   5.290  -3.980
  586   2HB   MET  82          2HB       MET  82   0.726   5.685  -2.350
  587   1HG   MET  82          1HG       MET  82   2.493   4.674  -4.010
  588   2HG   MET  82          2HG       MET  82   1.688   3.120  -3.758
  589   1HE   MET  82          1HE       MET  82   5.152   4.418  -1.542
  590   2HE   MET  82          2HE       MET  82   4.125   5.879  -1.635
  591   3HE   MET  82          3HE       MET  82   4.482   4.947  -3.118
  592    H    VAL  83           H        VAL  83  -2.790   4.984  -3.154
  593    HA   VAL  83           HA       VAL  83  -3.136   6.902  -0.934
  594    HB   VAL  83           HB       VAL  83  -4.543   6.320  -3.466
  595   1HG1  VAL  83          1HG1      VAL  83  -4.409   8.954  -1.870
  596   2HG1  VAL  83          2HG1      VAL  83  -3.105   8.396  -2.927
  597   3HG1  VAL  83          3HG1      VAL  83  -4.707   8.747  -3.615
  598   1HG2  VAL  83          1HG2      VAL  83  -6.760   7.190  -2.931
  599   2HG2  VAL  83          2HG2      VAL  83  -6.470   5.839  -1.811
  600   3HG2  VAL  83          3HG2      VAL  83  -6.314   7.504  -1.234
  601    NH1  ARG  84           NH1      ARG  84  -9.042  -1.387  -2.513
  602    NH2  ARG  84           NH2      ARG  84  -7.626  -2.294  -0.986
  603    H    ARG  84           H        ARG  84  -4.589   3.780  -1.831
  604    HA   ARG  84           HA       ARG  84  -6.726   3.567   0.133
  605   1HB   ARG  84          1HB       ARG  84  -5.075   1.473  -1.366
  606   2HB   ARG  84          2HB       ARG  84  -6.170   0.976  -0.084
  607   1HG   ARG  84          1HG       ARG  84  -8.124   1.640  -1.232
  608   2HG   ARG  84          2HG       ARG  84  -7.284   2.816  -2.246
  609   1HD   ARG  84          1HD       ARG  84  -6.211   1.028  -3.581
  610   2HD   ARG  84          2HD       ARG  84  -7.959   0.786  -3.576
  611    HE   ARG  84           HE       ARG  84  -5.911  -1.003  -2.306
  612   1HH1  ARG  84          1HH1      ARG  84  -9.188  -0.693  -3.255
  613   2HH1  ARG  84          2HH1      ARG  84  -9.732  -2.054  -2.151
  614   1HH2  ARG  84          1HH2      ARG  84  -6.676  -2.331  -0.600
  615   2HH2  ARG  84          2HH2      ARG  84  -8.431  -2.860  -0.694
  616    H    GLN  85           H        GLN  85  -3.284   2.657   0.283
  617    HA   GLN  85           HA       GLN  85  -3.421   1.540   3.064
  618   1HB   GLN  85          1HB       GLN  85  -0.822   1.569   2.793
  619   2HB   GLN  85          2HB       GLN  85  -1.106   2.080   1.139
  620   1HG   GLN  85          1HG       GLN  85  -2.691  -0.344   1.927
  621   2HG   GLN  85          2HG       GLN  85  -1.837  -0.002   0.439
  622   1HE2  GLN  85          1HE2      GLN  85   0.360  -1.680   3.569
  623   2HE2  GLN  85          2HE2      GLN  85  -0.913  -0.404   3.914
  624    H    MET  86           H        MET  86  -2.596   4.566   1.474
  625    HA   MET  86           HA       MET  86  -1.122   6.043   3.431
  626   1HB   MET  86          1HB       MET  86  -2.683   6.736   1.070
  627   2HB   MET  86          2HB       MET  86  -3.102   7.857   2.353
  628   1HG   MET  86          1HG       MET  86  -0.258   7.755   2.499
  629   2HG   MET  86          2HG       MET  86  -0.607   7.692   0.763
  630   1HE   MET  86          1HE       MET  86  -3.731   9.153   1.255
  631   2HE   MET  86          2HE       MET  86  -3.329  10.806   0.702
  632   3HE   MET  86          3HE       MET  86  -2.784   9.392  -0.247
  633    H    LYS  87           H        LYS  87  -4.554   5.251   3.285
  634    HA   LYS  87           HA       LYS  87  -5.512   6.950   5.506
  635   1HB   LYS  87          1HB       LYS  87  -7.432   5.115   5.582
  636   2HB   LYS  87          2HB       LYS  87  -6.676   4.484   4.126
  637   1HG   LYS  87          1HG       LYS  87  -7.346   6.232   2.781
  638   2HG   LYS  87          2HG       LYS  87  -7.205   7.449   4.039
  639   1HD   LYS  87          1HD       LYS  87  -9.405   7.116   4.806
  640   2HD   LYS  87          2HD       LYS  87  -9.562   6.794   3.083
  641   1HE   LYS  87          1HE       LYS  87  -9.077   4.215   3.870
  642   2HE   LYS  87          2HE       LYS  87  -9.727   4.818   5.401
  643   1HZ   LYS  87          1HZ       LYS  87 -11.486   3.970   4.007
  644   2HZ   LYS  87          2HZ       LYS  87 -11.098   4.984   2.762
  645   3HZ   LYS  87          3HZ       LYS  87 -11.699   5.600   4.172
  646    H    GLU  88           H        GLU  88  -5.844   6.455   7.627
  647    HA   GLU  88           HA       GLU  88  -4.092   4.261   8.806
  648   1HB   GLU  88          1HB       GLU  88  -4.787   5.595  11.022
  649   2HB   GLU  88          2HB       GLU  88  -3.439   6.069  10.006
  650   1HG   GLU  88          1HG       GLU  88  -4.679   8.079  10.584
  651   2HG   GLU  88          2HG       GLU  88  -4.925   7.797   8.869
  652    H    ASP  89           H        ASP  89  -7.402   5.445   8.570
  653    HA   ASP  89           HA       ASP  89  -8.595   3.546  10.528
  654   1HB   ASP  89          1HB       ASP  89  -9.866   5.462   8.506
  655   2HB   ASP  89          2HB       ASP  89  -9.742   5.646  10.240
  656    H    ALA  90           H        ALA  90  -8.420   1.477  10.109
  657    HA   ALA  90           HA       ALA  90  -9.984   0.203   7.931
  658   1HB   ALA  90          1HB       ALA  90  -8.115  -1.016   6.786
  659   2HB   ALA  90          2HB       ALA  90  -7.951   0.736   6.563
  660   3HB   ALA  90          3HB       ALA  90  -6.906  -0.110   7.730
   
  Start of MODEL           3
 Raw file had  660 H/Q atoms
  Start of MODEL    3
    1   1H    ALA   1          1H        ALA   1 -24.281  10.657 -13.622
    2   2H    ALA   1          2H        ALA   1 -23.079   9.778 -12.841
    3   3H    ALA   1          3H        ALA   1 -23.029  11.459 -12.836
    4    HA   ALA   1           HA       ALA   1 -23.047  11.182 -15.398
    5   1HB   ALA   1          1HB       ALA   1 -21.189  12.002 -13.535
    6   2HB   ALA   1          2HB       ALA   1 -20.869  11.963 -15.280
    7   3HB   ALA   1          3HB       ALA   1 -20.306  10.628 -14.242
    8    H    SER   2           H        SER   2 -22.725   9.724 -16.973
    9    HA   SER   2           HA       SER   2 -22.199   6.799 -16.259
   10   1HB   SER   2          1HB       SER   2 -24.352   7.433 -17.455
   11   2HB   SER   2          2HB       SER   2 -23.393   7.892 -18.865
   12    HG   SER   2           HG       SER   2 -23.029   5.382 -17.634
   13    H    MET   3           H        MET   3 -19.918   7.248 -16.052
   14    HA   MET   3           HA       MET   3 -18.360   6.878 -18.600
   15   1HB   MET   3          1HB       MET   3 -18.515   9.540 -17.238
   16   2HB   MET   3          2HB       MET   3 -16.880   9.002 -17.578
   17   1HG   MET   3          1HG       MET   3 -17.747   8.558 -20.048
   18   2HG   MET   3          2HG       MET   3 -19.148   9.526 -19.573
   19   1HE   MET   3          1HE       MET   3 -18.827  11.010 -21.367
   20   2HE   MET   3          2HE       MET   3 -17.169  11.086 -22.032
   21   3HE   MET   3          3HE       MET   3 -17.873  12.521 -21.231
   22    H    THR   4           H        THR   4 -15.941   6.867 -17.995
   23    HA   THR   4           HA       THR   4 -15.499   4.951 -15.799
   24    HB   THR   4           HB       THR   4 -12.975   5.373 -16.485
   25    HG1  THR   4           HG1      THR   4 -13.240   5.840 -18.866
   26   1HG2  THR   4          1HG2      THR   4 -13.938   3.194 -16.992
   27   2HG2  THR   4          2HG2      THR   4 -13.223   3.808 -18.499
   28   3HG2  THR   4          3HG2      THR   4 -14.989   3.858 -18.261
   29    H    ASP   5           H        ASP   5 -15.582   5.592 -13.775
   30    HA   ASP   5           HA       ASP   5 -14.893   8.402 -12.924
   31   1HB   ASP   5          1HB       ASP   5 -16.961   6.944 -12.109
   32   2HB   ASP   5          2HB       ASP   5 -15.821   6.243 -10.983
   33    H    GLN   6           H        GLN   6 -13.671   5.126 -12.658
   34    HA   GLN   6           HA       GLN   6 -11.821   5.339 -10.441
   35   1HB   GLN   6          1HB       GLN   6 -12.415   3.165 -11.432
   36   2HB   GLN   6          2HB       GLN   6 -10.678   3.377 -11.312
   37   1HG   GLN   6          1HG       GLN   6 -10.441   3.741 -13.718
   38   2HG   GLN   6          2HG       GLN   6 -12.167   3.913 -13.947
   39   1HE2  GLN   6          1HE2      GLN   6 -10.505   0.202 -14.151
   40   2HE2  GLN   6          2HE2      GLN   6  -9.536   1.745 -13.935
   41    H    GLN   7           H        GLN   7 -11.151   5.673 -13.946
   42    HA   GLN   7           HA       GLN   7  -8.323   6.500 -13.634
   43   1HB   GLN   7          1HB       GLN   7  -8.819   5.509 -15.755
   44   2HB   GLN   7          2HB       GLN   7  -8.518   7.211 -16.074
   45   1HG   GLN   7          1HG       GLN   7 -11.285   5.882 -15.988
   46   2HG   GLN   7          2HG       GLN   7 -11.059   7.619 -16.123
   47   1HE2  GLN   7          1HE2      GLN   7 -10.387   5.166 -19.395
   48   2HE2  GLN   7          2HE2      GLN   7 -10.680   4.494 -17.713
   49    H    ALA   8           H        ALA   8 -11.226   8.299 -14.739
   50    HA   ALA   8           HA       ALA   8 -10.194  10.961 -14.952
   51   1HB   ALA   8          1HB       ALA   8 -12.528  11.748 -14.593
   52   2HB   ALA   8          2HB       ALA   8 -12.482  10.340 -15.672
   53   3HB   ALA   8          3HB       ALA   8 -13.010  10.147 -13.981
   54    H    GLU   9           H        GLU   9 -10.966   9.079 -12.094
   55    HA   GLU   9           HA       GLU   9 -10.987  11.361 -10.164
   56   1HB   GLU   9          1HB       GLU   9 -11.547   8.434 -10.010
   57   2HB   GLU   9          2HB       GLU   9 -10.652   9.025  -8.618
   58   1HG   GLU   9          1HG       GLU   9 -13.428   9.145  -8.891
   59   2HG   GLU   9          2HG       GLU   9 -12.984  10.787  -9.342
   60    H    ALA  10           H        ALA  10  -8.745   8.734 -11.029
   61    HA   ALA  10           HA       ALA  10  -6.727   9.215  -8.976
   62   1HB   ALA  10          1HB       ALA  10  -5.249   7.762 -10.354
   63   2HB   ALA  10          2HB       ALA  10  -6.876   7.070 -10.206
   64   3HB   ALA  10          3HB       ALA  10  -6.379   7.858 -11.726
   65    NH1  ARG  11           NH1      ARG  11  -6.694  15.650 -18.078
   66    NH2  ARG  11           NH2      ARG  11  -8.449  16.172 -16.733
   67    H    ARG  11           H        ARG  11  -7.265  10.574 -12.176
   68    HA   ARG  11           HA       ARG  11  -4.572  11.833 -12.545
   69   1HB   ARG  11          1HB       ARG  11  -6.198  11.120 -14.441
   70   2HB   ARG  11          2HB       ARG  11  -7.165  12.527 -14.029
   71   1HG   ARG  11          1HG       ARG  11  -4.930  13.922 -14.340
   72   2HG   ARG  11          2HG       ARG  11  -4.339  12.499 -15.202
   73   1HD   ARG  11          1HD       ARG  11  -5.272  13.691 -16.991
   74   2HD   ARG  11          2HD       ARG  11  -6.647  12.668 -16.570
   75    HE   ARG  11           HE       ARG  11  -7.060  15.005 -15.000
   76   1HH1  ARG  11          1HH1      ARG  11  -8.926  16.028 -15.836
   77   2HH1  ARG  11          2HH1      ARG  11  -8.745  16.791 -17.495
   78   1HH2  ARG  11          1HH2      ARG  11  -5.858  15.075 -18.227
   79   2HH2  ARG  11          2HH2      ARG  11  -7.090  16.340 -18.727
   80    H    ALA  12           H        ALA  12  -7.785  12.811 -11.431
   81    HA   ALA  12           HA       ALA  12  -7.208  15.707 -11.054
   82   1HB   ALA  12          1HB       ALA  12  -9.360  15.760  -9.809
   83   2HB   ALA  12          2HB       ALA  12  -9.534  14.909 -11.357
   84   3HB   ALA  12          3HB       ALA  12  -9.457  13.983  -9.836
   85    H    PHE  13           H        PHE  13  -6.818  12.762  -9.178
   86    HA   PHE  13           HA       PHE  13  -6.558  13.873  -6.497
   87   1HB   PHE  13          1HB       PHE  13  -5.083  11.346  -7.364
   88   2HB   PHE  13          2HB       PHE  13  -6.827  11.369  -7.367
   89    HD1  PHE  13           HD1      PHE  13  -6.642  13.486  -4.782
   90    HD2  PHE  13           HD2      PHE  13  -5.189   9.523  -5.628
   91    HE1  PHE  13           HE1      PHE  13  -6.649  12.957  -2.378
   92    HE2  PHE  13           HE2      PHE  13  -5.203   9.015  -3.222
   93    HZ   PHE  13           HZ       PHE  13  -5.930  10.726  -1.594
   94    H    LEU  14           H        LEU  14  -4.123  12.975  -8.956
   95    HA   LEU  14           HA       LEU  14  -1.979  14.614  -7.482
   96   1HB   LEU  14          1HB       LEU  14  -0.459  12.881  -8.960
   97   2HB   LEU  14          2HB       LEU  14  -0.868  12.657  -7.273
   98    HG   LEU  14           HG       LEU  14  -2.966  11.296  -8.163
   99   1HD1  LEU  14          1HD1      LEU  14  -0.152  10.075  -8.474
  100   2HD1  LEU  14          2HD1      LEU  14  -0.955  10.349  -6.917
  101   3HD1  LEU  14          3HD1      LEU  14  -1.660   9.207  -8.088
  102   1HD2  LEU  14          1HD2      LEU  14  -2.721  10.205 -10.354
  103   2HD2  LEU  14          2HD2      LEU  14  -2.613  11.962 -10.625
  104   3HD2  LEU  14          3HD2      LEU  14  -1.141  10.980 -10.632
  105    H    SER  15           H        SER  15  -1.099  16.183  -8.598
  106    HA   SER  15           HA       SER  15  -2.201  17.042 -11.195
  107   1HB   SER  15          1HB       SER  15  -0.967  19.053 -10.917
  108   2HB   SER  15          2HB       SER  15  -1.432  18.564  -9.286
  109    HG   SER  15           HG       SER  15   0.590  18.742  -8.915
  110    H    GLU  16           H        GLU  16   0.100  18.158 -12.397
  111    HA   GLU  16           HA       GLU  16   1.084  15.823 -13.989
  112   1HB   GLU  16          1HB       GLU  16   0.375  17.824 -15.177
  113   2HB   GLU  16          2HB       GLU  16   1.512  18.839 -14.310
  114   1HG   GLU  16          1HG       GLU  16   1.969  17.838 -16.821
  115   2HG   GLU  16          2HG       GLU  16   2.677  16.521 -15.903
  116    H    GLU  17           H        GLU  17   2.291  18.071 -11.592
  117    HA   GLU  17           HA       GLU  17   5.170  17.605 -11.860
  118   1HB   GLU  17          1HB       GLU  17   3.462  18.772  -9.672
  119   2HB   GLU  17          2HB       GLU  17   5.051  18.204  -9.198
  120   1HG   GLU  17          1HG       GLU  17   5.504  20.449  -9.715
  121   2HG   GLU  17          2HG       GLU  17   5.948  19.676 -11.228
  122    H    MET  18           H        MET  18   2.744  16.143  -9.677
  123    HA   MET  18           HA       MET  18   4.592  14.176  -8.430
  124   1HB   MET  18          1HB       MET  18   2.761  13.356  -7.188
  125   2HB   MET  18          2HB       MET  18   1.587  13.739  -8.433
  126   1HG   MET  18          1HG       MET  18   2.617  16.298  -7.670
  127   2HG   MET  18          2HG       MET  18   1.037  15.609  -7.264
  128   1HE   MET  18          1HE       MET  18   4.795  16.135  -6.110
  129   2HE   MET  18          2HE       MET  18   4.867  15.161  -4.611
  130   3HE   MET  18          3HE       MET  18   4.707  14.347  -6.196
  131    H    ILE  19           H        ILE  19   2.345  14.228 -11.146
  132    HA   ILE  19           HA       ILE  19   2.180  11.347 -11.671
  133    HB   ILE  19           HB       ILE  19   1.396  13.821 -13.174
  134   1HG1  ILE  19          1HG1      ILE  19  -0.157  11.176 -12.912
  135   2HG1  ILE  19          2HG1      ILE  19  -0.079  12.310 -11.581
  136   1HG2  ILE  19          1HG2      ILE  19   0.891  12.606 -15.309
  137   2HG2  ILE  19          2HG2      ILE  19   2.626  12.599 -15.001
  138   3HG2  ILE  19          3HG2      ILE  19   1.672  11.133 -14.682
  139   1HD1  ILE  19          1HD1      ILE  19  -1.299  12.955 -14.330
  140   2HD1  ILE  19          2HD1      ILE  19  -2.151  12.708 -12.792
  141   3HD1  ILE  19          3HD1      ILE  19  -1.104  14.131 -13.002
  142    H    ALA  20           H        ALA  20   4.478  13.875 -12.515
  143    HA   ALA  20           HA       ALA  20   5.903  12.609 -14.706
  144   1HB   ALA  20          1HB       ALA  20   7.721  14.245 -14.226
  145   2HB   ALA  20          2HB       ALA  20   6.126  15.021 -14.188
  146   3HB   ALA  20          3HB       ALA  20   6.977  14.661 -12.664
  147    H    GLU  21           H        GLU  21   6.084  12.166 -11.232
  148    HA   GLU  21           HA       GLU  21   8.711  10.843 -11.079
  149   1HB   GLU  21          1HB       GLU  21   7.958  10.091  -8.789
  150   2HB   GLU  21          2HB       GLU  21   6.367  10.755  -9.103
  151   1HG   GLU  21          1HG       GLU  21   7.741  13.039  -9.570
  152   2HG   GLU  21          2HG       GLU  21   7.286  12.547  -7.948
  153    H    PHE  22           H        PHE  22   5.421   9.780 -11.712
  154    HA   PHE  22           HA       PHE  22   5.989   6.853 -11.383
  155   1HB   PHE  22          1HB       PHE  22   3.458   8.274 -12.421
  156   2HB   PHE  22          2HB       PHE  22   3.603   6.556 -12.165
  157    HD1  PHE  22           HD1      PHE  22   3.865   5.596  -9.825
  158    HD2  PHE  22           HD2      PHE  22   3.119   9.786 -10.471
  159    HE1  PHE  22           HE1      PHE  22   3.259   5.864  -7.457
  160    HE2  PHE  22           HE2      PHE  22   2.518  10.033  -8.098
  161    HZ   PHE  22           HZ       PHE  22   2.551   8.070  -6.597
  162    H    LYS  23           H        LYS  23   5.542   9.181 -14.013
  163    HA   LYS  23           HA       LYS  23   5.382   7.195 -16.237
  164   1HB   LYS  23          1HB       LYS  23   5.611   9.142 -17.769
  165   2HB   LYS  23          2HB       LYS  23   4.322   9.353 -16.604
  166   1HG   LYS  23          1HG       LYS  23   5.181  11.327 -15.904
  167   2HG   LYS  23          2HG       LYS  23   6.703  10.564 -15.476
  168   1HD   LYS  23          1HD       LYS  23   7.800  11.265 -17.381
  169   2HD   LYS  23          2HD       LYS  23   6.402  11.008 -18.432
  170   1HE   LYS  23          1HE       LYS  23   7.284  13.507 -17.871
  171   2HE   LYS  23          2HE       LYS  23   6.278  13.320 -16.427
  172   1HZ   LYS  23          1HZ       LYS  23   4.772  14.134 -17.927
  173   2HZ   LYS  23          2HZ       LYS  23   4.525  12.525 -18.207
  174   3HZ   LYS  23          3HZ       LYS  23   5.454  13.411 -19.247
  175    H    ALA  24           H        ALA  24   7.900   9.103 -14.663
  176    HA   ALA  24           HA       ALA  24  10.193   8.682 -16.373
  177   1HB   ALA  24          1HB       ALA  24  11.578   8.951 -14.325
  178   2HB   ALA  24          2HB       ALA  24  10.277  10.155 -14.385
  179   3HB   ALA  24          3HB       ALA  24  10.143   8.755 -13.291
  180    H    ALA  25           H        ALA  25   9.086   6.695 -13.604
  181    HA   ALA  25           HA       ALA  25  10.945   4.427 -14.195
  182   1HB   ALA  25          1HB       ALA  25   9.900   3.352 -12.210
  183   2HB   ALA  25          2HB       ALA  25  10.385   5.020 -11.852
  184   3HB   ALA  25          3HB       ALA  25   8.667   4.632 -12.121
  185    H    PHE  26           H        PHE  26   7.829   5.372 -15.280
  186    HA   PHE  26           HA       PHE  26   6.464   2.765 -15.508
  187   1HB   PHE  26          1HB       PHE  26   4.978   4.587 -15.557
  188   2HB   PHE  26          2HB       PHE  26   5.941   5.532 -16.662
  189    HD1  PHE  26           HD1      PHE  26   3.290   3.004 -16.345
  190    HD2  PHE  26           HD2      PHE  26   5.941   4.870 -19.174
  191    HE1  PHE  26           HE1      PHE  26   1.872   2.228 -18.202
  192    HE2  PHE  26           HE2      PHE  26   4.512   4.081 -21.018
  193    HZ   PHE  26           HZ       PHE  26   2.463   2.788 -20.535
  194    H    ASP  27           H        ASP  27   8.604   4.670 -17.582
  195    HA   ASP  27           HA       ASP  27   8.277   3.157 -20.068
  196   1HB   ASP  27          1HB       ASP  27  10.690   4.855 -19.207
  197   2HB   ASP  27          2HB       ASP  27  10.447   4.197 -20.808
  198    H    MET  28           H        MET  28  10.874   3.069 -17.607
  199    HA   MET  28           HA       MET  28  12.433   0.843 -18.450
  200   1HB   MET  28          1HB       MET  28  12.061   0.596 -15.562
  201   2HB   MET  28          2HB       MET  28  13.487   1.069 -16.503
  202   1HG   MET  28          1HG       MET  28  11.288   3.086 -15.754
  203   2HG   MET  28          2HG       MET  28  12.710   2.744 -14.751
  204   1HE   MET  28          1HE       MET  28  14.741   4.182 -14.839
  205   2HE   MET  28          2HE       MET  28  14.834   5.563 -15.971
  206   3HE   MET  28          3HE       MET  28  13.402   5.370 -14.917
  207    H    PHE  29           H        PHE  29   9.613   0.725 -16.251
  208    HA   PHE  29           HA       PHE  29   9.202  -2.058 -15.930
  209   1HB   PHE  29          1HB       PHE  29   7.785  -0.076 -14.975
  210   2HB   PHE  29          2HB       PHE  29   6.832  -0.173 -16.431
  211    HD1  PHE  29           HD1      PHE  29   4.967  -0.588 -14.630
  212    HD2  PHE  29           HD2      PHE  29   8.049  -3.471 -15.482
  213    HE1  PHE  29           HE1      PHE  29   3.599  -2.368 -13.621
  214    HE2  PHE  29           HE2      PHE  29   6.667  -5.232 -14.461
  215    HZ   PHE  29           HZ       PHE  29   4.439  -4.691 -13.547
  216    H    ASP  30           H        ASP  30   8.137  -0.003 -18.639
  217    HA   ASP  30           HA       ASP  30   6.631  -1.912 -20.183
  218   1HB   ASP  30          1HB       ASP  30   7.105   0.724 -20.559
  219   2HB   ASP  30          2HB       ASP  30   8.294   0.124 -21.693
  220    H    ALA  31           H        ALA  31   9.928  -0.840 -21.056
  221    HA   ALA  31           HA       ALA  31  11.916  -2.128 -21.570
  222   1HB   ALA  31          1HB       ALA  31  11.883  -4.615 -21.538
  223   2HB   ALA  31          2HB       ALA  31  11.165  -3.936 -20.064
  224   3HB   ALA  31          3HB       ALA  31  10.116  -4.627 -21.329
  225    H    ASP  32           H        ASP  32   8.845  -2.472 -23.209
  226    HA   ASP  32           HA       ASP  32  10.047  -3.476 -25.802
  227   1HB   ASP  32          1HB       ASP  32   7.597  -4.036 -24.689
  228   2HB   ASP  32          2HB       ASP  32   8.024  -4.264 -26.369
  229    H    GLY  33           H        GLY  33   8.702  -0.584 -24.312
  230   1HA   GLY  33          1HA       GLY  33  10.050   1.368 -25.972
  231   2HA   GLY  33          2HA       GLY  33   8.510   1.082 -26.749
  232    H    GLY  34           H        GLY  34   6.554   1.469 -25.472
  233   1HA   GLY  34          1HA       GLY  34   6.764   3.986 -23.800
  234   2HA   GLY  34          2HA       GLY  34   6.138   2.577 -22.933
  235    H    GLY  35           H        GLY  35   4.072   3.128 -22.670
  236   1HA   GLY  35          1HA       GLY  35   2.251   3.395 -25.126
  237   2HA   GLY  35          2HA       GLY  35   2.181   4.643 -23.874
  238    H    ASP  36           H        ASP  36   2.524   1.103 -23.646
  239    HA   ASP  36           HA       ASP  36   0.629   0.912 -21.354
  240   1HB   ASP  36          1HB       ASP  36  -1.250  -0.071 -22.238
  241   2HB   ASP  36          2HB       ASP  36  -0.397  -0.839 -23.558
  242    H    ILE  37           H        ILE  37   1.239  -0.722 -20.128
  243    HA   ILE  37           HA       ILE  37   3.486  -2.526 -20.991
  244    HB   ILE  37           HB       ILE  37   2.405  -3.134 -18.325
  245   1HG1  ILE  37          1HG1      ILE  37   2.984  -0.221 -18.910
  246   2HG1  ILE  37          2HG1      ILE  37   1.874  -0.943 -17.761
  247   1HG2  ILE  37          1HG2      ILE  37   4.785  -3.107 -17.686
  248   2HG2  ILE  37          2HG2      ILE  37   4.588  -3.973 -19.216
  249   3HG2  ILE  37          3HG2      ILE  37   5.236  -2.315 -19.215
  250   1HD1  ILE  37          1HD1      ILE  37   4.915  -0.726 -17.343
  251   2HD1  ILE  37          2HD1      ILE  37   3.638   0.192 -16.516
  252   3HD1  ILE  37          3HD1      ILE  37   3.795  -1.557 -16.230
  253    H    SER  38           H        SER  38   3.285  -4.867 -20.045
  254    HA   SER  38           HA       SER  38   0.609  -6.115 -20.799
  255   1HB   SER  38          1HB       SER  38   3.084  -7.302 -22.097
  256   2HB   SER  38          2HB       SER  38   2.334  -5.879 -22.824
  257    HG   SER  38           HG       SER  38   1.496  -8.454 -22.732
  258    H    THR  39           H        THR  39   1.022  -8.646 -20.624
  259    HA   THR  39           HA       THR  39   1.833  -9.175 -17.781
  260    HB   THR  39           HB       THR  39   1.125 -11.664 -18.709
  261    HG1  THR  39           HG1      THR  39   0.662 -10.591 -20.744
  262   1HG2  THR  39          1HG2      THR  39  -1.092 -11.331 -17.706
  263   2HG2  THR  39          2HG2      THR  39   0.118 -10.505 -16.698
  264   3HG2  THR  39          3HG2      THR  39  -0.932  -9.562 -17.788
  265    H    LYS  40           H        LYS  40   3.055  -9.711 -21.016
  266    HA   LYS  40           HA       LYS  40   5.103 -11.759 -20.240
  267   1HB   LYS  40          1HB       LYS  40   3.878 -11.196 -22.622
  268   2HB   LYS  40          2HB       LYS  40   5.362 -10.320 -22.895
  269   1HG   LYS  40          1HG       LYS  40   4.886 -12.982 -23.436
  270   2HG   LYS  40          2HG       LYS  40   5.526 -13.174 -21.825
  271   1HD   LYS  40          1HD       LYS  40   7.561 -11.620 -22.968
  272   2HD   LYS  40          2HD       LYS  40   7.529 -13.346 -22.756
  273   1HE   LYS  40          1HE       LYS  40   6.835 -11.874 -25.336
  274   2HE   LYS  40          2HE       LYS  40   8.205 -12.939 -25.054
  275   1HZ   LYS  40          1HZ       LYS  40   6.456 -14.049 -26.287
  276   2HZ   LYS  40          2HZ       LYS  40   5.335 -13.761 -25.108
  277   3HZ   LYS  40          3HZ       LYS  40   6.594 -14.790 -24.817
  278    H    GLU  41           H        GLU  41   5.000  -8.313 -21.177
  279    HA   GLU  41           HA       GLU  41   7.886  -7.761 -20.937
  280   1HB   GLU  41          1HB       GLU  41   7.422  -5.776 -21.808
  281   2HB   GLU  41          2HB       GLU  41   6.356  -5.342 -20.488
  282   1HG   GLU  41          1HG       GLU  41   5.540  -6.848 -23.050
  283   2HG   GLU  41          2HG       GLU  41   4.469  -6.620 -21.685
  284    H    LEU  42           H        LEU  42   5.096  -7.334 -18.774
  285    HA   LEU  42           HA       LEU  42   6.325  -6.126 -16.458
  286   1HB   LEU  42          1HB       LEU  42   3.897  -6.428 -16.586
  287   2HB   LEU  42          2HB       LEU  42   4.042  -8.171 -16.641
  288    HG   LEU  42           HG       LEU  42   3.543  -6.599 -14.359
  289   1HD1  LEU  42          1HD1      LEU  42   6.389  -7.729 -14.009
  290   2HD1  LEU  42          2HD1      LEU  42   6.039  -6.015 -14.281
  291   3HD1  LEU  42          3HD1      LEU  42   5.432  -6.820 -12.813
  292   1HD2  LEU  42          1HD2      LEU  42   3.541  -8.724 -13.107
  293   2HD2  LEU  42          2HD2      LEU  42   2.936  -9.055 -14.750
  294   3HD2  LEU  42          3HD2      LEU  42   4.596  -9.502 -14.316
  295    H    GLY  43           H        GLY  43   6.011  -9.569 -17.335
  296   1HA   GLY  43          1HA       GLY  43   7.286 -11.532 -16.684
  297   2HA   GLY  43          2HA       GLY  43   7.082 -10.886 -15.052
  298    H    THR  44           H        THR  44   8.794  -9.060 -17.497
  299    HA   THR  44           HA       THR  44  11.496 -10.110 -17.015
  300    HB   THR  44           HB       THR  44  10.348  -7.897 -18.645
  301    HG1  THR  44           HG1      THR  44  12.647  -9.333 -19.247
  302   1HG2  THR  44          1HG2      THR  44  12.553  -6.817 -19.122
  303   2HG2  THR  44          2HG2      THR  44  12.032  -6.503 -17.453
  304   3HG2  THR  44          3HG2      THR  44  13.299  -7.714 -17.776
  305    H    VAL  45           H        VAL  45  10.064  -6.940 -16.170
  306    HA   VAL  45           HA       VAL  45  12.250  -5.935 -14.553
  307    HB   VAL  45           HB       VAL  45   9.435  -5.108 -15.012
  308   1HG1  VAL  45          1HG1      VAL  45   9.288  -3.537 -13.079
  309   2HG1  VAL  45          2HG1      VAL  45   9.314  -5.210 -12.510
  310   3HG1  VAL  45          3HG1      VAL  45  10.781  -4.215 -12.379
  311   1HG2  VAL  45          1HG2      VAL  45  12.021  -3.463 -14.611
  312   2HG2  VAL  45          2HG2      VAL  45  11.337  -3.961 -16.176
  313   3HG2  VAL  45          3HG2      VAL  45  10.447  -2.824 -15.153
  314    H    MET  46           H        MET  46   9.485  -7.999 -13.807
  315    HA   MET  46           HA       MET  46   9.587  -7.906 -10.869
  316   1HB   MET  46          1HB       MET  46   8.401 -10.276 -11.135
  317   2HB   MET  46          2HB       MET  46   8.336  -9.866 -12.839
  318   1HG   MET  46          1HG       MET  46   7.302  -7.518 -11.703
  319   2HG   MET  46          2HG       MET  46   6.343  -8.859 -12.353
  320   1HE   MET  46          1HE       MET  46   6.289  -6.540  -9.606
  321   2HE   MET  46          2HE       MET  46   6.408  -7.428  -8.059
  322   3HE   MET  46          3HE       MET  46   7.870  -7.179  -9.057
  323    NH1  ARG  47           NH1      ARG  47  16.647 -14.565 -16.619
  324    NH2  ARG  47           NH2      ARG  47  17.678 -15.232 -14.706
  325    H    ARG  47           H        ARG  47  11.068  -9.985 -13.330
  326    HA   ARG  47           HA       ARG  47  12.388 -12.010 -11.795
  327   1HB   ARG  47          1HB       ARG  47  14.127 -10.860 -13.939
  328   2HB   ARG  47          2HB       ARG  47  12.481 -11.194 -14.459
  329   1HG   ARG  47          1HG       ARG  47  13.946 -13.368 -12.898
  330   2HG   ARG  47          2HG       ARG  47  12.630 -13.524 -14.063
  331   1HD   ARG  47          1HD       ARG  47  14.091 -13.775 -15.825
  332   2HD   ARG  47          2HD       ARG  47  14.928 -12.287 -15.408
  333    HE   ARG  47           HE       ARG  47  15.940 -14.111 -13.492
  334   1HH1  ARG  47          1HH1      ARG  47  15.865 -14.059 -17.049
  335   2HH1  ARG  47          2HH1      ARG  47  17.405 -15.055 -17.107
  336   1HH2  ARG  47          1HH2      ARG  47  17.685 -15.237 -13.680
  337   2HH2  ARG  47          2HH2      ARG  47  18.364 -15.674 -15.328
  338    H    MET  48           H        MET  48  13.699  -8.816 -12.730
  339    HA   MET  48           HA       MET  48  16.254  -8.906 -11.430
  340   1HB   MET  48          1HB       MET  48  15.108  -6.976 -12.929
  341   2HB   MET  48          2HB       MET  48  16.525  -6.709 -11.930
  342   1HG   MET  48          1HG       MET  48  14.051  -6.218 -10.360
  343   2HG   MET  48          2HG       MET  48  14.097  -5.241 -11.837
  344   1HE   MET  48          1HE       MET  48  14.089  -3.465  -9.398
  345   2HE   MET  48          2HE       MET  48  15.544  -2.447  -9.607
  346   3HE   MET  48          3HE       MET  48  14.521  -2.839 -11.020
  347    H    LEU  49           H        LEU  49  13.055  -8.247 -10.110
  348    HA   LEU  49           HA       LEU  49  13.565  -7.108  -7.548
  349   1HB   LEU  49          1HB       LEU  49  11.524  -9.365  -7.766
  350   2HB   LEU  49          2HB       LEU  49  11.288  -7.916  -8.719
  351    HG   LEU  49           HG       LEU  49  11.123  -6.497  -6.723
  352   1HD1  LEU  49          1HD1      LEU  49  11.706  -8.972  -4.979
  353   2HD1  LEU  49          2HD1      LEU  49  12.892  -7.703  -5.340
  354   3HD1  LEU  49          3HD1      LEU  49  11.424  -7.305  -4.414
  355   1HD2  LEU  49          1HD2      LEU  49   9.058  -7.355  -5.698
  356   2HD2  LEU  49          2HD2      LEU  49   9.044  -7.855  -7.407
  357   3HD2  LEU  49          3HD2      LEU  49   9.456  -9.032  -6.151
  358    H    GLY  50           H        GLY  50  13.407 -10.596  -8.333
  359   1HA   GLY  50          1HA       GLY  50  14.764 -11.447  -5.767
  360   2HA   GLY  50          2HA       GLY  50  15.808 -11.519  -7.192
  361    H    GLN  51           H        GLN  51  12.320 -12.143  -7.035
  362    HA   GLN  51           HA       GLN  51  12.591 -15.139  -7.144
  363   1HB   GLN  51          1HB       GLN  51  10.623 -13.469  -6.138
  364   2HB   GLN  51          2HB       GLN  51   9.915 -13.898  -7.685
  365   1HG   GLN  51          1HG       GLN  51   9.806 -16.234  -7.162
  366   2HG   GLN  51          2HG       GLN  51  11.000 -16.124  -5.888
  367   1HE2  GLN  51          1HE2      GLN  51   7.040 -15.233  -5.041
  368   2HE2  GLN  51          2HE2      GLN  51   7.662 -15.216  -6.767
  369    H    ASN  52           H        ASN  52  10.907 -16.085  -8.878
  370    HA   ASN  52           HA       ASN  52  11.026 -14.750 -11.551
  371   1HB   ASN  52          1HB       ASN  52  12.328 -17.512 -11.420
  372   2HB   ASN  52          2HB       ASN  52  13.280 -16.082 -11.090
  373   1HD2  ASN  52          1HD2      ASN  52  13.719 -16.694 -14.730
  374   2HD2  ASN  52          2HD2      ASN  52  14.187 -17.434 -13.118
  375    HA   PRO  53           HA       PRO  53   7.251 -17.569 -11.032
  376   1HB   PRO  53          1HB       PRO  53   5.330 -15.901 -12.095
  377   2HB   PRO  53          2HB       PRO  53   5.985 -15.741 -10.459
  378   1HG   PRO  53          1HG       PRO  53   6.731 -14.129 -12.940
  379   2HG   PRO  53          2HG       PRO  53   6.445 -13.534 -11.288
  380   1HD   PRO  53          1HD       PRO  53   8.681 -14.066 -10.628
  381   2HD   PRO  53          2HD       PRO  53   9.003 -14.078 -12.387
  382    H    THR  54           H        THR  54   5.469 -18.076 -12.827
  383    HA   THR  54           HA       THR  54   6.946 -18.759 -15.402
  384    HB   THR  54           HB       THR  54   5.743 -20.530 -13.835
  385    HG1  THR  54           HG1      THR  54   5.061 -21.228 -16.301
  386   1HG2  THR  54          1HG2      THR  54   3.496 -21.209 -14.613
  387   2HG2  THR  54          2HG2      THR  54   3.422 -19.571 -13.924
  388   3HG2  THR  54          3HG2      THR  54   3.394 -19.796 -15.691
  389    H    LYS  55           H        LYS  55   4.909 -19.186 -17.119
  390    HA   LYS  55           HA       LYS  55   4.124 -16.420 -17.929
  391   1HB   LYS  55          1HB       LYS  55   3.106 -17.588 -19.960
  392   2HB   LYS  55          2HB       LYS  55   3.537 -19.138 -19.267
  393   1HG   LYS  55          1HG       LYS  55   5.179 -17.243 -20.794
  394   2HG   LYS  55          2HG       LYS  55   5.986 -17.641 -19.288
  395   1HD   LYS  55          1HD       LYS  55   5.227 -19.498 -21.614
  396   2HD   LYS  55          2HD       LYS  55   6.789 -19.261 -20.846
  397   1HE   LYS  55          1HE       LYS  55   5.728 -20.340 -18.699
  398   2HE   LYS  55          2HE       LYS  55   4.418 -20.877 -19.747
  399   1HZ   LYS  55          1HZ       LYS  55   6.452 -21.769 -21.170
  400   2HZ   LYS  55          2HZ       LYS  55   5.867 -22.634 -19.889
  401   3HZ   LYS  55          3HZ       LYS  55   7.234 -21.723 -19.715
  402    H    GLU  56           H        GLU  56   2.606 -19.333 -16.652
  403    HA   GLU  56           HA       GLU  56  -0.212 -18.431 -16.937
  404   1HB   GLU  56          1HB       GLU  56  -0.458 -20.429 -15.121
  405   2HB   GLU  56          2HB       GLU  56   1.152 -20.823 -15.691
  406   1HG   GLU  56          1HG       GLU  56  -0.879 -21.981 -16.852
  407   2HG   GLU  56          2HG       GLU  56  -1.224 -20.440 -17.618
  408    H    GLU  57           H        GLU  57   2.285 -18.375 -14.445
  409    HA   GLU  57           HA       GLU  57   0.566 -17.563 -12.166
  410   1HB   GLU  57          1HB       GLU  57   2.612 -17.176 -10.904
  411   2HB   GLU  57          2HB       GLU  57   3.591 -17.211 -12.355
  412   1HG   GLU  57          1HG       GLU  57   2.781 -19.711 -12.656
  413   2HG   GLU  57          2HG       GLU  57   3.997 -19.353 -11.436
  414    H    LEU  58           H        LEU  58   2.452 -15.920 -14.647
  415    HA   LEU  58           HA       LEU  58   2.528 -13.231 -13.465
  416   1HB   LEU  58          1HB       LEU  58   3.296 -14.515 -16.030
  417   2HB   LEU  58          2HB       LEU  58   2.683 -12.891 -16.265
  418    HG   LEU  58           HG       LEU  58   4.698 -13.187 -14.030
  419   1HD1  LEU  58          1HD1      LEU  58   4.657 -11.206 -16.403
  420   2HD1  LEU  58          2HD1      LEU  58   3.804 -10.915 -14.880
  421   3HD1  LEU  58          3HD1      LEU  58   5.579 -11.052 -14.885
  422   1HD2  LEU  58          1HD2      LEU  58   6.658 -13.443 -15.505
  423   2HD2  LEU  58          2HD2      LEU  58   5.558 -14.815 -15.787
  424   3HD2  LEU  58          3HD2      LEU  58   5.624 -13.483 -16.956
  425    H    ASP  59           H        ASP  59   0.278 -15.002 -15.517
  426    HA   ASP  59           HA       ASP  59  -1.453 -12.818 -16.393
  427   1HB   ASP  59          1HB       ASP  59  -1.489 -15.039 -17.503
  428   2HB   ASP  59          2HB       ASP  59  -2.148 -15.789 -16.068
  429    H    ALA  60           H        ALA  60  -1.324 -14.783 -13.476
  430    HA   ALA  60           HA       ALA  60  -3.822 -13.779 -12.219
  431   1HB   ALA  60          1HB       ALA  60  -2.973 -14.887 -10.158
  432   2HB   ALA  60          2HB       ALA  60  -2.863 -15.962 -11.565
  433   3HB   ALA  60          3HB       ALA  60  -1.395 -15.179 -10.927
  434    H    ILE  61           H        ILE  61  -0.369 -12.970 -12.044
  435    HA   ILE  61           HA       ILE  61  -0.297 -11.043  -9.920
  436    HB   ILE  61           HB       ILE  61   1.444 -11.666 -12.222
  437   1HG1  ILE  61          1HG1      ILE  61   2.732 -12.312 -10.465
  438   2HG1  ILE  61          2HG1      ILE  61   1.583 -11.634  -9.332
  439   1HG2  ILE  61          1HG2      ILE  61   2.767  -9.531 -12.231
  440   2HG2  ILE  61          2HG2      ILE  61   1.127  -9.247 -12.810
  441   3HG2  ILE  61          3HG2      ILE  61   1.571  -8.765 -11.156
  442   1HD1  ILE  61          1HD1      ILE  61   2.722  -9.430  -9.312
  443   2HD1  ILE  61          2HD1      ILE  61   3.871 -10.735  -8.950
  444   3HD1  ILE  61          3HD1      ILE  61   3.867  -9.985 -10.564
  445    H    ILE  62           H        ILE  62  -1.343 -10.747 -13.283
  446    HA   ILE  62           HA       ILE  62  -1.861  -7.789 -13.128
  447    HB   ILE  62           HB       ILE  62  -2.139  -9.854 -15.338
  448   1HG1  ILE  62          1HG1      ILE  62  -0.378  -7.433 -14.788
  449   2HG1  ILE  62          2HG1      ILE  62   0.061  -9.020 -15.383
  450   1HG2  ILE  62          1HG2      ILE  62  -3.128  -8.136 -16.879
  451   2HG2  ILE  62          2HG2      ILE  62  -4.230  -8.468 -15.545
  452   3HG2  ILE  62          3HG2      ILE  62  -3.261  -6.977 -15.533
  453   1HD1  ILE  62          1HD1      ILE  62  -1.277  -6.843 -17.096
  454   2HD1  ILE  62          2HD1      ILE  62   0.401  -7.418 -17.181
  455   3HD1  ILE  62          3HD1      ILE  62  -0.928  -8.504 -17.650
  456    H    GLU  63           H        GLU  63  -3.617 -10.855 -13.046
  457    HA   GLU  63           HA       GLU  63  -6.351 -10.087 -13.150
  458   1HB   GLU  63          1HB       GLU  63  -5.452 -12.112 -11.057
  459   2HB   GLU  63          2HB       GLU  63  -5.252 -12.456 -12.764
  460   1HG   GLU  63          1HG       GLU  63  -7.564 -12.703 -13.141
  461   2HG   GLU  63          2HG       GLU  63  -7.422 -13.285 -11.491
  462    H    GLU  64           H        GLU  64  -4.017  -9.698 -10.538
  463    HA   GLU  64           HA       GLU  64  -5.621  -8.994  -8.281
  464   1HB   GLU  64          1HB       GLU  64  -2.828  -8.282  -9.146
  465   2HB   GLU  64          2HB       GLU  64  -3.383  -9.168  -7.739
  466   1HG   GLU  64          1HG       GLU  64  -4.316  -6.403  -7.480
  467   2HG   GLU  64          2HG       GLU  64  -2.628  -6.363  -7.957
  468    H    VAL  65           H        VAL  65  -3.951  -6.452 -10.133
  469    HA   VAL  65           HA       VAL  65  -6.263  -4.546  -9.646
  470    HB   VAL  65           HB       VAL  65  -4.351  -3.476  -8.926
  471   1HG1  VAL  65          1HG1      VAL  65  -4.418  -2.450 -11.837
  472   2HG1  VAL  65          2HG1      VAL  65  -5.652  -2.055 -10.625
  473   3HG1  VAL  65          3HG1      VAL  65  -3.967  -1.540 -10.374
  474   1HG2  VAL  65          1HG2      VAL  65  -2.108  -3.464  -9.901
  475   2HG2  VAL  65          2HG2      VAL  65  -2.652  -5.159  -9.913
  476   3HG2  VAL  65          3HG2      VAL  65  -2.675  -4.218 -11.411
  477    H    ASP  66           H        ASP  66  -7.679  -5.467 -11.163
  478    HA   ASP  66           HA       ASP  66  -7.454  -4.427 -13.939
  479   1HB   ASP  66          1HB       ASP  66  -8.001  -7.164 -14.550
  480   2HB   ASP  66          2HB       ASP  66  -6.611  -7.209 -13.490
  481    H    GLU  67           H        GLU  67  -9.245  -3.419 -12.824
  482    HA   GLU  67           HA       GLU  67 -11.769  -4.928 -12.244
  483   1HB   GLU  67          1HB       GLU  67 -12.632  -2.342 -12.381
  484   2HB   GLU  67          2HB       GLU  67 -10.927  -2.036 -12.115
  485   1HG   GLU  67          1HG       GLU  67 -12.506  -2.183 -10.032
  486   2HG   GLU  67          2HG       GLU  67 -12.548  -3.918 -10.291
  487    H    ASP  68           H        ASP  68 -10.296  -3.161 -14.903
  488    HA   ASP  68           HA       ASP  68 -12.714  -3.227 -16.675
  489   1HB   ASP  68          1HB       ASP  68 -10.930  -2.532 -18.501
  490   2HB   ASP  68          2HB       ASP  68 -11.511  -1.387 -17.313
  491    H    GLY  69           H        GLY  69  -9.794  -5.116 -16.129
  492   1HA   GLY  69          1HA       GLY  69  -9.268  -7.416 -16.722
  493   2HA   GLY  69          2HA       GLY  69 -10.950  -7.598 -17.237
  494    H    SER  70           H        SER  70  -8.721  -5.142 -18.438
  495    HA   SER  70           HA       SER  70  -9.167  -5.733 -21.309
  496   1HB   SER  70          1HB       SER  70  -7.298  -4.062 -21.677
  497   2HB   SER  70          2HB       SER  70  -8.663  -3.462 -20.732
  498    HG   SER  70           HG       SER  70  -6.867  -2.884 -19.671
  499    H    GLY  71           H        GLY  71  -6.766  -6.605 -18.870
  500   1HA   GLY  71          1HA       GLY  71  -5.502  -8.792 -18.994
  501   2HA   GLY  71          2HA       GLY  71  -5.558  -8.679 -20.759
  502    H    THR  72           H        THR  72  -4.887  -5.849 -20.834
  503    HA   THR  72           HA       THR  72  -1.902  -5.965 -20.171
  504    HB   THR  72           HB       THR  72  -1.836  -3.954 -21.902
  505    HG1  THR  72           HG1      THR  72  -3.319  -4.199 -23.512
  506   1HG2  THR  72          1HG2      THR  72  -1.323  -5.460 -23.781
  507   2HG2  THR  72          2HG2      THR  72  -0.608  -6.129 -22.298
  508   3HG2  THR  72          3HG2      THR  72  -2.096  -6.842 -22.974
  509    H    ILE  73           H        ILE  73  -0.942  -4.115 -19.278
  510    HA   ILE  73           HA       ILE  73  -2.797  -2.400 -17.576
  511    HB   ILE  73           HB       ILE  73   0.195  -2.982 -17.315
  512   1HG1  ILE  73          1HG1      ILE  73  -2.246  -3.813 -15.620
  513   2HG1  ILE  73          2HG1      ILE  73  -1.186  -4.865 -16.533
  514   1HG2  ILE  73          1HG2      ILE  73   0.239  -1.573 -15.261
  515   2HG2  ILE  73          2HG2      ILE  73  -0.263  -0.587 -16.642
  516   3HG2  ILE  73          3HG2      ILE  73  -1.475  -1.141 -15.462
  517   1HD1  ILE  73          1HD1      ILE  73  -0.333  -3.327 -14.011
  518   2HD1  ILE  73          2HD1      ILE  73  -0.625  -5.072 -14.171
  519   3HD1  ILE  73          3HD1      ILE  73   0.755  -4.327 -15.013
  520    H    ASP  74           H        ASP  74  -2.280  -0.112 -17.388
  521    HA   ASP  74           HA       ASP  74  -0.829   1.189 -19.714
  522   1HB   ASP  74          1HB       ASP  74  -2.743   1.461 -20.889
  523   2HB   ASP  74          2HB       ASP  74  -3.019   2.795 -19.793
  524    H    PHE  75           H        PHE  75  -1.162   3.714 -19.374
  525    HA   PHE  75           HA       PHE  75   0.183   4.348 -16.807
  526   1HB   PHE  75          1HB       PHE  75   0.527   5.469 -19.168
  527   2HB   PHE  75          2HB       PHE  75  -0.875   6.434 -18.791
  528    HD1  PHE  75           HD1      PHE  75   0.275   8.582 -18.708
  529    HD2  PHE  75           HD2      PHE  75   1.640   5.371 -16.188
  530    HE1  PHE  75           HE1      PHE  75   1.641  10.166 -17.412
  531    HE2  PHE  75           HE2      PHE  75   2.994   6.975 -14.899
  532    HZ   PHE  75           HZ       PHE  75   2.990   9.370 -15.499
  533    H    GLU  76           H        GLU  76  -3.048   4.680 -18.158
  534    HA   GLU  76           HA       GLU  76  -4.154   6.560 -16.172
  535   1HB   GLU  76          1HB       GLU  76  -5.433   4.789 -18.284
  536   2HB   GLU  76          2HB       GLU  76  -6.426   5.596 -17.090
  537   1HG   GLU  76          1HG       GLU  76  -6.318   7.592 -18.199
  538   2HG   GLU  76          2HG       GLU  76  -4.570   7.538 -18.295
  539    H    GLU  77           H        GLU  77  -4.045   3.042 -16.477
  540    HA   GLU  77           HA       GLU  77  -5.771   2.525 -14.071
  541   1HB   GLU  77          1HB       GLU  77  -6.149   0.840 -15.573
  542   2HB   GLU  77          2HB       GLU  77  -4.513   0.824 -16.191
  543   1HG   GLU  77          1HG       GLU  77  -3.693  -0.505 -14.290
  544   2HG   GLU  77          2HG       GLU  77  -5.194  -0.284 -13.398
  545    H    PHE  78           H        PHE  78  -2.364   2.687 -14.867
  546    HA   PHE  78           HA       PHE  78  -1.254   1.283 -12.527
  547   1HB   PHE  78          1HB       PHE  78   0.142   3.520 -14.115
  548   2HB   PHE  78          2HB       PHE  78  -0.019   1.898 -14.739
  549    HD1  PHE  78           HD1      PHE  78   2.679   2.885 -14.511
  550    HD2  PHE  78           HD2      PHE  78   0.286   1.127 -11.397
  551    HE1  PHE  78           HE1      PHE  78   4.719   2.212 -13.308
  552    HE2  PHE  78           HE2      PHE  78   2.336   0.446 -10.218
  553    HZ   PHE  78           HZ       PHE  78   4.552   0.985 -11.168
  554    H    LEU  79           H        LEU  79  -2.134   4.641 -13.237
  555    HA   LEU  79           HA       LEU  79  -1.084   5.806 -10.715
  556   1HB   LEU  79          1HB       LEU  79  -2.321   7.879 -11.391
  557   2HB   LEU  79          2HB       LEU  79  -3.120   7.010 -12.684
  558    HG   LEU  79           HG       LEU  79  -0.697   6.530 -13.626
  559   1HD1  LEU  79          1HD1      LEU  79  -0.010   8.956 -11.850
  560   2HD1  LEU  79          2HD1      LEU  79   0.511   7.294 -11.516
  561   3HD1  LEU  79          3HD1      LEU  79   1.076   8.120 -12.989
  562   1HD2  LEU  79          1HD2      LEU  79  -0.713   8.607 -14.940
  563   2HD2  LEU  79          2HD2      LEU  79  -2.412   8.161 -14.648
  564   3HD2  LEU  79          3HD2      LEU  79  -1.669   9.459 -13.701
  565    H    VAL  80           H        VAL  80  -4.155   4.492 -11.818
  566    HA   VAL  80           HA       VAL  80  -5.882   5.415  -9.645
  567    HB   VAL  80           HB       VAL  80  -6.429   4.173 -11.976
  568   1HG1  VAL  80          1HG1      VAL  80  -7.386   1.890 -11.595
  569   2HG1  VAL  80          2HG1      VAL  80  -5.641   1.895 -11.307
  570   3HG1  VAL  80          3HG1      VAL  80  -6.761   1.886  -9.926
  571   1HG2  VAL  80          1HG2      VAL  80  -8.309   3.995  -9.530
  572   2HG2  VAL  80          2HG2      VAL  80  -8.135   5.414 -10.589
  573   3HG2  VAL  80          3HG2      VAL  80  -8.793   3.905 -11.241
  574    H    MET  81           H        MET  81  -3.974   2.441 -10.129
  575    HA   MET  81           HA       MET  81  -4.663   1.028  -7.647
  576   1HB   MET  81          1HB       MET  81  -3.388  -0.600  -8.524
  577   2HB   MET  81          2HB       MET  81  -3.048   0.453  -9.885
  578   1HG   MET  81          1HG       MET  81  -1.298   0.562  -7.359
  579   2HG   MET  81          2HG       MET  81  -0.920   1.171  -8.979
  580   1HE   MET  81          1HE       MET  81   1.329  -0.371  -7.916
  581   2HE   MET  81          2HE       MET  81   1.632  -1.734  -9.035
  582   3HE   MET  81          3HE       MET  81   1.264  -0.112  -9.688
  583    H    MET  82           H        MET  82  -1.800   2.992  -8.508
  584    HA   MET  82           HA       MET  82  -0.497   2.934  -5.907
  585   1HB   MET  82          1HB       MET  82  -0.203   4.681  -8.366
  586   2HB   MET  82          2HB       MET  82   0.522   5.255  -6.877
  587   1HG   MET  82          1HG       MET  82   1.862   3.669  -8.618
  588   2HG   MET  82          2HG       MET  82   1.091   2.374  -7.693
  589   1HE   MET  82          1HE       MET  82   3.534   1.431  -5.803
  590   2HE   MET  82          2HE       MET  82   4.746   2.477  -6.602
  591   3HE   MET  82          3HE       MET  82   3.455   1.709  -7.572
  592    H    VAL  83           H        VAL  83  -3.101   4.899  -7.179
  593    HA   VAL  83           HA       VAL  83  -2.938   7.188  -5.354
  594    HB   VAL  83           HB       VAL  83  -4.728   6.346  -7.498
  595   1HG1  VAL  83          1HG1      VAL  83  -4.388   9.156  -6.276
  596   2HG1  VAL  83          2HG1      VAL  83  -3.225   8.443  -7.402
  597   3HG1  VAL  83          3HG1      VAL  83  -4.897   8.738  -7.932
  598   1HG2  VAL  83          1HG2      VAL  83  -6.860   7.322  -6.815
  599   2HG2  VAL  83          2HG2      VAL  83  -6.443   6.116  -5.576
  600   3HG2  VAL  83          3HG2      VAL  83  -6.209   7.837  -5.238
  601    NH1  ARG  84           NH1      ARG  84 -10.591   0.281  -5.491
  602    NH2  ARG  84           NH2      ARG  84 -10.184  -0.550  -3.416
  603    H    ARG  84           H        ARG  84  -4.734   4.118  -5.301
  604    HA   ARG  84           HA       ARG  84  -6.419   4.613  -2.933
  605   1HB   ARG  84          1HB       ARG  84  -5.556   2.071  -4.405
  606   2HB   ARG  84          2HB       ARG  84  -6.390   1.963  -2.862
  607   1HG   ARG  84          1HG       ARG  84  -7.628   3.727  -5.014
  608   2HG   ARG  84          2HG       ARG  84  -8.419   2.882  -3.681
  609   1HD   ARG  84          1HD       ARG  84  -8.731   1.907  -6.095
  610   2HD   ARG  84          2HD       ARG  84  -7.069   1.326  -5.981
  611    HE   ARG  84           HE       ARG  84  -7.787  -0.191  -4.107
  612   1HH1  ARG  84          1HH1      ARG  84 -10.218   0.739  -6.330
  613   2HH1  ARG  84          2HH1      ARG  84 -11.560  -0.018  -5.333
  614   1HH2  ARG  84          1HH2      ARG  84  -9.501  -0.724  -2.671
  615   2HH2  ARG  84          2HH2      ARG  84 -11.181  -0.794  -3.406
  616    H    GLN  85           H        GLN  85  -3.198   3.193  -3.412
  617    HA   GLN  85           HA       GLN  85  -2.849   2.224  -0.617
  618   1HB   GLN  85          1HB       GLN  85  -0.916   2.503  -2.978
  619   2HB   GLN  85          2HB       GLN  85  -0.368   2.017  -1.384
  620   1HG   GLN  85          1HG       GLN  85  -2.618   0.319  -1.932
  621   2HG   GLN  85          2HG       GLN  85  -1.757   0.426  -3.452
  622   1HE2  GLN  85          1HE2      GLN  85   0.253  -1.296  -0.222
  623   2HE2  GLN  85          2HE2      GLN  85  -0.958   0.055   0.053
  624    H    MET  86           H        MET  86  -2.073   5.136  -2.439
  625    HA   MET  86           HA       MET  86  -0.131   6.351  -0.590
  626   1HB   MET  86          1HB       MET  86   0.125   7.864  -2.227
  627   2HB   MET  86          2HB       MET  86  -1.030   6.934  -3.163
  628   1HG   MET  86          1HG       MET  86  -2.900   8.339  -2.616
  629   2HG   MET  86          2HG       MET  86  -2.060   9.108  -1.262
  630   1HE   MET  86          1HE       MET  86  -3.497  10.068  -4.390
  631   2HE   MET  86          2HE       MET  86  -2.228  10.649  -5.509
  632   3HE   MET  86          3HE       MET  86  -2.434   8.895  -5.229
  633    H    LYS  87           H        LYS  87  -3.643   6.590  -1.018
  634    HA   LYS  87           HA       LYS  87  -4.437   8.640   0.794
  635   1HB   LYS  87          1HB       LYS  87  -5.821   5.911   0.422
  636   2HB   LYS  87          2HB       LYS  87  -6.504   7.251   1.331
  637   1HG   LYS  87          1HG       LYS  87  -6.224   6.932  -1.648
  638   2HG   LYS  87          2HG       LYS  87  -5.968   8.563  -1.051
  639   1HD   LYS  87          1HD       LYS  87  -8.437   7.408  -1.679
  640   2HD   LYS  87          2HD       LYS  87  -8.382   7.162   0.062
  641   1HE   LYS  87          1HE       LYS  87  -9.325   9.282   0.151
  642   2HE   LYS  87          2HE       LYS  87  -7.652   9.835  -0.001
  643   1HZ   LYS  87          1HZ       LYS  87  -9.738   9.723  -2.076
  644   2HZ   LYS  87          2HZ       LYS  87  -8.155   9.631  -2.542
  645   3HZ   LYS  87          3HZ       LYS  87  -8.694  10.948  -1.702
  646    H    GLU  88           H        GLU  88  -4.822   8.777   2.973
  647    HA   GLU  88           HA       GLU  88  -3.312   6.788   4.747
  648   1HB   GLU  88          1HB       GLU  88  -3.940   9.677   5.518
  649   2HB   GLU  88          2HB       GLU  88  -2.854   8.559   6.320
  650   1HG   GLU  88          1HG       GLU  88  -1.137   9.455   5.123
  651   2HG   GLU  88          2HG       GLU  88  -1.805   8.735   3.668
  652    H    ASP  89           H        ASP  89  -5.269   5.493   4.589
  653    HA   ASP  89           HA       ASP  89  -7.875   6.180   5.703
  654   1HB   ASP  89          1HB       ASP  89  -8.309   3.790   5.971
  655   2HB   ASP  89          2HB       ASP  89  -6.608   3.397   5.892
  656    H    ALA  90           H        ALA  90  -8.286   6.923   7.619
  657    HA   ALA  90           HA       ALA  90  -8.379   7.186  10.017
  658   1HB   ALA  90          1HB       ALA  90  -7.464   5.348  11.458
  659   2HB   ALA  90          2HB       ALA  90  -8.438   4.681  10.133
  660   3HB   ALA  90          3HB       ALA  90  -6.661   4.605  10.052
   
  Start of MODEL           4
 Raw file had  660 H/Q atoms
  Start of MODEL    4
    1   1H    ALA   1          1H        ALA   1 -18.113   0.292 -20.547
    2   2H    ALA   1          2H        ALA   1 -18.203   1.868 -19.967
    3   3H    ALA   1          3H        ALA   1 -18.455   1.558 -21.600
    4    HA   ALA   1           HA       ALA   1 -15.991   1.679 -20.050
    5   1HB   ALA   1          1HB       ALA   1 -15.532  -0.503 -20.718
    6   2HB   ALA   1          2HB       ALA   1 -14.989   0.326 -22.190
    7   3HB   ALA   1          3HB       ALA   1 -16.596  -0.445 -22.144
    8    H    SER   2           H        SER   2 -16.418   3.906 -20.470
    9    HA   SER   2           HA       SER   2 -15.481   4.853 -23.202
   10   1HB   SER   2          1HB       SER   2 -17.922   6.258 -22.052
   11   2HB   SER   2          2HB       SER   2 -17.297   6.258 -23.703
   12    HG   SER   2           HG       SER   2 -18.853   4.859 -23.862
   13    H    MET   3           H        MET   3 -16.857   6.158 -20.158
   14    HA   MET   3           HA       MET   3 -14.876   8.399 -19.970
   15   1HB   MET   3          1HB       MET   3 -16.865   7.493 -17.817
   16   2HB   MET   3          2HB       MET   3 -16.038   9.036 -17.910
   17   1HG   MET   3          1HG       MET   3 -17.993   8.105 -20.103
   18   2HG   MET   3          2HG       MET   3 -18.518   8.975 -18.655
   19   1HE   MET   3          1HE       MET   3 -15.881  10.409 -22.136
   20   2HE   MET   3          2HE       MET   3 -17.604  10.060 -22.466
   21   3HE   MET   3          3HE       MET   3 -16.550   8.781 -21.797
   22    H    THR   4           H        THR   4 -14.339   8.418 -17.257
   23    HA   THR   4           HA       THR   4 -12.962   5.845 -16.499
   24    HB   THR   4           HB       THR   4 -11.424   8.333 -17.240
   25    HG1  THR   4           HG1      THR   4 -11.620   6.882 -18.793
   26   1HG2  THR   4          1HG2      THR   4 -10.660   6.551 -14.995
   27   2HG2  THR   4          2HG2      THR   4  -9.902   8.060 -15.552
   28   3HG2  THR   4          3HG2      THR   4  -9.467   6.507 -16.311
   29    H    ASP   5           H        ASP   5 -14.935   6.366 -15.087
   30    HA   ASP   5           HA       ASP   5 -14.497   8.335 -12.847
   31   1HB   ASP   5          1HB       ASP   5 -16.782   8.112 -13.733
   32   2HB   ASP   5          2HB       ASP   5 -16.710   7.720 -12.029
   33    H    GLN   6           H        GLN   6 -12.715   5.934 -13.288
   34    HA   GLN   6           HA       GLN   6 -13.298   4.045 -10.995
   35   1HB   GLN   6          1HB       GLN   6 -10.686   3.594 -12.224
   36   2HB   GLN   6          2HB       GLN   6 -11.871   3.853 -13.490
   37   1HG   GLN   6          1HG       GLN   6 -12.759   1.963 -11.317
   38   2HG   GLN   6          2HG       GLN   6 -13.038   1.889 -13.042
   39   1HE2  GLN   6          1HE2      GLN   6  -9.367   0.609 -13.271
   40   2HE2  GLN   6          2HE2      GLN   6 -10.015   2.310 -13.501
   41    H    GLN   7           H        GLN   7 -10.497   6.004 -12.067
   42    HA   GLN   7           HA       GLN   7  -9.509   6.207  -9.167
   43   1HB   GLN   7          1HB       GLN   7  -7.665   7.066 -11.388
   44   2HB   GLN   7          2HB       GLN   7  -7.345   6.204  -9.890
   45   1HG   GLN   7          1HG       GLN   7  -8.393   4.993 -12.508
   46   2HG   GLN   7          2HG       GLN   7  -6.837   4.697 -11.748
   47   1HE2  GLN   7          1HE2      GLN   7  -8.874   1.737 -10.783
   48   2HE2  GLN   7          2HE2      GLN   7  -7.958   2.438 -12.209
   49    H    ALA   8           H        ALA   8 -11.573   7.900 -10.669
   50    HA   ALA   8           HA       ALA   8 -10.621  10.555 -11.285
   51   1HB   ALA   8          1HB       ALA   8 -12.950  11.320 -10.852
   52   2HB   ALA   8          2HB       ALA   8 -12.927   9.818 -11.795
   53   3HB   ALA   8          3HB       ALA   8 -13.345   9.774 -10.063
   54    H    GLU   9           H        GLU   9 -11.285   8.972  -8.210
   55    HA   GLU   9           HA       GLU   9 -11.104  11.414  -6.508
   56   1HB   GLU   9          1HB       GLU   9 -11.571  10.084  -4.640
   57   2HB   GLU   9          2HB       GLU   9 -12.435   9.272  -5.938
   58   1HG   GLU   9          1HG       GLU   9  -9.631   8.304  -5.127
   59   2HG   GLU   9          2HG       GLU   9 -10.846   7.441  -6.063
   60    H    ALA  10           H        ALA  10  -8.931   8.883  -7.613
   61    HA   ALA  10           HA       ALA  10  -6.731   9.318  -5.709
   62   1HB   ALA  10          1HB       ALA  10  -5.386   7.900  -7.250
   63   2HB   ALA  10          2HB       ALA  10  -6.980   7.186  -6.941
   64   3HB   ALA  10          3HB       ALA  10  -6.655   7.995  -8.495
   65    NH1  ARG  11           NH1      ARG  11  -6.828  11.821 -15.952
   66    NH2  ARG  11           NH2      ARG  11  -7.133   9.788 -14.988
   67    H    ARG  11           H        ARG  11  -7.492  10.560  -8.938
   68    HA   ARG  11           HA       ARG  11  -4.904  11.957  -9.439
   69   1HB   ARG  11          1HB       ARG  11  -6.807  11.129 -11.156
   70   2HB   ARG  11          2HB       ARG  11  -7.487  12.721 -10.853
   71   1HG   ARG  11          1HG       ARG  11  -5.279  13.796 -11.514
   72   2HG   ARG  11          2HG       ARG  11  -4.650  12.201 -11.933
   73   1HD   ARG  11          1HD       ARG  11  -6.901  13.767 -13.300
   74   2HD   ARG  11          2HD       ARG  11  -5.435  13.108 -14.030
   75    HE   ARG  11           HE       ARG  11  -7.542  11.180 -12.938
   76   1HH1  ARG  11          1HH1      ARG  11  -7.255   9.247 -14.124
   77   2HH1  ARG  11          2HH1      ARG  11  -7.139   9.424 -15.947
   78   1HH2  ARG  11          1HH2      ARG  11  -6.638  12.821 -15.823
   79   2HH2  ARG  11          2HH2      ARG  11  -6.933  11.326 -16.844
   80    H    ALA  12           H        ALA  12  -8.076  12.794  -8.134
   81    HA   ALA  12           HA       ALA  12  -7.623  15.711  -7.812
   82   1HB   ALA  12          1HB       ALA  12  -9.660  15.667  -6.387
   83   2HB   ALA  12          2HB       ALA  12  -9.918  14.785  -7.906
   84   3HB   ALA  12          3HB       ALA  12  -9.662  13.886  -6.389
   85    H    PHE  13           H        PHE  13  -6.974  12.815  -5.917
   86    HA   PHE  13           HA       PHE  13  -6.499  13.975  -3.303
   87   1HB   PHE  13          1HB       PHE  13  -5.185  11.457  -4.475
   88   2HB   PHE  13          2HB       PHE  13  -6.812  11.510  -3.847
   89    HD1  PHE  13           HD1      PHE  13  -6.632  10.085  -1.906
   90    HD2  PHE  13           HD2      PHE  13  -3.751  13.244  -2.412
   91    HE1  PHE  13           HE1      PHE  13  -5.736   9.645   0.344
   92    HE2  PHE  13           HE2      PHE  13  -2.867  12.784  -0.163
   93    HZ   PHE  13           HZ       PHE  13  -3.857  10.991   1.220
   94    H    LEU  14           H        LEU  14  -4.190  13.076  -5.888
   95    HA   LEU  14           HA       LEU  14  -2.027  14.857  -4.624
   96   1HB   LEU  14          1HB       LEU  14  -0.597  13.263  -6.346
   97   2HB   LEU  14          2HB       LEU  14  -0.781  12.975  -4.629
   98    HG   LEU  14           HG       LEU  14  -2.815  11.460  -5.191
   99   1HD1  LEU  14          1HD1      LEU  14  -2.962  10.555  -7.513
  100   2HD1  LEU  14          2HD1      LEU  14  -3.272  12.301  -7.500
  101   3HD1  LEU  14          3HD1      LEU  14  -1.698  11.685  -8.062
  102   1HD2  LEU  14          1HD2      LEU  14  -0.039  10.588  -6.245
  103   2HD2  LEU  14          2HD2      LEU  14  -0.610  10.459  -4.563
  104   3HD2  LEU  14          3HD2      LEU  14  -1.384   9.494  -5.829
  105    H    SER  15           H        SER  15  -1.235  16.453  -5.797
  106    HA   SER  15           HA       SER  15  -2.665  17.417  -8.198
  107   1HB   SER  15          1HB       SER  15  -0.041  18.680  -7.370
  108   2HB   SER  15          2HB       SER  15  -1.545  19.432  -7.908
  109    HG   SER  15           HG       SER  15  -0.950  19.500  -5.602
  110    H    GLU  16           H        GLU  16  -0.637  18.545  -9.719
  111    HA   GLU  16           HA       GLU  16   0.169  16.263 -11.460
  112   1HB   GLU  16          1HB       GLU  16  -0.698  18.329 -12.458
  113   2HB   GLU  16          2HB       GLU  16   0.604  19.281 -11.772
  114   1HG   GLU  16          1HG       GLU  16   0.745  17.234 -14.055
  115   2HG   GLU  16          2HG       GLU  16   2.206  17.670 -13.185
  116    H    GLU  17           H        GLU  17   1.690  18.516  -9.240
  117    HA   GLU  17           HA       GLU  17   4.506  18.099  -9.995
  118   1HB   GLU  17          1HB       GLU  17   3.290  19.142  -7.395
  119   2HB   GLU  17          2HB       GLU  17   5.020  18.934  -7.583
  120   1HG   GLU  17          1HG       GLU  17   4.839  20.488  -9.689
  121   2HG   GLU  17          2HG       GLU  17   3.187  20.815  -9.193
  122    H    MET  18           H        MET  18   2.273  16.468  -7.808
  123    HA   MET  18           HA       MET  18   4.343  14.670  -6.564
  124   1HB   MET  18          1HB       MET  18   2.585  13.742  -5.206
  125   2HB   MET  18          2HB       MET  18   1.322  14.303  -6.287
  126   1HG   MET  18          1HG       MET  18   1.080  15.929  -4.653
  127   2HG   MET  18          2HG       MET  18   2.317  16.757  -5.615
  128   1HE   MET  18          1HE       MET  18   4.453  17.653  -4.643
  129   2HE   MET  18          2HE       MET  18   5.509  16.696  -3.562
  130   3HE   MET  18          3HE       MET  18   5.084  16.064  -5.180
  131    H    ILE  19           H        ILE  19   1.847  14.578  -9.052
  132    HA   ILE  19           HA       ILE  19   1.750  11.727  -9.611
  133    HB   ILE  19           HB       ILE  19   0.978  14.188 -11.152
  134   1HG1  ILE  19          1HG1      ILE  19  -0.457  12.555  -9.507
  135   2HG1  ILE  19          2HG1      ILE  19  -0.679  11.633 -10.979
  136   1HG2  ILE  19          1HG2      ILE  19   0.442  12.924 -13.250
  137   2HG2  ILE  19          2HG2      ILE  19   2.179  12.900 -12.953
  138   3HG2  ILE  19          3HG2      ILE  19   1.206  11.457 -12.589
  139   1HD1  ILE  19          1HD1      ILE  19  -1.758  13.533 -12.151
  140   2HD1  ILE  19          2HD1      ILE  19  -2.565  13.214 -10.602
  141   3HD1  ILE  19          3HD1      ILE  19  -1.458  14.599 -10.751
  142    H    ALA  20           H        ALA  20   3.968  14.300 -10.576
  143    HA   ALA  20           HA       ALA  20   5.477  13.027 -12.676
  144   1HB   ALA  20          1HB       ALA  20   7.292  14.648 -12.136
  145   2HB   ALA  20          2HB       ALA  20   5.701  15.434 -12.147
  146   3HB   ALA  20          3HB       ALA  20   6.501  15.066 -10.598
  147    H    GLU  21           H        GLU  21   5.745  12.786  -9.158
  148    HA   GLU  21           HA       GLU  21   8.337  11.494  -8.904
  149   1HB   GLU  21          1HB       GLU  21   6.885  12.547  -7.051
  150   2HB   GLU  21          2HB       GLU  21   5.986  11.044  -6.994
  151   1HG   GLU  21          1HG       GLU  21   8.398   9.919  -6.619
  152   2HG   GLU  21          2HG       GLU  21   7.525  10.657  -5.288
  153    H    PHE  22           H        PHE  22   5.098  10.276  -9.560
  154    HA   PHE  22           HA       PHE  22   5.859   7.372  -9.368
  155   1HB   PHE  22          1HB       PHE  22   3.178   8.490 -10.374
  156   2HB   PHE  22          2HB       PHE  22   3.520   6.875  -9.815
  157    HD1  PHE  22           HD1      PHE  22   2.274  10.066  -8.776
  158    HD2  PHE  22           HD2      PHE  22   4.401   6.630  -7.293
  159    HE1  PHE  22           HE1      PHE  22   1.769  10.738  -6.466
  160    HE2  PHE  22           HE2      PHE  22   3.880   7.318  -4.988
  161    HZ   PHE  22           HZ       PHE  22   2.582   9.378  -4.568
  162    H    LYS  23           H        LYS  23   5.475   9.849 -11.808
  163    HA   LYS  23           HA       LYS  23   5.108   8.303 -14.242
  164   1HB   LYS  23          1HB       LYS  23   6.289  11.043 -13.661
  165   2HB   LYS  23          2HB       LYS  23   6.637  10.332 -15.222
  166   1HG   LYS  23          1HG       LYS  23   3.743  10.554 -14.228
  167   2HG   LYS  23          2HG       LYS  23   4.317  10.278 -15.864
  168   1HD   LYS  23          1HD       LYS  23   4.394  12.893 -14.270
  169   2HD   LYS  23          2HD       LYS  23   3.605  12.579 -15.820
  170   1HE   LYS  23          1HE       LYS  23   6.660  12.325 -15.596
  171   2HE   LYS  23          2HE       LYS  23   5.916  13.920 -15.784
  172   1HZ   LYS  23          1HZ       LYS  23   5.169  13.394 -17.890
  173   2HZ   LYS  23          2HZ       LYS  23   5.115  11.763 -17.632
  174   3HZ   LYS  23          3HZ       LYS  23   6.568  12.516 -17.860
  175    H    ALA  24           H        ALA  24   8.135   9.495 -12.743
  176    HA   ALA  24           HA       ALA  24  10.040   8.423 -14.628
  177   1HB   ALA  24          1HB       ALA  24  11.737   8.679 -12.826
  178   2HB   ALA  24          2HB       ALA  24  10.667  10.091 -12.906
  179   3HB   ALA  24          3HB       ALA  24  10.457   8.889 -11.607
  180    H    ALA  25           H        ALA  25   8.916   7.027 -11.528
  181    HA   ALA  25           HA       ALA  25  10.463   4.523 -11.691
  182   1HB   ALA  25          1HB       ALA  25   9.107   3.803  -9.735
  183   2HB   ALA  25          2HB       ALA  25   9.712   5.457  -9.521
  184   3HB   ALA  25          3HB       ALA  25   8.004   5.184  -9.949
  185    H    PHE  26           H        PHE  26   7.401   5.566 -12.977
  186    HA   PHE  26           HA       PHE  26   5.982   2.992 -13.168
  187   1HB   PHE  26          1HB       PHE  26   4.629   4.962 -13.360
  188   2HB   PHE  26          2HB       PHE  26   5.592   5.649 -14.641
  189    HD1  PHE  26           HD1      PHE  26   2.733   3.554 -13.833
  190    HD2  PHE  26           HD2      PHE  26   5.551   4.381 -16.977
  191    HE1  PHE  26           HE1      PHE  26   1.188   2.586 -15.486
  192    HE2  PHE  26           HE2      PHE  26   4.002   3.387 -18.613
  193    HZ   PHE  26           HZ       PHE  26   1.826   2.482 -17.872
  194    H    ASP  27           H        ASP  27   8.206   4.766 -15.281
  195    HA   ASP  27           HA       ASP  27   8.139   2.950 -17.589
  196   1HB   ASP  27          1HB       ASP  27  10.579   4.001 -17.967
  197   2HB   ASP  27          2HB       ASP  27  10.090   5.107 -16.704
  198    H    MET  28           H        MET  28   9.988   3.054 -14.590
  199    HA   MET  28           HA       MET  28  12.036   1.018 -15.212
  200   1HB   MET  28          1HB       MET  28  11.994   2.689 -13.182
  201   2HB   MET  28          2HB       MET  28  10.972   1.504 -12.389
  202   1HG   MET  28          1HG       MET  28  12.878  -0.251 -12.871
  203   2HG   MET  28          2HG       MET  28  13.892   1.148 -13.261
  204   1HE   MET  28          1HE       MET  28  11.587   2.863 -11.048
  205   2HE   MET  28          2HE       MET  28  12.745   3.155  -9.716
  206   3HE   MET  28          3HE       MET  28  13.220   3.510 -11.403
  207    H    PHE  29           H        PHE  29   8.723   0.948 -14.004
  208    HA   PHE  29           HA       PHE  29   8.665  -1.925 -13.228
  209   1HB   PHE  29          1HB       PHE  29   6.119  -0.380 -13.887
  210   2HB   PHE  29          2HB       PHE  29   7.064   0.122 -12.511
  211    HD1  PHE  29           HD1      PHE  29   5.520  -0.498 -10.754
  212    HD2  PHE  29           HD2      PHE  29   6.712  -3.474 -13.627
  213    HE1  PHE  29           HE1      PHE  29   4.395  -2.243  -9.432
  214    HE2  PHE  29           HE2      PHE  29   5.588  -5.203 -12.285
  215    HZ   PHE  29           HZ       PHE  29   4.422  -4.593 -10.196
  216    H    ASP  30           H        ASP  30   7.908   0.005 -16.082
  217    HA   ASP  30           HA       ASP  30   6.651  -2.149 -17.678
  218   1HB   ASP  30          1HB       ASP  30   6.617   0.547 -17.983
  219   2HB   ASP  30          2HB       ASP  30   7.936   0.208 -19.079
  220    H    ALA  31           H        ALA  31   8.084  -1.812 -20.120
  221    HA   ALA  31           HA       ALA  31  10.895  -2.814 -19.715
  222   1HB   ALA  31          1HB       ALA  31  10.527  -5.043 -20.780
  223   2HB   ALA  31          2HB       ALA  31   9.626  -4.884 -19.259
  224   3HB   ALA  31          3HB       ALA  31   8.769  -4.767 -20.818
  225    H    ASP  32           H        ASP  32   8.135  -2.423 -21.917
  226    HA   ASP  32           HA       ASP  32   9.805  -2.340 -24.405
  227   1HB   ASP  32          1HB       ASP  32   7.491  -1.448 -25.425
  228   2HB   ASP  32          2HB       ASP  32   7.808  -3.141 -25.122
  229    H    GLY  33           H        GLY  33   7.413   0.080 -23.320
  230   1HA   GLY  33          1HA       GLY  33   9.480   2.335 -23.493
  231   2HA   GLY  33          2HA       GLY  33   8.079   2.406 -24.538
  232    H    GLY  34           H        GLY  34   6.198   3.191 -23.731
  233   1HA   GLY  34          1HA       GLY  34   5.976   4.948 -21.488
  234   2HA   GLY  34          2HA       GLY  34   5.574   3.365 -20.811
  235    H    GLY  35           H        GLY  35   3.455   3.603 -20.468
  236   1HA   GLY  35          1HA       GLY  35   1.569   3.549 -22.856
  237   2HA   GLY  35          2HA       GLY  35   1.339   4.890 -21.726
  238    H    ASP  36           H        ASP  36   2.131   1.439 -21.275
  239    HA   ASP  36           HA       ASP  36   0.358   1.108 -18.904
  240   1HB   ASP  36          1HB       ASP  36  -1.142  -0.670 -20.044
  241   2HB   ASP  36          2HB       ASP  36  -1.536   1.020 -20.250
  242    H    ILE  37           H        ILE  37   0.513  -1.005 -18.021
  243    HA   ILE  37           HA       ILE  37   3.066  -2.487 -18.815
  244    HB   ILE  37           HB       ILE  37   2.011  -3.307 -16.218
  245   1HG1  ILE  37          1HG1      ILE  37   2.112  -0.354 -16.615
  246   2HG1  ILE  37          2HG1      ILE  37   1.353  -1.302 -15.351
  247   1HG2  ILE  37          1HG2      ILE  37   4.368  -3.099 -15.531
  248   2HG2  ILE  37          2HG2      ILE  37   4.274  -3.873 -17.119
  249   3HG2  ILE  37          3HG2      ILE  37   4.761  -2.166 -16.995
  250   1HD1  ILE  37          1HD1      ILE  37   4.328  -0.512 -15.387
  251   2HD1  ILE  37          2HD1      ILE  37   3.049   0.122 -14.329
  252   3HD1  ILE  37          3HD1      ILE  37   3.573  -1.569 -14.163
  253    H    SER  38           H        SER  38   2.616  -4.854 -17.465
  254    HA   SER  38           HA       SER  38  -0.022  -6.057 -18.288
  255   1HB   SER  38          1HB       SER  38   1.596  -6.019 -20.366
  256   2HB   SER  38          2HB       SER  38   0.646  -7.464 -20.011
  257    HG   SER  38           HG       SER  38   2.397  -8.500 -19.688
  258    H    THR  39           H        THR  39   0.765  -8.715 -18.205
  259    HA   THR  39           HA       THR  39   1.220  -9.140 -15.261
  260    HB   THR  39           HB       THR  39   1.023 -11.701 -16.311
  261    HG1  THR  39           HG1      THR  39   0.303 -11.486 -18.207
  262   1HG2  THR  39          1HG2      THR  39  -1.296 -11.746 -15.504
  263   2HG2  THR  39          2HG2      THR  39  -0.315 -10.801 -14.361
  264   3HG2  THR  39          3HG2      THR  39  -1.398  -9.970 -15.509
  265    H    LYS  40           H        LYS  40   2.598 -10.568 -18.255
  266    HA   LYS  40           HA       LYS  40   4.932 -11.785 -17.118
  267   1HB   LYS  40          1HB       LYS  40   4.251 -12.374 -19.327
  268   2HB   LYS  40          2HB       LYS  40   4.378 -10.752 -19.957
  269   1HG   LYS  40          1HG       LYS  40   7.000 -11.521 -18.945
  270   2HG   LYS  40          2HG       LYS  40   6.529 -11.207 -20.594
  271   1HD   LYS  40          1HD       LYS  40   7.394 -13.384 -20.815
  272   2HD   LYS  40          2HD       LYS  40   6.967 -13.791 -19.179
  273   1HE   LYS  40          1HE       LYS  40   5.599 -15.231 -20.400
  274   2HE   LYS  40          2HE       LYS  40   4.481 -13.970 -19.896
  275   1HZ   LYS  40          1HZ       LYS  40   5.543 -14.556 -22.578
  276   2HZ   LYS  40          2HZ       LYS  40   5.130 -12.991 -22.249
  277   3HZ   LYS  40          3HZ       LYS  40   3.999 -14.188 -22.120
  278    H    GLU  41           H        GLU  41   4.383  -8.489 -18.318
  279    HA   GLU  41           HA       GLU  41   7.155  -7.515 -18.177
  280   1HB   GLU  41          1HB       GLU  41   6.309  -5.290 -18.550
  281   2HB   GLU  41          2HB       GLU  41   4.693  -5.726 -18.036
  282   1HG   GLU  41          1HG       GLU  41   6.089  -6.585 -20.640
  283   2HG   GLU  41          2HG       GLU  41   4.609  -7.336 -20.083
  284    H    LEU  42           H        LEU  42   4.392  -7.418 -15.951
  285    HA   LEU  42           HA       LEU  42   5.484  -5.615 -13.929
  286   1HB   LEU  42          1HB       LEU  42   3.170  -7.492 -14.109
  287   2HB   LEU  42          2HB       LEU  42   3.242  -5.842 -13.530
  288    HG   LEU  42           HG       LEU  42   4.609  -7.246 -11.493
  289   1HD1  LEU  42          1HD1      LEU  42   2.167  -8.958 -12.274
  290   2HD1  LEU  42          2HD1      LEU  42   3.842  -9.430 -12.598
  291   3HD1  LEU  42          3HD1      LEU  42   3.289  -9.233 -10.916
  292   1HD2  LEU  42          1HD2      LEU  42   2.643  -6.748 -10.082
  293   2HD2  LEU  42          2HD2      LEU  42   2.856  -5.400 -11.227
  294   3HD2  LEU  42          3HD2      LEU  42   1.588  -6.606 -11.511
  295    H    GLY  43           H        GLY  43   5.534  -9.159 -14.256
  296   1HA   GLY  43          1HA       GLY  43   6.708  -9.921 -11.715
  297   2HA   GLY  43          2HA       GLY  43   6.847 -10.876 -13.195
  298    H    THR  44           H        THR  44   8.145  -8.727 -14.702
  299    HA   THR  44           HA       THR  44  10.873  -9.568 -14.475
  300    HB   THR  44           HB       THR  44   9.645  -7.137 -15.813
  301    HG1  THR  44           HG1      THR  44  11.181  -9.260 -16.850
  302   1HG2  THR  44          1HG2      THR  44  11.836  -6.608 -16.895
  303   2HG2  THR  44          2HG2      THR  44  11.890  -6.289 -15.149
  304   3HG2  THR  44          3HG2      THR  44  12.664  -7.752 -15.809
  305    H    VAL  45           H        VAL  45   9.523  -6.423 -13.429
  306    HA   VAL  45           HA       VAL  45  11.948  -5.429 -12.125
  307    HB   VAL  45           HB       VAL  45   9.224  -4.447 -12.502
  308   1HG1  VAL  45          1HG1      VAL  45   9.020  -2.989 -10.487
  309   2HG1  VAL  45          2HG1      VAL  45   8.950  -4.693 -10.022
  310   3HG1  VAL  45          3HG1      VAL  45  10.443  -3.768  -9.745
  311   1HG2  VAL  45          1HG2      VAL  45  11.841  -2.936 -11.852
  312   2HG2  VAL  45          2HG2      VAL  45  11.235  -3.310 -13.481
  313   3HG2  VAL  45          3HG2      VAL  45  10.327  -2.202 -12.443
  314    H    MET  46           H        MET  46   9.134  -7.269 -11.010
  315    HA   MET  46           HA       MET  46   9.386  -7.132  -8.154
  316   1HB   MET  46          1HB       MET  46   8.358  -9.412  -9.924
  317   2HB   MET  46          2HB       MET  46   8.420  -9.567  -8.178
  318   1HG   MET  46          1HG       MET  46   6.610  -7.801  -9.859
  319   2HG   MET  46          2HG       MET  46   7.065  -7.201  -8.255
  320   1HE   MET  46          1HE       MET  46   4.061  -7.579  -8.589
  321   2HE   MET  46          2HE       MET  46   3.603  -8.631  -7.217
  322   3HE   MET  46          3HE       MET  46   4.785  -7.313  -6.972
  323    NH1  ARG  47           NH1      ARG  47  13.986 -14.631 -12.404
  324    NH2  ARG  47           NH2      ARG  47  13.311 -14.056 -14.496
  325    H    ARG  47           H        ARG  47  11.148  -9.058 -10.524
  326    HA   ARG  47           HA       ARG  47  12.515 -11.015  -8.948
  327   1HB   ARG  47          1HB       ARG  47  14.130  -9.600 -11.093
  328   2HB   ARG  47          2HB       ARG  47  12.626 -10.377 -11.568
  329   1HG   ARG  47          1HG       ARG  47  14.677 -11.943  -9.916
  330   2HG   ARG  47          2HG       ARG  47  13.356 -12.567 -10.904
  331   1HD   ARG  47          1HD       ARG  47  15.558 -10.942 -12.292
  332   2HD   ARG  47          2HD       ARG  47  15.901 -12.592 -11.798
  333    HE   ARG  47           HE       ARG  47  14.234 -11.880 -14.093
  334   1HH1  ARG  47          1HH1      ARG  47  14.449 -14.344 -11.534
  335   2HH1  ARG  47          2HH1      ARG  47  13.581 -15.551 -12.609
  336   1HH2  ARG  47          1HH2      ARG  47  13.257 -13.334 -15.223
  337   2HH2  ARG  47          2HH2      ARG  47  12.954 -15.016 -14.555
  338    H    MET  48           H        MET  48  14.117  -8.016 -10.026
  339    HA   MET  48           HA       MET  48  16.393  -8.115  -8.256
  340   1HB   MET  48          1HB       MET  48  15.278  -5.389  -9.035
  341   2HB   MET  48          2HB       MET  48  16.941  -5.918  -8.843
  342   1HG   MET  48          1HG       MET  48  16.981  -5.901 -11.128
  343   2HG   MET  48          2HG       MET  48  16.250  -7.508 -10.995
  344   1HE   MET  48          1HE       MET  48  15.620  -3.619 -11.628
  345   2HE   MET  48          2HE       MET  48  13.835  -3.542 -11.685
  346   3HE   MET  48          3HE       MET  48  14.663  -3.886 -10.139
  347    H    LEU  49           H        LEU  49  13.128  -6.881  -7.769
  348    HA   LEU  49           HA       LEU  49  13.318  -5.294  -5.408
  349   1HB   LEU  49          1HB       LEU  49  11.058  -7.332  -5.614
  350   2HB   LEU  49          2HB       LEU  49  11.200  -6.105  -6.853
  351    HG   LEU  49           HG       LEU  49  11.074  -5.335  -3.882
  352   1HD1  LEU  49          1HD1      LEU  49  10.268  -3.143  -4.765
  353   2HD1  LEU  49          2HD1      LEU  49  11.854  -3.548  -5.448
  354   3HD1  LEU  49          3HD1      LEU  49  10.387  -3.743  -6.439
  355   1HD2  LEU  49          1HD2      LEU  49   8.657  -5.697  -5.779
  356   2HD2  LEU  49          2HD2      LEU  49   9.009  -6.673  -4.332
  357   3HD2  LEU  49          3HD2      LEU  49   8.603  -4.960  -4.158
  358    H    GLY  50           H        GLY  50  12.518  -8.785  -5.404
  359   1HA   GLY  50          1HA       GLY  50  14.591  -9.838  -3.756
  360   2HA   GLY  50          2HA       GLY  50  13.437  -9.198  -2.578
  361    H    GLN  51           H        GLN  51  11.104  -9.683  -4.260
  362    HA   GLN  51           HA       GLN  51  10.543 -12.576  -3.612
  363   1HB   GLN  51          1HB       GLN  51   8.616 -10.762  -5.129
  364   2HB   GLN  51          2HB       GLN  51   8.918 -10.483  -3.425
  365   1HG   GLN  51          1HG       GLN  51   7.929 -13.163  -4.574
  366   2HG   GLN  51          2HG       GLN  51   6.874 -11.916  -3.945
  367   1HE2  GLN  51          1HE2      GLN  51   7.231 -14.120  -1.023
  368   2HE2  GLN  51          2HE2      GLN  51   6.352 -13.983  -2.628
  369    H    ASN  52           H        ASN  52   9.522 -13.919  -5.335
  370    HA   ASN  52           HA       ASN  52  10.208 -13.319  -8.184
  371   1HB   ASN  52          1HB       ASN  52  11.391 -15.913  -7.082
  372   2HB   ASN  52          2HB       ASN  52  12.291 -14.418  -6.949
  373   1HD2  ASN  52          1HD2      ASN  52  13.482 -15.861 -10.139
  374   2HD2  ASN  52          2HD2      ASN  52  13.784 -15.761  -8.332
  375    HA   PRO  53           HA       PRO  53   6.316 -15.941  -7.577
  376   1HB   PRO  53          1HB       PRO  53   4.964 -14.035  -7.806
  377   2HB   PRO  53          2HB       PRO  53   4.716 -14.699  -9.428
  378   1HG   PRO  53          1HG       PRO  53   6.266 -13.280 -10.479
  379   2HG   PRO  53          2HG       PRO  53   5.717 -12.178  -9.196
  380   1HD   PRO  53          1HD       PRO  53   7.750 -12.472  -7.954
  381   2HD   PRO  53          2HD       PRO  53   8.402 -12.956  -9.548
  382    H    THR  54           H        THR  54   4.825 -17.009  -9.358
  383    HA   THR  54           HA       THR  54   6.619 -18.308 -11.461
  384    HB   THR  54           HB       THR  54   5.035 -19.522  -9.487
  385    HG1  THR  54           HG1      THR  54   6.592 -20.687 -10.171
  386   1HG2  THR  54          1HG2      THR  54   3.406 -20.947 -10.684
  387   2HG2  THR  54          2HG2      THR  54   2.937 -19.238 -10.839
  388   3HG2  THR  54          3HG2      THR  54   3.704 -20.081 -12.210
  389    H    LYS  55           H        LYS  55   5.195 -19.209 -13.330
  390    HA   LYS  55           HA       LYS  55   4.410 -16.930 -14.954
  391   1HB   LYS  55          1HB       LYS  55   4.818 -19.756 -15.377
  392   2HB   LYS  55          2HB       LYS  55   3.207 -19.419 -15.975
  393   1HG   LYS  55          1HG       LYS  55   3.952 -18.353 -17.821
  394   2HG   LYS  55          2HG       LYS  55   5.120 -17.378 -16.947
  395   1HD   LYS  55          1HD       LYS  55   6.394 -18.756 -18.512
  396   2HD   LYS  55          2HD       LYS  55   5.467 -20.194 -18.113
  397   1HE   LYS  55          1HE       LYS  55   7.202 -18.871 -15.972
  398   2HE   LYS  55          2HE       LYS  55   6.599 -20.526 -16.002
  399   1HZ   LYS  55          1HZ       LYS  55   8.358 -21.166 -17.245
  400   2HZ   LYS  55          2HZ       LYS  55   9.062 -19.735 -16.813
  401   3HZ   LYS  55          3HZ       LYS  55   8.290 -19.870 -18.267
  402    H    GLU  56           H        GLU  56   2.386 -19.596 -13.677
  403    HA   GLU  56           HA       GLU  56  -0.185 -18.315 -14.378
  404   1HB   GLU  56          1HB       GLU  56   0.545 -20.801 -12.777
  405   2HB   GLU  56          2HB       GLU  56  -1.105 -20.211 -12.778
  406   1HG   GLU  56          1HG       GLU  56   0.180 -20.540 -15.509
  407   2HG   GLU  56          2HG       GLU  56  -1.482 -20.817 -15.017
  408    H    GLU  57           H        GLU  57   1.848 -18.527 -11.507
  409    HA   GLU  57           HA       GLU  57  -0.001 -17.657  -9.443
  410   1HB   GLU  57          1HB       GLU  57   2.287 -16.679  -8.396
  411   2HB   GLU  57          2HB       GLU  57   3.003 -17.672  -9.647
  412   1HG   GLU  57          1HG       GLU  57   1.122 -19.438  -8.421
  413   2HG   GLU  57          2HG       GLU  57   2.871 -19.461  -8.234
  414    H    LEU  58           H        LEU  58   1.899 -15.881 -11.817
  415    HA   LEU  58           HA       LEU  58   1.771 -13.199 -10.688
  416   1HB   LEU  58          1HB       LEU  58   2.496 -14.424 -13.320
  417   2HB   LEU  58          2HB       LEU  58   1.891 -12.785 -13.446
  418    HG   LEU  58           HG       LEU  58   4.368 -13.801 -11.947
  419   1HD1  LEU  58          1HD1      LEU  58   3.292 -10.917 -11.670
  420   2HD1  LEU  58          2HD1      LEU  58   3.114 -12.145 -10.409
  421   3HD1  LEU  58          3HD1      LEU  58   4.740 -11.606 -10.893
  422   1HD2  LEU  58          1HD2      LEU  58   5.576 -12.202 -13.386
  423   2HD2  LEU  58          2HD2      LEU  58   4.513 -13.195 -14.414
  424   3HD2  LEU  58          3HD2      LEU  58   4.047 -11.532 -14.010
  425    H    ASP  59           H        ASP  59  -0.377 -15.062 -12.790
  426    HA   ASP  59           HA       ASP  59  -2.214 -13.063 -13.723
  427   1HB   ASP  59          1HB       ASP  59  -2.789 -16.010 -13.083
  428   2HB   ASP  59          2HB       ASP  59  -2.287 -15.340 -14.618
  429    H    ALA  60           H        ALA  60  -1.984 -14.688 -10.610
  430    HA   ALA  60           HA       ALA  60  -4.581 -13.784  -9.505
  431   1HB   ALA  60          1HB       ALA  60  -3.736 -14.696  -7.348
  432   2HB   ALA  60          2HB       ALA  60  -3.488 -15.844  -8.678
  433   3HB   ALA  60          3HB       ALA  60  -2.110 -14.911  -8.039
  434    H    ILE  61           H        ILE  61  -1.212 -12.695  -9.274
  435    HA   ILE  61           HA       ILE  61  -1.410 -10.554  -7.319
  436    HB   ILE  61           HB       ILE  61   0.517 -11.287  -9.448
  437   1HG1  ILE  61          1HG1      ILE  61   0.476 -11.029  -6.572
  438   2HG1  ILE  61          2HG1      ILE  61   1.752 -11.666  -7.588
  439   1HG2  ILE  61          1HG2      ILE  61   1.689  -9.069  -9.573
  440   2HG2  ILE  61          2HG2      ILE  61   0.074  -8.956 -10.268
  441   3HG2  ILE  61          3HG2      ILE  61   0.379  -8.303  -8.642
  442   1HD1  ILE  61          1HD1      ILE  61   1.533  -8.717  -6.737
  443   2HD1  ILE  61          2HD1      ILE  61   2.704  -9.929  -6.174
  444   3HD1  ILE  61          3HD1      ILE  61   2.760  -9.367  -7.860
  445    H    ILE  62           H        ILE  62  -2.239 -10.766 -10.749
  446    HA   ILE  62           HA       ILE  62  -2.941  -7.860 -11.041
  447    HB   ILE  62           HB       ILE  62  -3.212 -10.209 -12.982
  448   1HG1  ILE  62          1HG1      ILE  62  -1.029  -8.283 -12.375
  449   2HG1  ILE  62          2HG1      ILE  62  -0.975  -9.802 -13.244
  450   1HG2  ILE  62          1HG2      ILE  62  -3.818  -8.552 -14.767
  451   2HG2  ILE  62          2HG2      ILE  62  -5.038  -8.555 -13.496
  452   3HG2  ILE  62          3HG2      ILE  62  -3.846  -7.238 -13.565
  453   1HD1  ILE  62          1HD1      ILE  62  -1.744  -7.109 -14.518
  454   2HD1  ILE  62          2HD1      ILE  62  -0.251  -8.040 -14.757
  455   3HD1  ILE  62          3HD1      ILE  62  -1.797  -8.684 -15.356
  456    H    GLU  63           H        GLU  63  -4.507 -10.937 -10.384
  457    HA   GLU  63           HA       GLU  63  -7.253 -10.555 -10.817
  458   1HB   GLU  63          1HB       GLU  63  -6.028 -12.542  -9.673
  459   2HB   GLU  63          2HB       GLU  63  -6.282 -11.703  -8.155
  460   1HG   GLU  63          1HG       GLU  63  -8.658 -12.001  -8.226
  461   2HG   GLU  63          2HG       GLU  63  -8.695 -12.206  -9.969
  462    H    GLU  64           H        GLU  64  -5.859  -9.833  -7.601
  463    HA   GLU  64           HA       GLU  64  -8.100  -7.936  -6.973
  464   1HB   GLU  64          1HB       GLU  64  -5.907  -9.258  -5.365
  465   2HB   GLU  64          2HB       GLU  64  -7.645  -9.303  -5.143
  466   1HG   GLU  64          1HG       GLU  64  -6.999  -6.562  -4.693
  467   2HG   GLU  64          2HG       GLU  64  -5.625  -7.421  -4.018
  468    H    VAL  65           H        VAL  65  -7.565  -6.401  -8.616
  469    HA   VAL  65           HA       VAL  65  -6.331  -3.978  -7.795
  470    HB   VAL  65           HB       VAL  65  -4.228  -4.191  -9.524
  471   1HG1  VAL  65          1HG1      VAL  65  -4.155  -6.913  -8.071
  472   2HG1  VAL  65          2HG1      VAL  65  -4.596  -6.720  -9.778
  473   3HG1  VAL  65          3HG1      VAL  65  -2.965  -6.265  -9.228
  474   1HG2  VAL  65          1HG2      VAL  65  -2.735  -4.109  -7.591
  475   2HG2  VAL  65          2HG2      VAL  65  -4.231  -3.278  -7.103
  476   3HG2  VAL  65          3HG2      VAL  65  -3.918  -4.926  -6.541
  477    H    ASP  66           H        ASP  66  -6.883  -6.238 -10.454
  478    HA   ASP  66           HA       ASP  66  -7.656  -3.960 -12.346
  479   1HB   ASP  66          1HB       ASP  66  -6.085  -6.293 -12.850
  480   2HB   ASP  66          2HB       ASP  66  -7.616  -6.604 -13.635
  481    H    GLU  67           H        GLU  67  -9.443  -4.013 -10.611
  482    HA   GLU  67           HA       GLU  67 -11.639  -6.040 -11.019
  483   1HB   GLU  67          1HB       GLU  67 -11.882  -3.539  -9.292
  484   2HB   GLU  67          2HB       GLU  67 -10.884  -4.880  -8.764
  485   1HG   GLU  67          1HG       GLU  67 -13.286  -4.846  -7.854
  486   2HG   GLU  67          2HG       GLU  67 -13.876  -5.147  -9.479
  487    H    ASP  68           H        ASP  68 -10.932  -4.594 -13.343
  488    HA   ASP  68           HA       ASP  68 -13.420  -2.898 -13.873
  489   1HB   ASP  68          1HB       ASP  68 -12.018  -1.107 -13.997
  490   2HB   ASP  68          2HB       ASP  68 -11.799  -1.686 -15.632
  491    H    GLY  69           H        GLY  69 -10.659  -4.155 -15.779
  492   1HA   GLY  69          1HA       GLY  69 -12.620  -5.395 -17.795
  493   2HA   GLY  69          2HA       GLY  69 -11.317  -6.386 -17.125
  494    H    SER  70           H        SER  70  -9.375  -6.341 -18.000
  495    HA   SER  70           HA       SER  70  -8.797  -5.198 -20.613
  496   1HB   SER  70          1HB       SER  70  -8.666  -2.996 -19.932
  497   2HB   SER  70          2HB       SER  70  -6.978  -3.476 -19.733
  498    HG   SER  70           HG       SER  70  -8.160  -2.359 -17.959
  499    H    GLY  71           H        GLY  71  -7.292  -5.863 -17.435
  500   1HA   GLY  71          1HA       GLY  71  -5.680  -7.633 -16.840
  501   2HA   GLY  71          2HA       GLY  71  -5.604  -8.095 -18.546
  502    H    THR  72           H        THR  72  -5.242  -4.783 -17.447
  503    HA   THR  72           HA       THR  72  -2.221  -4.863 -17.668
  504    HB   THR  72           HB       THR  72  -2.162  -2.775 -19.087
  505    HG1  THR  72           HG1      THR  72  -4.620  -2.657 -18.708
  506   1HG2  THR  72          1HG2      THR  72  -2.434  -3.853 -21.284
  507   2HG2  THR  72          2HG2      THR  72  -1.644  -4.998 -20.177
  508   3HG2  THR  72          3HG2      THR  72  -3.368  -5.195 -20.587
  509    H    ILE  73           H        ILE  73  -1.230  -2.981 -16.723
  510    HA   ILE  73           HA       ILE  73  -2.948  -1.550 -14.622
  511    HB   ILE  73           HB       ILE  73   0.037  -2.196 -14.432
  512   1HG1  ILE  73          1HG1      ILE  73  -2.395  -3.676 -13.255
  513   2HG1  ILE  73          2HG1      ILE  73  -0.813  -3.780 -12.513
  514   1HG2  ILE  73          1HG2      ILE  73  -0.119  -1.444 -12.062
  515   2HG2  ILE  73          2HG2      ILE  73  -0.653  -0.140 -13.131
  516   3HG2  ILE  73          3HG2      ILE  73  -1.855  -1.099 -12.235
  517   1HD1  ILE  73          1HD1      ILE  73   0.197  -4.808 -14.532
  518   2HD1  ILE  73          2HD1      ILE  73  -1.233  -5.720 -14.005
  519   3HD1  ILE  73          3HD1      ILE  73  -1.345  -4.641 -15.416
  520    H    ASP  74           H        ASP  74  -3.482  -0.073 -16.342
  521    HA   ASP  74           HA       ASP  74  -1.423   1.658 -17.612
  522   1HB   ASP  74          1HB       ASP  74  -4.317   2.556 -17.514
  523   2HB   ASP  74          2HB       ASP  74  -3.127   2.741 -18.781
  524    H    PHE  75           H        PHE  75  -1.499   4.050 -17.338
  525    HA   PHE  75           HA       PHE  75  -0.690   4.853 -14.668
  526   1HB   PHE  75          1HB       PHE  75  -1.750   6.862 -16.727
  527   2HB   PHE  75          2HB       PHE  75  -0.256   6.009 -17.011
  528    HD1  PHE  75           HD1      PHE  75   0.237   6.029 -13.717
  529    HD2  PHE  75           HD2      PHE  75  -0.388   9.006 -16.760
  530    HE1  PHE  75           HE1      PHE  75   1.384   7.705 -12.327
  531    HE2  PHE  75           HE2      PHE  75   0.769  10.667 -15.357
  532    HZ   PHE  75           HZ       PHE  75   1.645  10.025 -13.139
  533    H    GLU  76           H        GLU  76  -3.828   4.631 -16.177
  534    HA   GLU  76           HA       GLU  76  -5.216   6.382 -14.139
  535   1HB   GLU  76          1HB       GLU  76  -6.786   6.750 -15.657
  536   2HB   GLU  76          2HB       GLU  76  -7.082   5.044 -15.915
  537   1HG   GLU  76          1HG       GLU  76  -4.892   6.668 -17.355
  538   2HG   GLU  76          2HG       GLU  76  -5.217   4.966 -17.609
  539    H    GLU  77           H        GLU  77  -3.970   4.192 -13.028
  540    HA   GLU  77           HA       GLU  77  -6.156   2.966 -11.460
  541   1HB   GLU  77          1HB       GLU  77  -5.236   0.521 -12.084
  542   2HB   GLU  77          2HB       GLU  77  -6.644   1.248 -12.822
  543   1HG   GLU  77          1HG       GLU  77  -4.816   2.131 -14.643
  544   2HG   GLU  77          2HG       GLU  77  -3.894   0.758 -14.041
  545    H    PHE  78           H        PHE  78  -2.773   2.817 -12.496
  546    HA   PHE  78           HA       PHE  78  -1.603   1.494 -10.185
  547   1HB   PHE  78          1HB       PHE  78  -0.088   3.674 -11.709
  548   2HB   PHE  78          2HB       PHE  78  -0.534   2.207 -12.542
  549    HD1  PHE  78           HD1      PHE  78   2.162   2.268 -12.685
  550    HD2  PHE  78           HD2      PHE  78  -0.007   1.418  -9.068
  551    HE1  PHE  78           HE1      PHE  78   4.164   1.209 -11.720
  552    HE2  PHE  78           HE2      PHE  78   1.996   0.341  -8.130
  553    HZ   PHE  78           HZ       PHE  78   4.086   0.246  -9.444
  554    H    LEU  79           H        LEU  79  -2.593   4.807 -10.799
  555    HA   LEU  79           HA       LEU  79  -1.252   6.065  -8.469
  556   1HB   LEU  79          1HB       LEU  79  -2.563   8.076  -8.984
  557   2HB   LEU  79          2HB       LEU  79  -3.675   7.178  -9.994
  558    HG   LEU  79           HG       LEU  79  -1.700   6.674 -11.591
  559   1HD1  LEU  79          1HD1      LEU  79  -0.273   8.900 -10.005
  560   2HD1  LEU  79          2HD1      LEU  79   0.141   7.179  -9.901
  561   3HD1  LEU  79          3HD1      LEU  79   0.343   8.047 -11.443
  562   1HD2  LEU  79          1HD2      LEU  79  -1.869   8.828 -12.763
  563   2HD2  LEU  79          2HD2      LEU  79  -3.450   8.522 -12.001
  564   3HD2  LEU  79          3HD2      LEU  79  -2.330   9.678 -11.266
  565    H    VAL  80           H        VAL  80  -4.375   4.569  -9.094
  566    HA   VAL  80           HA       VAL  80  -5.780   5.416  -6.663
  567    HB   VAL  80           HB       VAL  80  -6.723   4.304  -8.867
  568   1HG1  VAL  80          1HG1      VAL  80  -7.386   1.904  -8.596
  569   2HG1  VAL  80          2HG1      VAL  80  -5.627   2.066  -8.668
  570   3HG1  VAL  80          3HG1      VAL  80  -6.422   1.788  -7.101
  571   1HG2  VAL  80          1HG2      VAL  80  -8.020   3.662  -6.136
  572   2HG2  VAL  80          2HG2      VAL  80  -8.195   5.197  -7.019
  573   3HG2  VAL  80          3HG2      VAL  80  -8.848   3.705  -7.712
  574    H    MET  81           H        MET  81  -4.137   2.345  -7.515
  575    HA   MET  81           HA       MET  81  -4.326   0.963  -4.960
  576   1HB   MET  81          1HB       MET  81  -2.712  -0.581  -5.731
  577   2HB   MET  81          2HB       MET  81  -3.571  -0.065  -7.170
  578   1HG   MET  81          1HG       MET  81  -1.705   1.174  -8.030
  579   2HG   MET  81          2HG       MET  81  -0.918   1.295  -6.447
  580   1HE   MET  81          1HE       MET  81  -0.413  -1.092  -4.998
  581   2HE   MET  81          2HE       MET  81   0.832  -2.052  -5.852
  582   3HE   MET  81          3HE       MET  81   1.015  -0.280  -5.716
  583    H    MET  82           H        MET  82  -1.894   3.213  -6.264
  584    HA   MET  82           HA       MET  82   0.021   3.045  -4.049
  585   1HB   MET  82          1HB       MET  82   0.634   5.497  -5.036
  586   2HB   MET  82          2HB       MET  82  -0.353   4.954  -6.379
  587   1HG   MET  82          1HG       MET  82   1.700   4.153  -7.115
  588   2HG   MET  82          2HG       MET  82   1.222   2.733  -6.175
  589   1HE   MET  82          1HE       MET  82   4.715   2.391  -5.116
  590   2HE   MET  82          2HE       MET  82   4.817   3.575  -6.452
  591   3HE   MET  82          3HE       MET  82   3.624   2.246  -6.530
  592    H    VAL  83           H        VAL  83  -2.841   5.000  -4.669
  593    HA   VAL  83           HA       VAL  83  -2.444   7.039  -2.575
  594    HB   VAL  83           HB       VAL  83  -4.395   6.557  -4.643
  595   1HG1  VAL  83          1HG1      VAL  83  -4.156   9.048  -2.843
  596   2HG1  VAL  83          2HG1      VAL  83  -3.036   8.700  -4.168
  597   3HG1  VAL  83          3HG1      VAL  83  -4.761   8.961  -4.517
  598   1HG2  VAL  83          1HG2      VAL  83  -6.528   7.172  -3.631
  599   2HG2  VAL  83          2HG2      VAL  83  -5.933   5.764  -2.720
  600   3HG2  VAL  83          3HG2      VAL  83  -5.795   7.383  -2.020
  601    NH1  ARG  84           NH1      ARG  84  -7.446  -2.393  -3.083
  602    NH2  ARG  84           NH2      ARG  84  -9.437  -2.056  -2.043
  603    H    ARG  84           H        ARG  84  -3.948   3.856  -2.751
  604    HA   ARG  84           HA       ARG  84  -5.577   3.715  -0.368
  605   1HB   ARG  84          1HB       ARG  84  -4.479   1.809  -2.260
  606   2HB   ARG  84          2HB       ARG  84  -4.088   1.226  -0.649
  607   1HG   ARG  84          1HG       ARG  84  -6.342   0.975   0.016
  608   2HG   ARG  84          2HG       ARG  84  -6.954   2.142  -1.159
  609   1HD   ARG  84          1HD       ARG  84  -6.807   0.616  -2.993
  610   2HD   ARG  84          2HD       ARG  84  -5.623  -0.422  -2.196
  611    HE   ARG  84           HE       ARG  84  -8.057  -0.526  -0.602
  612   1HH1  ARG  84          1HH1      ARG  84  -6.468  -2.105  -3.197
  613   2HH1  ARG  84          2HH1      ARG  84  -7.921  -3.161  -3.569
  614   1HH2  ARG  84          1HH2      ARG  84  -9.983  -1.501  -1.375
  615   2HH2  ARG  84          2HH2      ARG  84  -9.767  -2.860  -2.589
  616    H    GLN  85           H        GLN  85  -2.140   2.753  -0.728
  617    HA   GLN  85           HA       GLN  85  -1.614   2.285   2.136
  618   1HB   GLN  85          1HB       GLN  85  -0.264   1.425   0.074
  619   2HB   GLN  85          2HB       GLN  85   0.579   1.821   1.560
  620   1HG   GLN  85          1HG       GLN  85   0.836   4.249   0.314
  621   2HG   GLN  85          2HG       GLN  85   0.648   3.256  -1.114
  622   1HE2  GLN  85          1HE2      GLN  85   4.328   3.381  -0.392
  623   2HE2  GLN  85          2HE2      GLN  85   2.975   4.460  -1.002
  624    H    MET  86           H        MET  86  -1.351   5.052  -0.038
  625    HA   MET  86           HA       MET  86   0.238   6.906   1.478
  626   1HB   MET  86          1HB       MET  86  -1.544   7.106  -0.826
  627   2HB   MET  86          2HB       MET  86  -1.879   8.444   0.258
  628   1HG   MET  86          1HG       MET  86   0.480   8.005  -1.493
  629   2HG   MET  86          2HG       MET  86   0.963   8.410   0.162
  630   1HE   MET  86          1HE       MET  86  -2.410   9.433  -1.798
  631   2HE   MET  86          2HE       MET  86  -1.939  11.043  -2.418
  632   3HE   MET  86          3HE       MET  86  -1.134   9.575  -3.047
  633    H    LYS  87           H        LYS  87  -3.164   6.016   1.754
  634    HA   LYS  87           HA       LYS  87  -4.155   8.053   3.589
  635   1HB   LYS  87          1HB       LYS  87  -5.744   6.117   4.420
  636   2HB   LYS  87          2HB       LYS  87  -4.992   5.138   3.169
  637   1HG   LYS  87          1HG       LYS  87  -6.303   7.834   2.523
  638   2HG   LYS  87          2HG       LYS  87  -5.777   6.618   1.372
  639   1HD   LYS  87          1HD       LYS  87  -8.083   6.319   3.404
  640   2HD   LYS  87          2HD       LYS  87  -8.250   6.685   1.691
  641   1HE   LYS  87          1HE       LYS  87  -6.701   4.150   2.241
  642   2HE   LYS  87          2HE       LYS  87  -8.391   4.105   2.760
  643   1HZ   LYS  87          1HZ       LYS  87  -8.911   4.987   0.438
  644   2HZ   LYS  87          2HZ       LYS  87  -8.394   3.421   0.537
  645   3HZ   LYS  87          3HZ       LYS  87  -7.357   4.602   0.028
  646    H    GLU  88           H        GLU  88  -4.303   8.107   5.810
  647    HA   GLU  88           HA       GLU  88  -3.457   7.988   8.052
  648   1HB   GLU  88          1HB       GLU  88  -4.670   5.872   8.023
  649   2HB   GLU  88          2HB       GLU  88  -3.331   5.029   7.269
  650   1HG   GLU  88          1HG       GLU  88  -1.967   5.746   9.464
  651   2HG   GLU  88          2HG       GLU  88  -3.047   4.363   9.489
  652    H    ASP  89           H        ASP  89  -1.411   5.317   7.081
  653    HA   ASP  89           HA       ASP  89   1.055   6.829   6.481
  654   1HB   ASP  89          1HB       ASP  89   0.597   7.174   9.095
  655   2HB   ASP  89          2HB       ASP  89   1.251   5.558   9.238
  656    H    ALA  90           H        ALA  90   2.947   5.358   6.463
  657    HA   ALA  90           HA       ALA  90   4.064   3.269   5.944
  658   1HB   ALA  90          1HB       ALA  90   2.968   1.095   6.550
  659   2HB   ALA  90          2HB       ALA  90   2.910   2.229   7.914
  660   3HB   ALA  90          3HB       ALA  90   1.447   1.937   6.942
   
  Start of MODEL           5
 Raw file had  660 H/Q atoms
  Start of MODEL    5
    1   1H    ALA   1          1H        ALA   1 -21.428  -2.670 -15.325
    2   2H    ALA   1          2H        ALA   1 -22.852  -3.004 -16.155
    3   3H    ALA   1          3H        ALA   1 -21.367  -3.192 -16.922
    4    HA   ALA   1           HA       ALA   1 -22.133  -1.243 -17.796
    5   1HB   ALA   1          1HB       ALA   1 -23.584   0.252 -16.731
    6   2HB   ALA   1          2HB       ALA   1 -22.874   0.010 -15.124
    7   3HB   ALA   1          3HB       ALA   1 -23.979  -1.213 -15.801
    8    H    SER   2           H        SER   2 -20.617   0.229 -18.247
    9    HA   SER   2           HA       SER   2 -18.222   0.513 -16.363
   10   1HB   SER   2          1HB       SER   2 -16.816   0.336 -18.147
   11   2HB   SER   2          2HB       SER   2 -18.190  -0.495 -18.880
   12    HG   SER   2           HG       SER   2 -17.071   1.381 -19.967
   13    H    MET   3           H        MET   3 -17.258   2.524 -16.090
   14    HA   MET   3           HA       MET   3 -18.702   5.039 -17.030
   15   1HB   MET   3          1HB       MET   3 -18.438   4.140 -14.123
   16   2HB   MET   3          2HB       MET   3 -18.551   5.845 -14.520
   17   1HG   MET   3          1HG       MET   3 -20.760   5.270 -15.803
   18   2HG   MET   3          2HG       MET   3 -20.649   3.665 -15.070
   19   1HE   MET   3          1HE       MET   3 -22.137   7.517 -13.778
   20   2HE   MET   3          2HE       MET   3 -23.343   6.203 -13.646
   21   3HE   MET   3          3HE       MET   3 -22.409   6.406 -15.157
   22    H    THR   4           H        THR   4 -17.443   6.959 -15.842
   23    HA   THR   4           HA       THR   4 -14.493   6.558 -16.473
   24    HB   THR   4           HB       THR   4 -14.327   8.992 -16.863
   25    HG1  THR   4           HG1      THR   4 -16.609   9.825 -17.305
   26   1HG2  THR   4          1HG2      THR   4 -15.720   9.148 -19.008
   27   2HG2  THR   4          2HG2      THR   4 -16.371   7.533 -18.650
   28   3HG2  THR   4          3HG2      THR   4 -14.626   7.749 -18.944
   29    H    ASP   5           H        ASP   5 -15.661   5.788 -13.991
   30    HA   ASP   5           HA       ASP   5 -14.912   7.806 -11.901
   31   1HB   ASP   5          1HB       ASP   5 -16.755   6.549 -11.188
   32   2HB   ASP   5          2HB       ASP   5 -16.141   5.039 -11.820
   33    H    GLN   6           H        GLN   6 -13.497   5.055 -13.517
   34    HA   GLN   6           HA       GLN   6 -11.513   4.015 -11.798
   35   1HB   GLN   6          1HB       GLN   6 -11.321   4.556 -14.810
   36   2HB   GLN   6          2HB       GLN   6 -11.843   3.085 -14.009
   37   1HG   GLN   6          1HG       GLN   6  -9.058   3.924 -13.265
   38   2HG   GLN   6          2HG       GLN   6  -9.262   3.606 -14.974
   39   1HE2  GLN   6          1HE2      GLN   6  -8.866   0.462 -12.466
   40   2HE2  GLN   6          2HE2      GLN   6  -8.538   2.214 -12.032
   41    H    GLN   7           H        GLN   7 -10.434   6.315 -14.280
   42    HA   GLN   7           HA       GLN   7  -8.260   7.348 -12.428
   43   1HB   GLN   7          1HB       GLN   7  -7.765   6.590 -14.839
   44   2HB   GLN   7          2HB       GLN   7  -7.121   8.146 -14.327
   45   1HG   GLN   7          1HG       GLN   7  -8.872   9.386 -15.556
   46   2HG   GLN   7          2HG       GLN   7  -7.970   8.332 -16.634
   47   1HE2  GLN   7          1HE2      GLN   7 -10.879   6.198 -17.267
   48   2HE2  GLN   7          2HE2      GLN   7  -9.045   6.260 -17.250
   49    H    ALA   8           H        ALA   8 -11.218   8.129 -12.293
   50    HA   ALA   8           HA       ALA   8 -11.322  11.031 -13.019
   51   1HB   ALA   8          1HB       ALA   8 -13.589  10.976 -11.992
   52   2HB   ALA   8          2HB       ALA   8 -13.370   9.647 -13.147
   53   3HB   ALA   8          3HB       ALA   8 -13.314   9.321 -11.396
   54    H    GLU   9           H        GLU   9 -10.878   9.059 -10.111
   55    HA   GLU   9           HA       GLU   9 -10.864  11.404  -8.223
   56   1HB   GLU   9          1HB       GLU   9  -9.934   8.735  -7.184
   57   2HB   GLU   9          2HB       GLU   9 -10.992   9.938  -6.461
   58   1HG   GLU   9          1HG       GLU   9 -12.788   9.191  -8.278
   59   2HG   GLU   9          2HG       GLU   9 -11.771   7.770  -8.487
   60    H    ALA  10           H        ALA  10  -8.530   8.759  -8.857
   61    HA   ALA  10           HA       ALA  10  -6.249   9.783  -7.470
   62   1HB   ALA  10          1HB       ALA  10  -4.867   8.310  -8.926
   63   2HB   ALA  10          2HB       ALA  10  -6.342   7.484  -8.389
   64   3HB   ALA  10          3HB       ALA  10  -6.225   8.099 -10.057
   65    NH1  ARG  11           NH1      ARG  11  -7.756  14.721 -16.354
   66    NH2  ARG  11           NH2      ARG  11  -9.265  13.154 -17.007
   67    H    ARG  11           H        ARG  11  -7.560  10.682 -10.597
   68    HA   ARG  11           HA       ARG  11  -5.177  12.124 -11.675
   69   1HB   ARG  11          1HB       ARG  11  -6.640  11.312 -13.365
   70   2HB   ARG  11          2HB       ARG  11  -8.086  11.847 -12.522
   71   1HG   ARG  11          1HG       ARG  11  -6.316  14.136 -13.236
   72   2HG   ARG  11          2HG       ARG  11  -6.833  13.208 -14.646
   73   1HD   ARG  11          1HD       ARG  11  -9.046  13.744 -12.683
   74   2HD   ARG  11          2HD       ARG  11  -8.361  15.210 -13.389
   75    HE   ARG  11           HE       ARG  11 -10.251  13.619 -14.748
   76   1HH1  ARG  11          1HH1      ARG  11 -10.039  12.533 -16.744
   77   2HH1  ARG  11          2HH1      ARG  11  -8.852  13.262 -17.940
   78   1HH2  ARG  11          1HH2      ARG  11  -7.327  15.241 -15.580
   79   2HH2  ARG  11          2HH2      ARG  11  -7.495  14.768 -17.345
   80    H    ALA  12           H        ALA  12  -8.276  13.054 -10.180
   81    HA   ALA  12           HA       ALA  12  -8.035  15.955 -10.377
   82   1HB   ALA  12          1HB       ALA  12  -9.785  16.069  -8.615
   83   2HB   ALA  12          2HB       ALA  12 -10.190  14.858  -9.848
   84   3HB   ALA  12          3HB       ALA  12  -9.582  14.337  -8.256
   85    H    PHE  13           H        PHE  13  -6.749  13.605  -8.090
   86    HA   PHE  13           HA       PHE  13  -5.921  15.564  -6.002
   87   1HB   PHE  13          1HB       PHE  13  -6.547  13.264  -5.395
   88   2HB   PHE  13          2HB       PHE  13  -5.273  12.583  -6.373
   89    HD1  PHE  13           HD1      PHE  13  -3.185  12.074  -5.292
   90    HD2  PHE  13           HD2      PHE  13  -5.770  14.998  -3.475
   91    HE1  PHE  13           HE1      PHE  13  -1.691  12.199  -3.340
   92    HE2  PHE  13           HE2      PHE  13  -4.264  15.108  -1.533
   93    HZ   PHE  13           HZ       PHE  13  -2.229  13.709  -1.457
   94    H    LEU  14           H        LEU  14  -4.239  13.510  -8.401
   95    HA   LEU  14           HA       LEU  14  -1.532  14.680  -7.864
   96   1HB   LEU  14          1HB       LEU  14  -2.278  12.894 -10.242
   97   2HB   LEU  14          2HB       LEU  14  -0.686  13.168  -9.568
   98    HG   LEU  14           HG       LEU  14  -2.753  11.923  -7.720
   99   1HD1  LEU  14          1HD1      LEU  14   0.240  11.304  -8.129
  100   2HD1  LEU  14          2HD1      LEU  14  -0.385  12.480  -6.958
  101   3HD1  LEU  14          3HD1      LEU  14  -0.794  10.754  -6.785
  102   1HD2  LEU  14          1HD2      LEU  14  -2.440   9.650  -8.609
  103   2HD2  LEU  14          2HD2      LEU  14  -3.001  10.671  -9.956
  104   3HD2  LEU  14          3HD2      LEU  14  -1.291  10.226  -9.844
  105    H    SER  15           H        SER  15  -0.761  16.433  -8.730
  106    HA   SER  15           HA       SER  15  -2.147  18.003 -10.887
  107   1HB   SER  15          1HB       SER  15  -1.270  19.543  -9.455
  108   2HB   SER  15          2HB       SER  15   0.051  18.500  -8.921
  109    HG   SER  15           HG       SER  15   0.883  20.144 -10.106
  110    H    GLU  16           H        GLU  16  -0.640  18.880 -12.662
  111    HA   GLU  16           HA       GLU  16   0.142  16.701 -14.443
  112   1HB   GLU  16          1HB       GLU  16   0.848  19.668 -14.746
  113   2HB   GLU  16          2HB       GLU  16  -0.706  18.975 -15.165
  114   1HG   GLU  16          1HG       GLU  16   0.899  17.324 -16.679
  115   2HG   GLU  16          2HG       GLU  16   0.212  18.828 -17.267
  116    H    GLU  17           H        GLU  17   1.903  18.795 -12.242
  117    HA   GLU  17           HA       GLU  17   4.639  18.090 -13.232
  118   1HB   GLU  17          1HB       GLU  17   4.199  19.369 -10.513
  119   2HB   GLU  17          2HB       GLU  17   5.551  19.542 -11.614
  120   1HG   GLU  17          1HG       GLU  17   3.896  20.784 -13.229
  121   2HG   GLU  17          2HG       GLU  17   2.745  20.780 -11.904
  122    H    MET  18           H        MET  18   2.463  17.118 -10.624
  123    HA   MET  18           HA       MET  18   4.347  15.426  -9.081
  124   1HB   MET  18          1HB       MET  18   2.182  14.384  -8.122
  125   2HB   MET  18          2HB       MET  18   1.283  15.496  -9.138
  126   1HG   MET  18          1HG       MET  18   1.389  16.532  -6.961
  127   2HG   MET  18          2HG       MET  18   2.512  17.453  -7.976
  128   1HE   MET  18          1HE       MET  18   2.189  14.570  -5.235
  129   2HE   MET  18          2HE       MET  18   3.477  15.178  -4.152
  130   3HE   MET  18          3HE       MET  18   2.092  16.230  -4.569
  131    H    ILE  19           H        ILE  19   2.183  14.970 -11.823
  132    HA   ILE  19           HA       ILE  19   2.045  12.044 -11.872
  133    HB   ILE  19           HB       ILE  19   1.256  14.234 -13.706
  134   1HG1  ILE  19          1HG1      ILE  19   0.083  11.588 -12.718
  135   2HG1  ILE  19          2HG1      ILE  19  -0.582  12.301 -14.172
  136   1HG2  ILE  19          1HG2      ILE  19   1.096  12.853 -15.793
  137   2HG2  ILE  19          2HG2      ILE  19   2.783  13.047 -15.320
  138   3HG2  ILE  19          3HG2      ILE  19   1.951  11.509 -14.996
  139   1HD1  ILE  19          1HD1      ILE  19  -1.240  14.382 -12.995
  140   2HD1  ILE  19          2HD1      ILE  19  -1.888  12.958 -12.156
  141   3HD1  ILE  19          3HD1      ILE  19  -0.471  13.804 -11.492
  142    H    ALA  20           H        ALA  20   4.316  14.439 -13.137
  143    HA   ALA  20           HA       ALA  20   5.976  12.841 -14.862
  144   1HB   ALA  20          1HB       ALA  20   7.752  14.545 -14.476
  145   2HB   ALA  20          2HB       ALA  20   6.169  15.303 -14.737
  146   3HB   ALA  20          3HB       ALA  20   6.853  15.212 -13.094
  147    H    GLU  21           H        GLU  21   6.077  13.287 -11.340
  148    HA   GLU  21           HA       GLU  21   8.577  12.040 -10.625
  149   1HB   GLU  21          1HB       GLU  21   6.963  13.278  -9.081
  150   2HB   GLU  21          2HB       GLU  21   5.990  11.823  -8.994
  151   1HG   GLU  21          1HG       GLU  21   8.488  10.794  -8.288
  152   2HG   GLU  21          2HG       GLU  21   8.652  12.444  -7.712
  153    H    PHE  22           H        PHE  22   5.378  10.641 -11.271
  154    HA   PHE  22           HA       PHE  22   6.175   7.822 -10.678
  155   1HB   PHE  22          1HB       PHE  22   3.602   9.035 -11.843
  156   2HB   PHE  22          2HB       PHE  22   3.846   7.315 -11.715
  157    HD1  PHE  22           HD1      PHE  22   3.588   6.128  -9.608
  158    HD2  PHE  22           HD2      PHE  22   3.563  10.432  -9.643
  159    HE1  PHE  22           HE1      PHE  22   2.962   6.154  -7.230
  160    HE2  PHE  22           HE2      PHE  22   2.924  10.437  -7.267
  161    HZ   PHE  22           HZ       PHE  22   2.628   8.304  -6.055
  162    H    LYS  23           H        LYS  23   5.956   9.924 -13.475
  163    HA   LYS  23           HA       LYS  23   5.787   8.149 -15.719
  164   1HB   LYS  23          1HB       LYS  23   7.267  10.803 -15.368
  165   2HB   LYS  23          2HB       LYS  23   7.467   9.892 -16.848
  166   1HG   LYS  23          1HG       LYS  23   4.849   9.928 -17.052
  167   2HG   LYS  23          2HG       LYS  23   4.880  11.090 -15.737
  168   1HD   LYS  23          1HD       LYS  23   4.851  11.950 -18.254
  169   2HD   LYS  23          2HD       LYS  23   5.792  12.816 -17.034
  170   1HE   LYS  23          1HE       LYS  23   6.853  10.866 -19.170
  171   2HE   LYS  23          2HE       LYS  23   7.840  11.320 -17.773
  172   1HZ   LYS  23          1HZ       LYS  23   7.931  13.523 -18.483
  173   2HZ   LYS  23          2HZ       LYS  23   6.584  13.425 -19.435
  174   3HZ   LYS  23          3HZ       LYS  23   7.992  12.709 -19.919
  175    H    ALA  24           H        ALA  24   8.728   9.224 -13.990
  176    HA   ALA  24           HA       ALA  24  10.784   7.968 -15.515
  177   1HB   ALA  24          1HB       ALA  24  12.180   8.018 -13.458
  178   2HB   ALA  24          2HB       ALA  24  11.264   9.525 -13.650
  179   3HB   ALA  24          3HB       ALA  24  10.742   8.314 -12.451
  180    H    ALA  25           H        ALA  25   9.480   6.605 -12.471
  181    HA   ALA  25           HA       ALA  25  10.725   3.979 -12.713
  182   1HB   ALA  25          1HB       ALA  25   9.259   3.317 -10.817
  183   2HB   ALA  25          2HB       ALA  25   9.987   4.909 -10.537
  184   3HB   ALA  25          3HB       ALA  25   8.276   4.787 -11.018
  185    H    PHE  26           H        PHE  26   7.799   5.302 -14.058
  186    HA   PHE  26           HA       PHE  26   6.199   2.842 -14.369
  187   1HB   PHE  26          1HB       PHE  26   4.968   4.882 -14.493
  188   2HB   PHE  26          2HB       PHE  26   6.022   5.598 -15.683
  189    HD1  PHE  26           HD1      PHE  26   5.432   5.417 -18.031
  190    HD2  PHE  26           HD2      PHE  26   3.587   2.729 -15.224
  191    HE1  PHE  26           HE1      PHE  26   3.806   4.725 -19.746
  192    HE2  PHE  26           HE2      PHE  26   1.972   2.046 -16.953
  193    HZ   PHE  26           HZ       PHE  26   2.089   3.027 -19.218
  194    H    ASP  27           H        ASP  27   8.356   4.674 -16.548
  195    HA   ASP  27           HA       ASP  27   8.170   2.888 -18.869
  196   1HB   ASP  27          1HB       ASP  27   9.206   5.374 -18.611
  197   2HB   ASP  27          2HB       ASP  27   9.559   4.305 -19.948
  198    H    MET  28           H        MET  28  10.157   2.939 -15.972
  199    HA   MET  28           HA       MET  28  12.194   0.979 -16.571
  200   1HB   MET  28          1HB       MET  28  11.613   2.357 -14.283
  201   2HB   MET  28          2HB       MET  28  10.943   0.802 -13.828
  202   1HG   MET  28          1HG       MET  28  13.858   1.240 -14.741
  203   2HG   MET  28          2HG       MET  28  13.162  -0.317 -14.264
  204   1HE   MET  28          1HE       MET  28  12.541   3.376 -12.788
  205   2HE   MET  28          2HE       MET  28  13.675   3.351 -11.404
  206   3HE   MET  28          3HE       MET  28  14.308   3.283 -13.076
  207    H    PHE  29           H        PHE  29   8.830   0.569 -15.503
  208    HA   PHE  29           HA       PHE  29   8.940  -2.393 -15.259
  209   1HB   PHE  29          1HB       PHE  29   6.495  -0.523 -15.370
  210   2HB   PHE  29          2HB       PHE  29   6.407  -2.237 -15.067
  211    HD1  PHE  29           HD1      PHE  29   6.368   0.846 -13.450
  212    HD2  PHE  29           HD2      PHE  29   8.238  -3.012 -13.053
  213    HE1  PHE  29           HE1      PHE  29   6.728   1.253 -11.049
  214    HE2  PHE  29           HE2      PHE  29   8.595  -2.579 -10.657
  215    HZ   PHE  29           HZ       PHE  29   7.844  -0.452  -9.652
  216    H    ASP  30           H        ASP  30   7.999  -0.036 -17.709
  217    HA   ASP  30           HA       ASP  30   6.763  -1.796 -19.679
  218   1HB   ASP  30          1HB       ASP  30   6.502   0.621 -19.902
  219   2HB   ASP  30          2HB       ASP  30   8.225   0.867 -20.071
  220    H    ALA  31           H        ALA  31   7.664  -2.613 -21.637
  221    HA   ALA  31           HA       ALA  31  10.666  -3.256 -21.575
  222   1HB   ALA  31          1HB       ALA  31  10.147  -5.602 -22.259
  223   2HB   ALA  31          2HB       ALA  31   9.436  -5.204 -20.683
  224   3HB   ALA  31          3HB       ALA  31   8.401  -5.283 -22.131
  225    H    ASP  32           H        ASP  32   7.711  -3.525 -23.576
  226    HA   ASP  32           HA       ASP  32   9.265  -3.215 -26.158
  227   1HB   ASP  32          1HB       ASP  32   7.509  -4.132 -27.296
  228   2HB   ASP  32          2HB       ASP  32   7.197  -4.841 -25.728
  229    H    GLY  33           H        GLY  33   6.678  -1.582 -24.316
  230   1HA   GLY  33          1HA       GLY  33   6.579   0.899 -23.991
  231   2HA   GLY  33          2HA       GLY  33   7.565   1.087 -25.423
  232    H    GLY  34           H        GLY  34   4.434   1.077 -24.122
  233   1HA   GLY  34          1HA       GLY  34   3.216   2.153 -26.640
  234   2HA   GLY  34          2HA       GLY  34   2.576   0.557 -26.226
  235    H    GLY  35           H        GLY  35   3.653   2.995 -23.906
  236   1HA   GLY  35          1HA       GLY  35   2.511   4.119 -22.081
  237   2HA   GLY  35          2HA       GLY  35   1.195   4.364 -23.237
  238    H    ASP  36           H        ASP  36   2.451   1.228 -22.215
  239    HA   ASP  36           HA       ASP  36   0.557   0.698 -20.028
  240   1HB   ASP  36          1HB       ASP  36  -1.079  -0.749 -20.953
  241   2HB   ASP  36          2HB       ASP  36  -1.077   0.677 -21.964
  242    H    ILE  37           H        ILE  37   0.639  -1.626 -19.402
  243    HA   ILE  37           HA       ILE  37   3.111  -3.131 -20.344
  244    HB   ILE  37           HB       ILE  37   2.614  -2.551 -17.391
  245   1HG1  ILE  37          1HG1      ILE  37   5.281  -1.715 -18.302
  246   2HG1  ILE  37          2HG1      ILE  37   4.060  -0.909 -19.269
  247   1HG2  ILE  37          1HG2      ILE  37   4.644  -3.864 -16.909
  248   2HG2  ILE  37          2HG2      ILE  37   3.487  -4.857 -17.806
  249   3HG2  ILE  37          3HG2      ILE  37   4.906  -4.181 -18.641
  250   1HD1  ILE  37          1HD1      ILE  37   4.224  -0.766 -16.198
  251   2HD1  ILE  37          2HD1      ILE  37   4.600   0.519 -17.367
  252   3HD1  ILE  37          3HD1      ILE  37   2.922  -0.041 -17.181
  253    H    SER  38           H        SER  38   2.358  -4.955 -21.038
  254    HA   SER  38           HA       SER  38  -0.085  -6.336 -20.022
  255   1HB   SER  38          1HB       SER  38   1.955  -6.847 -22.175
  256   2HB   SER  38          2HB       SER  38   0.191  -6.862 -22.243
  257    HG   SER  38           HG       SER  38   0.679  -8.918 -22.333
  258    H    THR  39           H        THR  39   0.173  -8.703 -19.402
  259    HA   THR  39           HA       THR  39   1.527  -8.929 -16.816
  260    HB   THR  39           HB       THR  39   1.076 -11.583 -17.435
  261    HG1  THR  39           HG1      THR  39  -0.595 -11.757 -18.708
  262   1HG2  THR  39          1HG2      THR  39  -1.022 -11.431 -16.168
  263   2HG2  THR  39          2HG2      THR  39   0.184 -10.373 -15.400
  264   3HG2  THR  39          3HG2      THR  39  -1.111  -9.671 -16.406
  265    H    LYS  40           H        LYS  40   2.578  -9.541 -20.074
  266    HA   LYS  40           HA       LYS  40   4.827 -11.388 -19.419
  267   1HB   LYS  40          1HB       LYS  40   5.001  -9.863 -21.981
  268   2HB   LYS  40          2HB       LYS  40   3.518 -10.768 -21.824
  269   1HG   LYS  40          1HG       LYS  40   6.011 -12.292 -21.093
  270   2HG   LYS  40          2HG       LYS  40   6.058 -11.638 -22.711
  271   1HD   LYS  40          1HD       LYS  40   3.770 -12.885 -23.142
  272   2HD   LYS  40          2HD       LYS  40   5.271 -13.761 -23.088
  273   1HE   LYS  40          1HE       LYS  40   3.611 -15.061 -21.904
  274   2HE   LYS  40          2HE       LYS  40   4.864 -14.576 -20.770
  275   1HZ   LYS  40          1HZ       LYS  40   2.475 -12.862 -20.986
  276   2HZ   LYS  40          2HZ       LYS  40   3.391 -13.218 -19.658
  277   3HZ   LYS  40          3HZ       LYS  40   2.309 -14.325 -20.236
  278    H    GLU  41           H        GLU  41   4.721  -8.036 -20.705
  279    HA   GLU  41           HA       GLU  41   7.469  -7.318 -20.450
  280   1HB   GLU  41          1HB       GLU  41   6.849  -5.361 -21.263
  281   2HB   GLU  41          2HB       GLU  41   5.985  -4.943 -19.799
  282   1HG   GLU  41          1HG       GLU  41   4.701  -6.594 -22.061
  283   2HG   GLU  41          2HG       GLU  41   3.893  -5.926 -20.659
  284    H    LEU  42           H        LEU  42   4.875  -6.952 -18.035
  285    HA   LEU  42           HA       LEU  42   6.263  -5.534 -15.954
  286   1HB   LEU  42          1HB       LEU  42   3.720  -6.432 -16.168
  287   2HB   LEU  42          2HB       LEU  42   4.318  -7.740 -15.171
  288    HG   LEU  42           HG       LEU  42   3.275  -6.075 -13.732
  289   1HD1  LEU  42          1HD1      LEU  42   5.245  -3.942 -14.770
  290   2HD1  LEU  42          2HD1      LEU  42   3.575  -4.097 -15.336
  291   3HD1  LEU  42          3HD1      LEU  42   3.896  -3.703 -13.629
  292   1HD2  LEU  42          1HD2      LEU  42   5.061  -5.595 -12.095
  293   2HD2  LEU  42          2HD2      LEU  42   5.404  -7.178 -12.836
  294   3HD2  LEU  42          3HD2      LEU  42   6.322  -5.749 -13.346
  295    H    GLY  43           H        GLY  43   6.087  -9.020 -16.613
  296   1HA   GLY  43          1HA       GLY  43   7.536 -10.865 -15.957
  297   2HA   GLY  43          2HA       GLY  43   7.295 -10.193 -14.340
  298    H    THR  44           H        THR  44   8.936  -8.632 -17.064
  299    HA   THR  44           HA       THR  44  11.652  -9.362 -16.637
  300    HB   THR  44           HB       THR  44  10.485  -6.785 -17.757
  301    HG1  THR  44           HG1      THR  44  10.636  -7.838 -19.494
  302   1HG2  THR  44          1HG2      THR  44  12.749  -6.160 -18.617
  303   2HG2  THR  44          2HG2      THR  44  12.688  -6.068 -16.845
  304   3HG2  THR  44          3HG2      THR  44  13.492  -7.448 -17.636
  305    H    VAL  45           H        VAL  45  10.016  -6.467 -15.322
  306    HA   VAL  45           HA       VAL  45  12.239  -5.474 -13.713
  307    HB   VAL  45           HB       VAL  45   9.354  -4.794 -13.961
  308   1HG1  VAL  45          1HG1      VAL  45   9.220  -3.442 -11.868
  309   2HG1  VAL  45          2HG1      VAL  45   9.381  -5.160 -11.481
  310   3HG1  VAL  45          3HG1      VAL  45  10.789  -4.088 -11.318
  311   1HG2  VAL  45          1HG2      VAL  45  11.853  -3.029 -13.517
  312   2HG2  VAL  45          2HG2      VAL  45  11.114  -3.408 -15.090
  313   3HG2  VAL  45          3HG2      VAL  45  10.215  -2.445 -13.909
  314    H    MET  46           H        MET  46   9.575  -7.717 -13.068
  315    HA   MET  46           HA       MET  46   9.753  -7.975 -10.182
  316   1HB   MET  46          1HB       MET  46   8.871 -10.091 -12.232
  317   2HB   MET  46          2HB       MET  46   8.734 -10.286 -10.494
  318   1HG   MET  46          1HG       MET  46   7.427  -7.837 -10.817
  319   2HG   MET  46          2HG       MET  46   7.048  -8.639 -12.350
  320   1HE   MET  46          1HE       MET  46   6.147  -8.245  -8.657
  321   2HE   MET  46          2HE       MET  46   5.618  -9.865  -8.115
  322   3HE   MET  46          3HE       MET  46   7.355  -9.541  -8.387
  323    NH1  ARG  47           NH1      ARG  47  16.342 -10.773 -15.594
  324    NH2  ARG  47           NH2      ARG  47  17.991 -12.011 -14.637
  325    H    ARG  47           H        ARG  47  11.555  -9.470 -12.820
  326    HA   ARG  47           HA       ARG  47  12.951 -11.596 -11.370
  327   1HB   ARG  47          1HB       ARG  47  14.674 -10.629 -13.485
  328   2HB   ARG  47          2HB       ARG  47  13.016 -10.466 -14.048
  329   1HG   ARG  47          1HG       ARG  47  12.532 -12.819 -13.791
  330   2HG   ARG  47          2HG       ARG  47  13.952 -13.094 -12.780
  331   1HD   ARG  47          1HD       ARG  47  14.094 -13.874 -15.291
  332   2HD   ARG  47          2HD       ARG  47  14.209 -12.171 -15.704
  333    HE   ARG  47           HE       ARG  47  16.327 -13.663 -14.133
  334   1HH1  ARG  47          1HH1      ARG  47  15.348 -10.694 -15.833
  335   2HH1  ARG  47          2HH1      ARG  47  17.079 -10.088 -15.795
  336   1HH2  ARG  47          1HH2      ARG  47  18.257 -12.873 -14.148
  337   2HH2  ARG  47          2HH2      ARG  47  18.612 -11.239 -14.905
  338    H    MET  48           H        MET  48  13.965  -8.294 -12.284
  339    HA   MET  48           HA       MET  48  16.547  -8.091 -11.084
  340   1HB   MET  48          1HB       MET  48  15.065  -6.243 -12.357
  341   2HB   MET  48          2HB       MET  48  16.457  -5.836 -11.370
  342   1HG   MET  48          1HG       MET  48  14.020  -5.881  -9.686
  343   2HG   MET  48          2HG       MET  48  13.810  -4.816 -11.086
  344   1HE   MET  48          1HE       MET  48  14.372  -2.361 -10.903
  345   2HE   MET  48          2HE       MET  48  16.020  -1.813 -10.482
  346   3HE   MET  48          3HE       MET  48  15.780  -2.954 -11.837
  347    H    LEU  49           H        LEU  49  13.370  -8.073  -9.568
  348    HA   LEU  49           HA       LEU  49  13.842  -7.011  -6.964
  349   1HB   LEU  49          1HB       LEU  49  12.127  -9.517  -7.413
  350   2HB   LEU  49          2HB       LEU  49  11.624  -7.942  -7.986
  351    HG   LEU  49           HG       LEU  49  10.515  -7.864  -5.984
  352   1HD1  LEU  49          1HD1      LEU  49  11.084  -9.188  -3.946
  353   2HD1  LEU  49          2HD1      LEU  49  11.055 -10.229  -5.380
  354   3HD1  LEU  49          3HD1      LEU  49  12.615  -9.722  -4.686
  355   1HD2  LEU  49          1HD2      LEU  49  13.322  -7.133  -4.904
  356   2HD2  LEU  49          2HD2      LEU  49  12.169  -6.013  -5.671
  357   3HD2  LEU  49          3HD2      LEU  49  11.773  -6.751  -4.112
  358    H    GLY  50           H        GLY  50  14.174 -10.432  -7.966
  359   1HA   GLY  50          1HA       GLY  50  16.637 -11.337  -7.234
  360   2HA   GLY  50          2HA       GLY  50  16.049 -10.958  -5.610
  361    H    GLN  51           H        GLN  51  14.477 -12.433  -8.454
  362    HA   GLN  51           HA       GLN  51  14.051 -15.098  -7.086
  363   1HB   GLN  51          1HB       GLN  51  11.978 -12.988  -7.018
  364   2HB   GLN  51          2HB       GLN  51  11.407 -14.422  -7.851
  365   1HG   GLN  51          1HG       GLN  51  12.203 -14.091  -4.943
  366   2HG   GLN  51          2HG       GLN  51  12.503 -15.658  -5.659
  367   1HE2  GLN  51          1HE2      GLN  51   8.494 -14.711  -6.034
  368   2HE2  GLN  51          2HE2      GLN  51   9.799 -13.619  -6.721
  369    H    ASN  52           H        ASN  52  12.026 -16.005  -8.720
  370    HA   ASN  52           HA       ASN  52  12.661 -15.349 -11.583
  371   1HB   ASN  52          1HB       ASN  52  14.261 -17.234 -10.617
  372   2HB   ASN  52          2HB       ASN  52  12.891 -18.305 -10.810
  373   1HD2  ASN  52          1HD2      ASN  52  14.939 -18.450 -13.969
  374   2HD2  ASN  52          2HD2      ASN  52  15.234 -18.738 -12.181
  375    HA   PRO  53           HA       PRO  53   8.121 -16.521 -10.909
  376   1HB   PRO  53          1HB       PRO  53   7.519 -14.256 -10.749
  377   2HB   PRO  53          2HB       PRO  53   6.987 -14.531 -12.416
  378   1HG   PRO  53          1HG       PRO  53   8.878 -13.561 -13.407
  379   2HG   PRO  53          2HG       PRO  53   8.822 -12.571 -11.929
  380   1HD   PRO  53          1HD       PRO  53  10.702 -13.725 -10.989
  381   2HD   PRO  53          2HD       PRO  53  11.028 -14.177 -12.688
  382    H    THR  54           H        THR  54   6.290 -16.704 -12.695
  383    HA   THR  54           HA       THR  54   7.427 -17.844 -15.300
  384    HB   THR  54           HB       THR  54   6.432 -19.451 -13.292
  385    HG1  THR  54           HG1      THR  54   6.490 -20.990 -14.856
  386   1HG2  THR  54          1HG2      THR  54   4.291 -20.435 -14.042
  387   2HG2  THR  54          2HG2      THR  54   4.049 -18.726 -13.615
  388   3HG2  THR  54          3HG2      THR  54   4.129 -19.215 -15.327
  389    H    LYS  55           H        LYS  55   5.438 -18.295 -16.810
  390    HA   LYS  55           HA       LYS  55   4.364 -15.584 -17.448
  391   1HB   LYS  55          1HB       LYS  55   3.376 -17.887 -19.102
  392   2HB   LYS  55          2HB       LYS  55   4.046 -16.349 -19.604
  393   1HG   LYS  55          1HG       LYS  55   5.518 -18.913 -18.884
  394   2HG   LYS  55          2HG       LYS  55   5.562 -18.020 -20.393
  395   1HD   LYS  55          1HD       LYS  55   7.036 -17.438 -17.765
  396   2HD   LYS  55          2HD       LYS  55   7.676 -17.572 -19.395
  397   1HE   LYS  55          1HE       LYS  55   5.781 -15.268 -18.783
  398   2HE   LYS  55          2HE       LYS  55   7.441 -15.168 -18.201
  399   1HZ   LYS  55          1HZ       LYS  55   6.431 -15.114 -20.954
  400   2HZ   LYS  55          2HZ       LYS  55   7.905 -15.827 -20.732
  401   3HZ   LYS  55          3HZ       LYS  55   7.668 -14.259 -20.270
  402    H    GLU  56           H        GLU  56   3.136 -18.712 -16.347
  403    HA   GLU  56           HA       GLU  56   0.248 -18.071 -16.608
  404   1HB   GLU  56          1HB       GLU  56   1.812 -20.382 -15.420
  405   2HB   GLU  56          2HB       GLU  56   0.127 -20.198 -14.975
  406   1HG   GLU  56          1HG       GLU  56   0.946 -20.217 -17.937
  407   2HG   GLU  56          2HG       GLU  56   0.820 -21.722 -17.043
  408    H    GLU  57           H        GLU  57   2.709 -17.899 -14.090
  409    HA   GLU  57           HA       GLU  57   0.961 -17.530 -11.749
  410   1HB   GLU  57          1HB       GLU  57   3.621 -18.035 -11.997
  411   2HB   GLU  57          2HB       GLU  57   2.807 -17.562 -10.521
  412   1HG   GLU  57          1HG       GLU  57   4.653 -15.902 -12.304
  413   2HG   GLU  57          2HG       GLU  57   3.443 -15.041 -11.362
  414    H    LEU  58           H        LEU  58   2.564 -15.313 -14.011
  415    HA   LEU  58           HA       LEU  58   2.033 -12.805 -12.632
  416   1HB   LEU  58          1HB       LEU  58   2.563 -13.377 -15.604
  417   2HB   LEU  58          2HB       LEU  58   2.443 -11.762 -14.936
  418    HG   LEU  58           HG       LEU  58   4.423 -13.731 -13.685
  419   1HD1  LEU  58          1HD1      LEU  58   4.717 -10.698 -14.202
  420   2HD1  LEU  58          2HD1      LEU  58   4.076 -11.369 -12.695
  421   3HD1  LEU  58          3HD1      LEU  58   5.754 -11.722 -13.176
  422   1HD2  LEU  58          1HD2      LEU  58   6.144 -13.226 -15.379
  423   2HD2  LEU  58          2HD2      LEU  58   4.714 -13.890 -16.208
  424   3HD2  LEU  58          3HD2      LEU  58   5.033 -12.146 -16.258
  425    H    ASP  59           H        ASP  59   0.197 -14.752 -14.926
  426    HA   ASP  59           HA       ASP  59  -1.851 -12.981 -15.833
  427   1HB   ASP  59          1HB       ASP  59  -2.099 -15.981 -15.235
  428   2HB   ASP  59          2HB       ASP  59  -1.657 -15.238 -16.754
  429    H    ALA  60           H        ALA  60  -1.492 -14.615 -12.736
  430    HA   ALA  60           HA       ALA  60  -4.199 -14.043 -11.671
  431   1HB   ALA  60          1HB       ALA  60  -3.288 -14.873  -9.507
  432   2HB   ALA  60          2HB       ALA  60  -2.882 -15.967 -10.844
  433   3HB   ALA  60          3HB       ALA  60  -1.637 -14.885 -10.170
  434    H    ILE  61           H        ILE  61  -0.950 -12.664 -11.131
  435    HA   ILE  61           HA       ILE  61  -1.382 -10.635  -9.211
  436    HB   ILE  61           HB       ILE  61   0.485 -10.617 -11.613
  437   1HG1  ILE  61          1HG1      ILE  61   1.027 -10.929  -8.584
  438   2HG1  ILE  61          2HG1      ILE  61   2.192 -11.108  -9.888
  439   1HG2  ILE  61          1HG2      ILE  61   1.721  -8.692 -10.579
  440   2HG2  ILE  61          2HG2      ILE  61   0.103  -8.205 -11.079
  441   3HG2  ILE  61          3HG2      ILE  61   0.438  -8.506  -9.358
  442   1HD1  ILE  61          1HD1      ILE  61   1.137 -13.182 -10.706
  443   2HD1  ILE  61          2HD1      ILE  61   1.495 -13.315  -8.971
  444   3HD1  ILE  61          3HD1      ILE  61  -0.175 -13.017  -9.507
  445    H    ILE  62           H        ILE  62  -2.211 -10.655 -12.656
  446    HA   ILE  62           HA       ILE  62  -3.156  -7.800 -12.723
  447    HB   ILE  62           HB       ILE  62  -2.984  -9.998 -14.816
  448   1HG1  ILE  62          1HG1      ILE  62  -1.640  -7.289 -14.356
  449   2HG1  ILE  62          2HG1      ILE  62  -0.907  -8.847 -14.675
  450   1HG2  ILE  62          1HG2      ILE  62  -4.067  -8.506 -16.520
  451   2HG2  ILE  62          2HG2      ILE  62  -5.214  -8.913 -15.246
  452   3HG2  ILE  62          3HG2      ILE  62  -4.448  -7.308 -15.258
  453   1HD1  ILE  62          1HD1      ILE  62  -2.337  -7.143 -16.800
  454   2HD1  ILE  62          2HD1      ILE  62  -0.595  -7.448 -16.640
  455   3HD1  ILE  62          3HD1      ILE  62  -1.687  -8.782 -17.078
  456    H    GLU  63           H        GLU  63  -4.460 -11.086 -12.591
  457    HA   GLU  63           HA       GLU  63  -7.258 -10.726 -12.915
  458   1HB   GLU  63          1HB       GLU  63  -6.037 -12.917 -12.475
  459   2HB   GLU  63          2HB       GLU  63  -6.045 -12.541 -10.763
  460   1HG   GLU  63          1HG       GLU  63  -8.384 -12.896 -10.543
  461   2HG   GLU  63          2HG       GLU  63  -8.725 -12.495 -12.218
  462    H    GLU  64           H        GLU  64  -5.209  -9.920 -10.156
  463    HA   GLU  64           HA       GLU  64  -7.190  -9.332  -8.106
  464   1HB   GLU  64          1HB       GLU  64  -4.310  -8.723  -8.534
  465   2HB   GLU  64          2HB       GLU  64  -5.140  -7.488  -7.608
  466   1HG   GLU  64          1HG       GLU  64  -4.007  -9.436  -6.299
  467   2HG   GLU  64          2HG       GLU  64  -5.621  -8.962  -5.797
  468    H    VAL  65           H        VAL  65  -5.359  -6.877  -9.951
  469    HA   VAL  65           HA       VAL  65  -7.550  -4.838  -9.806
  470    HB   VAL  65           HB       VAL  65  -6.136  -3.333 -11.043
  471   1HG1  VAL  65          1HG1      VAL  65  -4.052  -5.559 -11.518
  472   2HG1  VAL  65          2HG1      VAL  65  -5.225  -5.033 -12.740
  473   3HG1  VAL  65          3HG1      VAL  65  -4.011  -3.885 -12.124
  474   1HG2  VAL  65          1HG2      VAL  65  -4.224  -3.077  -9.540
  475   2HG2  VAL  65          2HG2      VAL  65  -5.541  -3.770  -8.563
  476   3HG2  VAL  65          3HG2      VAL  65  -4.221  -4.807  -9.120
  477    H    ASP  66           H        ASP  66  -7.167  -3.895 -12.550
  478    HA   ASP  66           HA       ASP  66  -7.980  -4.204 -14.796
  479   1HB   ASP  66          1HB       ASP  66  -7.000  -6.818 -14.144
  480   2HB   ASP  66          2HB       ASP  66  -8.602  -7.072 -14.795
  481    H    GLU  67           H        GLU  67  -9.603  -3.092 -13.261
  482    HA   GLU  67           HA       GLU  67 -12.214  -4.475 -12.749
  483   1HB   GLU  67          1HB       GLU  67 -12.895  -1.852 -12.533
  484   2HB   GLU  67          2HB       GLU  67 -12.222  -2.816 -11.233
  485   1HG   GLU  67          1HG       GLU  67 -10.276  -1.313 -13.047
  486   2HG   GLU  67          2HG       GLU  67 -11.242  -0.379 -11.918
  487    H    ASP  68           H        ASP  68 -10.695  -2.507 -15.236
  488    HA   ASP  68           HA       ASP  68 -13.190  -2.095 -16.849
  489   1HB   ASP  68          1HB       ASP  68 -11.761  -0.268 -17.139
  490   2HB   ASP  68          2HB       ASP  68 -11.570  -1.170 -18.625
  491    H    GLY  69           H        GLY  69 -10.421  -4.266 -16.774
  492   1HA   GLY  69          1HA       GLY  69 -10.330  -6.582 -17.622
  493   2HA   GLY  69          2HA       GLY  69 -11.881  -6.314 -18.429
  494    H    SER  70           H        SER  70  -8.959  -4.317 -18.646
  495    HA   SER  70           HA       SER  70  -9.010  -4.312 -21.652
  496   1HB   SER  70          1HB       SER  70  -7.160  -2.681 -21.485
  497   2HB   SER  70          2HB       SER  70  -8.531  -2.214 -20.474
  498    HG   SER  70           HG       SER  70  -6.742  -1.988 -19.268
  499    H    GLY  71           H        GLY  71  -7.170  -5.751 -19.011
  500   1HA   GLY  71          1HA       GLY  71  -5.851  -7.765 -20.844
  501   2HA   GLY  71          2HA       GLY  71  -5.790  -7.779 -19.076
  502    H    THR  72           H        THR  72  -5.058  -4.961 -18.866
  503    HA   THR  72           HA       THR  72  -2.084  -5.184 -19.121
  504    HB   THR  72           HB       THR  72  -1.767  -3.126 -20.501
  505    HG1  THR  72           HG1      THR  72  -3.614  -2.680 -21.899
  506   1HG2  THR  72          1HG2      THR  72  -2.129  -4.090 -22.737
  507   2HG2  THR  72          2HG2      THR  72  -1.514  -5.360 -21.656
  508   3HG2  THR  72          3HG2      THR  72  -3.240  -5.323 -22.100
  509    H    ILE  73           H        ILE  73  -1.215  -2.788 -18.598
  510    HA   ILE  73           HA       ILE  73  -2.836  -1.587 -16.298
  511    HB   ILE  73           HB       ILE  73   0.038  -2.588 -16.137
  512   1HG1  ILE  73          1HG1      ILE  73  -0.716  -3.693 -14.044
  513   2HG1  ILE  73          2HG1      ILE  73  -2.291  -2.938 -14.146
  514   1HG2  ILE  73          1HG2      ILE  73   0.389  -1.317 -14.024
  515   2HG2  ILE  73          2HG2      ILE  73   0.043  -0.188 -15.341
  516   3HG2  ILE  73          3HG2      ILE  73  -1.222  -0.571 -14.148
  517   1HD1  ILE  73          1HD1      ILE  73  -1.271  -5.069 -16.113
  518   2HD1  ILE  73          2HD1      ILE  73  -2.506  -5.259 -14.851
  519   3HD1  ILE  73          3HD1      ILE  73  -2.831  -4.215 -16.254
  520    H    ASP  74           H        ASP  74  -3.348  -0.172 -18.100
  521    HA   ASP  74           HA       ASP  74  -1.335   1.472 -19.510
  522   1HB   ASP  74          1HB       ASP  74  -4.142   2.550 -19.185
  523   2HB   ASP  74          2HB       ASP  74  -3.070   2.600 -20.565
  524    H    PHE  75           H        PHE  75  -1.042   3.769 -19.223
  525    HA   PHE  75           HA       PHE  75  -0.137   4.618 -16.621
  526   1HB   PHE  75          1HB       PHE  75  -1.160   6.589 -18.745
  527   2HB   PHE  75          2HB       PHE  75   0.315   5.688 -18.973
  528    HD1  PHE  75           HD1      PHE  75  -1.218   8.550 -17.288
  529    HD2  PHE  75           HD2      PHE  75   2.272   6.032 -17.309
  530    HE1  PHE  75           HE1      PHE  75  -0.003  10.205 -15.932
  531    HE2  PHE  75           HE2      PHE  75   3.468   7.699 -15.946
  532    HZ   PHE  75           HZ       PHE  75   2.336   9.781 -15.253
  533    H    GLU  76           H        GLU  76  -3.330   4.634 -18.071
  534    HA   GLU  76           HA       GLU  76  -4.573   6.423 -15.986
  535   1HB   GLU  76          1HB       GLU  76  -6.641   6.183 -17.297
  536   2HB   GLU  76          2HB       GLU  76  -5.910   4.961 -18.314
  537   1HG   GLU  76          1HG       GLU  76  -4.135   6.890 -18.915
  538   2HG   GLU  76          2HG       GLU  76  -5.684   6.772 -19.723
  539    H    GLU  77           H        GLU  77  -3.411   4.111 -14.939
  540    HA   GLU  77           HA       GLU  77  -5.689   2.856 -13.456
  541   1HB   GLU  77          1HB       GLU  77  -5.739   1.486 -15.506
  542   2HB   GLU  77          2HB       GLU  77  -4.043   1.093 -15.333
  543   1HG   GLU  77          1HG       GLU  77  -5.899   0.368 -13.024
  544   2HG   GLU  77          2HG       GLU  77  -4.411  -0.422 -13.532
  545    H    PHE  78           H        PHE  78  -2.239   2.756 -14.307
  546    HA   PHE  78           HA       PHE  78  -1.203   1.476 -11.924
  547   1HB   PHE  78          1HB       PHE  78   0.149   1.840 -14.003
  548   2HB   PHE  78          2HB       PHE  78   0.183   3.563 -13.728
  549    HD1  PHE  78           HD1      PHE  78   1.621   4.487 -11.821
  550    HD2  PHE  78           HD2      PHE  78   1.573   0.283 -12.735
  551    HE1  PHE  78           HE1      PHE  78   3.690   4.170 -10.525
  552    HE2  PHE  78           HE2      PHE  78   3.652  -0.011 -11.453
  553    HZ   PHE  78           HZ       PHE  78   4.708   1.925 -10.338
  554    H    LEU  79           H        LEU  79  -2.089   4.809 -12.632
  555    HA   LEU  79           HA       LEU  79  -0.903   6.090 -10.254
  556   1HB   LEU  79          1HB       LEU  79  -2.894   6.945 -12.381
  557   2HB   LEU  79          2HB       LEU  79  -2.870   7.865 -10.892
  558    HG   LEU  79           HG       LEU  79  -0.160   7.864 -11.450
  559   1HD1  LEU  79          1HD1      LEU  79  -2.159   9.894 -12.628
  560   2HD1  LEU  79          2HD1      LEU  79  -1.669   9.849 -10.924
  561   3HD1  LEU  79          3HD1      LEU  79  -0.460  10.198 -12.184
  562   1HD2  LEU  79          1HD2      LEU  79   0.254   8.207 -13.849
  563   2HD2  LEU  79          2HD2      LEU  79  -0.573   6.639 -13.680
  564   3HD2  LEU  79          3HD2      LEU  79  -1.479   8.054 -14.234
  565    H    VAL  80           H        VAL  80  -4.097   4.758 -11.029
  566    HA   VAL  80           HA       VAL  80  -5.492   5.580  -8.559
  567    HB   VAL  80           HB       VAL  80  -6.134   3.682 -10.812
  568   1HG1  VAL  80          1HG1      VAL  80  -7.889   5.849  -9.499
  569   2HG1  VAL  80          2HG1      VAL  80  -6.760   6.191 -10.816
  570   3HG1  VAL  80          3HG1      VAL  80  -8.115   5.071 -11.087
  571   1HG2  VAL  80          1HG2      VAL  80  -8.156   2.782  -9.760
  572   2HG2  VAL  80          2HG2      VAL  80  -6.790   2.364  -8.701
  573   3HG2  VAL  80          3HG2      VAL  80  -7.868   3.697  -8.260
  574    H    MET  81           H        MET  81  -3.501   2.848  -9.547
  575    HA   MET  81           HA       MET  81  -3.961   0.937  -7.413
  576   1HB   MET  81          1HB       MET  81  -2.458   0.713  -9.581
  577   2HB   MET  81          2HB       MET  81  -1.175   1.369  -8.582
  578   1HG   MET  81          1HG       MET  81  -2.723  -1.040  -7.513
  579   2HG   MET  81          2HG       MET  81  -1.054  -0.546  -7.185
  580   1HE   MET  81          1HE       MET  81   0.840  -1.807  -8.043
  581   2HE   MET  81          2HE       MET  81   1.077  -2.242  -9.762
  582   3HE   MET  81          3HE       MET  81   0.906  -0.526  -9.294
  583    H    MET  82           H        MET  82  -1.355   3.380  -7.656
  584    HA   MET  82           HA       MET  82  -0.371   2.979  -4.902
  585   1HB   MET  82          1HB       MET  82   0.961   5.128  -5.388
  586   2HB   MET  82          2HB       MET  82   0.197   5.178  -6.966
  587   1HG   MET  82          1HG       MET  82   1.149   2.875  -7.498
  588   2HG   MET  82          2HG       MET  82   2.375   4.120  -7.228
  589   1HE   MET  82          1HE       MET  82   2.911   4.716  -4.530
  590   2HE   MET  82          2HE       MET  82   4.342   3.829  -5.133
  591   3HE   MET  82          3HE       MET  82   3.622   3.391  -3.556
  592    H    VAL  83           H        VAL  83  -2.817   5.012  -6.352
  593    HA   VAL  83           HA       VAL  83  -2.917   7.150  -4.332
  594    HB   VAL  83           HB       VAL  83  -3.995   6.917  -6.829
  595   1HG1  VAL  83          1HG1      VAL  83  -6.490   7.002  -6.695
  596   2HG1  VAL  83          2HG1      VAL  83  -5.891   5.428  -6.153
  597   3HG1  VAL  83          3HG1      VAL  83  -6.432   6.626  -4.954
  598   1HG2  VAL  83          1HG2      VAL  83  -5.023   8.870  -4.665
  599   2HG2  VAL  83          2HG2      VAL  83  -3.577   9.105  -5.674
  600   3HG2  VAL  83          3HG2      VAL  83  -5.178   9.085  -6.428
  601    NH1  ARG  84           NH1      ARG  84  -7.389  -1.493  -4.303
  602    NH2  ARG  84           NH2      ARG  84  -9.328  -1.973  -5.384
  603    H    ARG  84           H        ARG  84  -4.504   4.023  -4.761
  604    HA   ARG  84           HA       ARG  84  -6.656   4.227  -2.772
  605   1HB   ARG  84          1HB       ARG  84  -5.335   1.991  -4.296
  606   2HB   ARG  84          2HB       ARG  84  -6.027   1.530  -2.748
  607   1HG   ARG  84          1HG       ARG  84  -7.808   3.239  -4.488
  608   2HG   ARG  84          2HG       ARG  84  -8.235   1.919  -3.396
  609   1HD   ARG  84          1HD       ARG  84  -6.613   0.722  -5.465
  610   2HD   ARG  84          2HD       ARG  84  -7.723   1.807  -6.304
  611    HE   ARG  84           HE       ARG  84  -9.648   0.517  -5.246
  612   1HH1  ARG  84          1HH1      ARG  84  -6.716  -0.777  -4.008
  613   2HH1  ARG  84          2HH1      ARG  84  -7.318  -2.505  -4.147
  614   1HH2  ARG  84          1HH2      ARG  84 -10.116  -1.629  -5.944
  615   2HH2  ARG  84          2HH2      ARG  84  -9.140  -2.947  -5.121
  616    H    GLN  85           H        GLN  85  -3.497   2.541  -2.553
  617    HA   GLN  85           HA       GLN  85  -3.518   2.009   0.330
  618   1HB   GLN  85          1HB       GLN  85  -1.317   2.103  -1.776
  619   2HB   GLN  85          2HB       GLN  85  -0.881   2.026  -0.079
  620   1HG   GLN  85          1HG       GLN  85  -2.798  -0.022  -0.256
  621   2HG   GLN  85          2HG       GLN  85  -2.060  -0.094  -1.841
  622   1HE2  GLN  85          1HE2      GLN  85   0.556  -0.708   1.356
  623   2HE2  GLN  85          2HE2      GLN  85  -0.830   0.485   1.512
  624    H    MET  86           H        MET  86  -2.549   4.759  -1.646
  625    HA   MET  86           HA       MET  86  -0.924   6.321   0.115
  626   1HB   MET  86          1HB       MET  86  -2.393   6.851  -2.344
  627   2HB   MET  86          2HB       MET  86  -2.694   8.175  -1.233
  628   1HG   MET  86          1HG       MET  86  -0.222   7.536  -2.740
  629   2HG   MET  86          2HG       MET  86   0.121   7.783  -1.019
  630   1HE   MET  86          1HE       MET  86  -3.128   9.382  -2.634
  631   2HE   MET  86          2HE       MET  86  -2.505  10.914  -3.314
  632   3HE   MET  86          3HE       MET  86  -2.056   9.357  -4.069
  633    H    LYS  87           H        LYS  87  -4.473   6.202  -0.141
  634    HA   LYS  87           HA       LYS  87  -5.088   8.044   2.120
  635   1HB   LYS  87          1HB       LYS  87  -6.776   5.960   0.628
  636   2HB   LYS  87          2HB       LYS  87  -7.367   6.742   2.086
  637   1HG   LYS  87          1HG       LYS  87  -8.057   7.782  -0.183
  638   2HG   LYS  87          2HG       LYS  87  -6.414   8.380  -0.336
  639   1HD   LYS  87          1HD       LYS  87  -8.045   8.999   2.188
  640   2HD   LYS  87          2HD       LYS  87  -6.639   9.843   1.549
  641   1HE   LYS  87          1HE       LYS  87  -7.931  10.860  -0.281
  642   2HE   LYS  87          2HE       LYS  87  -9.324   9.813   0.021
  643   1HZ   LYS  87          1HZ       LYS  87  -8.437  12.164   1.515
  644   2HZ   LYS  87          2HZ       LYS  87  -9.133  10.954   2.399
  645   3HZ   LYS  87          3HZ       LYS  87  -9.968  11.654   1.157
  646    H    GLU  88           H        GLU  88  -3.755   7.364   3.784
  647    HA   GLU  88           HA       GLU  88  -4.609   4.810   5.229
  648   1HB   GLU  88          1HB       GLU  88  -2.600   4.002   4.425
  649   2HB   GLU  88          2HB       GLU  88  -1.811   5.567   4.397
  650   1HG   GLU  88          1HG       GLU  88  -0.660   4.662   6.189
  651   2HG   GLU  88          2HG       GLU  88  -2.000   5.330   7.104
  652    H    ASP  89           H        ASP  89  -2.911   7.936   5.387
  653    HA   ASP  89           HA       ASP  89  -2.646   9.577   7.129
  654   1HB   ASP  89          1HB       ASP  89  -5.357   8.453   8.038
  655   2HB   ASP  89          2HB       ASP  89  -4.591   9.866   8.729
  656    H    ALA  90           H        ALA  90  -0.973   7.682   7.474
  657    HA   ALA  90           HA       ALA  90   0.458   6.568   9.068
  658   1HB   ALA  90          1HB       ALA  90   0.449   7.500  11.397
  659   2HB   ALA  90          2HB       ALA  90   0.406   8.807  10.197
  660   3HB   ALA  90          3HB       ALA  90  -1.077   8.363  11.077
   
  Start of MODEL           6
 Raw file had  660 H/Q atoms
  Start of MODEL    6
    1   1H    ALA   1          1H        ALA   1 -24.958   1.638 -18.369
    2   2H    ALA   1          2H        ALA   1 -23.597   0.982 -19.106
    3   3H    ALA   1          3H        ALA   1 -23.979   0.564 -17.523
    4    HA   ALA   1           HA       ALA   1 -23.401   3.332 -18.365
    5   1HB   ALA   1          1HB       ALA   1 -23.057   2.204 -15.543
    6   2HB   ALA   1          2HB       ALA   1 -24.678   2.638 -16.120
    7   3HB   ALA   1          3HB       ALA   1 -23.399   3.877 -16.042
    8    H    SER   2           H        SER   2 -21.279   3.629 -16.573
    9    HA   SER   2           HA       SER   2 -19.101   1.649 -17.185
   10   1HB   SER   2          1HB       SER   2 -19.509   3.223 -19.293
   11   2HB   SER   2          2HB       SER   2 -18.586   4.405 -18.361
   12    HG   SER   2           HG       SER   2 -17.556   1.837 -18.373
   13    H    MET   3           H        MET   3 -19.400   5.162 -16.541
   14    HA   MET   3           HA       MET   3 -18.791   6.506 -14.633
   15   1HB   MET   3          1HB       MET   3 -19.560   4.157 -13.467
   16   2HB   MET   3          2HB       MET   3 -17.871   4.140 -12.994
   17   1HG   MET   3          1HG       MET   3 -18.134   6.394 -11.893
   18   2HG   MET   3          2HG       MET   3 -19.818   6.466 -12.429
   19   1HE   MET   3          1HE       MET   3 -20.661   5.951  -8.840
   20   2HE   MET   3          2HE       MET   3 -21.759   5.652 -10.219
   21   3HE   MET   3          3HE       MET   3 -20.579   6.993 -10.296
   22    H    THR   4           H        THR   4 -17.011   7.652 -14.730
   23    HA   THR   4           HA       THR   4 -14.290   6.285 -14.904
   24    HB   THR   4           HB       THR   4 -13.402   7.734 -16.429
   25    HG1  THR   4           HG1      THR   4 -15.451   9.473 -15.640
   26   1HG2  THR   4          1HG2      THR   4 -15.405   8.321 -18.191
   27   2HG2  THR   4          2HG2      THR   4 -16.240   7.067 -17.246
   28   3HG2  THR   4          3HG2      THR   4 -14.698   6.696 -18.060
   29    H    ASP   5           H        ASP   5 -15.759   6.994 -12.553
   30    HA   ASP   5           HA       ASP   5 -14.706   9.592 -11.460
   31   1HB   ASP   5          1HB       ASP   5 -16.747   7.579 -10.521
   32   2HB   ASP   5          2HB       ASP   5 -15.887   8.445  -9.269
   33    H    GLN   6           H        GLN   6 -14.066   6.155 -11.259
   34    HA   GLN   6           HA       GLN   6 -12.421   5.962  -8.883
   35   1HB   GLN   6          1HB       GLN   6 -13.039   3.888  -9.794
   36   2HB   GLN   6          2HB       GLN   6 -12.603   4.335 -11.432
   37   1HG   GLN   6          1HG       GLN   6 -10.096   4.377 -10.489
   38   2HG   GLN   6          2HG       GLN   6 -10.754   3.439  -9.166
   39   1HE2  GLN   6          1HE2      GLN   6  -9.809   1.522 -12.587
   40   2HE2  GLN   6          2HE2      GLN   6  -9.160   3.132 -11.992
   41    H    GLN   7           H        GLN   7 -11.146   5.969 -12.224
   42    HA   GLN   7           HA       GLN   7  -8.371   6.597 -11.465
   43   1HB   GLN   7          1HB       GLN   7  -8.931   5.441 -13.623
   44   2HB   GLN   7          2HB       GLN   7  -7.886   6.841 -13.823
   45   1HG   GLN   7          1HG       GLN   7  -9.977   6.405 -15.460
   46   2HG   GLN   7          2HG       GLN   7 -10.879   7.267 -14.223
   47   1HE2  GLN   7          1HE2      GLN   7  -9.792  10.347 -15.704
   48   2HE2  GLN   7          2HE2      GLN   7 -11.127   9.318 -14.980
   49    H    ALA   8           H        ALA   8 -11.069   8.553 -12.732
   50    HA   ALA   8           HA       ALA   8  -9.743  11.104 -13.132
   51   1HB   ALA   8          1HB       ALA   8 -12.013  12.113 -12.973
   52   2HB   ALA   8          2HB       ALA   8 -12.028  10.645 -13.969
   53   3HB   ALA   8          3HB       ALA   8 -12.675  10.601 -12.309
   54    H    GLU   9           H        GLU   9 -10.889   9.484 -10.236
   55    HA   GLU   9           HA       GLU   9 -10.896  11.829  -8.419
   56   1HB   GLU   9          1HB       GLU   9 -11.754  10.465  -6.805
   57   2HB   GLU   9          2HB       GLU   9 -12.111   9.443  -8.190
   58   1HG   GLU   9          1HG       GLU   9 -10.930   7.731  -7.303
   59   2HG   GLU   9          2HG       GLU   9  -9.444   8.673  -7.342
   60    H    ALA  10           H        ALA  10  -8.572   9.340  -9.325
   61    HA   ALA  10           HA       ALA  10  -6.567   9.909  -7.221
   62   1HB   ALA  10          1HB       ALA  10  -5.083   8.396  -8.526
   63   2HB   ALA  10          2HB       ALA  10  -6.693   7.686  -8.303
   64   3HB   ALA  10          3HB       ALA  10  -6.238   8.380  -9.880
   65    NH1  ARG  11           NH1      ARG  11  -5.165   9.727 -15.674
   66    NH2  ARG  11           NH2      ARG  11  -6.140  10.769 -17.442
   67    H    ARG  11           H        ARG  11  -7.185  11.038 -10.494
   68    HA   ARG  11           HA       ARG  11  -4.554  12.359 -10.986
   69   1HB   ARG  11          1HB       ARG  11  -6.296  11.501 -12.765
   70   2HB   ARG  11          2HB       ARG  11  -7.161  12.998 -12.454
   71   1HG   ARG  11          1HG       ARG  11  -5.848  14.112 -13.899
   72   2HG   ARG  11          2HG       ARG  11  -4.436  13.813 -12.883
   73   1HD   ARG  11          1HD       ARG  11  -3.827  12.907 -15.015
   74   2HD   ARG  11          2HD       ARG  11  -4.212  11.485 -14.044
   75    HE   ARG  11           HE       ARG  11  -6.445  12.623 -15.767
   76   1HH1  ARG  11          1HH1      ARG  11  -4.797   9.801 -14.720
   77   2HH1  ARG  11          2HH1      ARG  11  -5.194   8.884 -16.258
   78   1HH2  ARG  11          1HH2      ARG  11  -6.487  11.645 -17.848
   79   2HH2  ARG  11          2HH2      ARG  11  -6.126   9.847 -17.891
   80    H    ALA  12           H        ALA  12  -7.793  13.372  -9.946
   81    HA   ALA  12           HA       ALA  12  -7.297  16.294  -9.893
   82   1HB   ALA  12          1HB       ALA  12  -9.440  16.438  -8.641
   83   2HB   ALA  12          2HB       ALA  12  -9.598  15.397 -10.070
   84   3HB   ALA  12          3HB       ALA  12  -9.482  14.668  -8.448
   85    H    PHE  13           H        PHE  13  -6.983  13.629  -7.593
   86    HA   PHE  13           HA       PHE  13  -6.561  15.220  -5.150
   87   1HB   PHE  13          1HB       PHE  13  -5.902  12.297  -5.809
   88   2HB   PHE  13          2HB       PHE  13  -7.359  12.892  -5.058
   89    HD1  PHE  13           HD1      PHE  13  -5.011  14.961  -3.540
   90    HD2  PHE  13           HD2      PHE  13  -6.032  10.780  -3.650
   91    HE1  PHE  13           HE1      PHE  13  -3.991  14.642  -1.323
   92    HE2  PHE  13           HE2      PHE  13  -5.008  10.483  -1.433
   93    HZ   PHE  13           HZ       PHE  13  -3.983  12.406  -0.268
   94    H    LEU  14           H        LEU  14  -4.405  13.563  -7.457
   95    HA   LEU  14           HA       LEU  14  -1.864  14.558  -6.199
   96   1HB   LEU  14          1HB       LEU  14  -2.103  13.253  -8.963
   97   2HB   LEU  14          2HB       LEU  14  -0.681  13.362  -7.947
   98    HG   LEU  14           HG       LEU  14  -3.077  11.826  -6.856
   99   1HD1  LEU  14          1HD1      LEU  14  -2.375   9.749  -8.051
  100   2HD1  LEU  14          2HD1      LEU  14  -2.887  10.993  -9.205
  101   3HD1  LEU  14          3HD1      LEU  14  -1.153  10.660  -8.974
  102   1HD2  LEU  14          1HD2      LEU  14  -0.025  11.366  -6.632
  103   2HD2  LEU  14          2HD2      LEU  14  -1.074  12.075  -5.379
  104   3HD2  LEU  14          3HD2      LEU  14  -1.285  10.381  -5.846
  105    H    SER  15           H        SER  15  -0.284  15.719  -7.588
  106    HA   SER  15           HA       SER  15  -1.617  18.076  -9.005
  107   1HB   SER  15          1HB       SER  15   0.805  19.094  -8.576
  108   2HB   SER  15          2HB       SER  15   0.938  17.801  -7.381
  109    HG   SER  15           HG       SER  15  -1.413  19.329  -7.475
  110    H    GLU  16           H        GLU  16   0.262  19.115 -10.505
  111    HA   GLU  16           HA       GLU  16   0.582  17.230 -12.806
  112   1HB   GLU  16          1HB       GLU  16   1.127  20.208 -12.448
  113   2HB   GLU  16          2HB       GLU  16  -0.139  19.433 -13.379
  114   1HG   GLU  16          1HG       GLU  16   2.072  18.433 -14.717
  115   2HG   GLU  16          2HG       GLU  16   2.763  19.923 -14.099
  116    H    GLU  17           H        GLU  17   2.581  18.817 -10.384
  117    HA   GLU  17           HA       GLU  17   5.208  17.920 -11.568
  118   1HB   GLU  17          1HB       GLU  17   4.547  19.490  -9.028
  119   2HB   GLU  17          2HB       GLU  17   6.171  18.945  -9.398
  120   1HG   GLU  17          1HG       GLU  17   5.420  21.400 -10.053
  121   2HG   GLU  17          2HG       GLU  17   6.458  20.498 -11.144
  122    H    MET  18           H        MET  18   3.041  17.161  -8.868
  123    HA   MET  18           HA       MET  18   4.715  15.178  -7.459
  124   1HB   MET  18          1HB       MET  18   1.711  15.746  -7.434
  125   2HB   MET  18          2HB       MET  18   2.349  14.309  -6.656
  126   1HG   MET  18          1HG       MET  18   4.029  16.124  -5.481
  127   2HG   MET  18          2HG       MET  18   2.676  17.209  -5.841
  128   1HE   MET  18          1HE       MET  18   0.569  14.372  -5.880
  129   2HE   MET  18          2HE       MET  18  -0.257  14.680  -4.324
  130   3HE   MET  18          3HE       MET  18  -0.017  16.018  -5.485
  131    H    ILE  19           H        ILE  19   2.422  15.079 -10.144
  132    HA   ILE  19           HA       ILE  19   2.137  12.149 -10.348
  133    HB   ILE  19           HB       ILE  19   1.334  14.482 -12.062
  134   1HG1  ILE  19          1HG1      ILE  19  -0.067  13.096 -10.218
  135   2HG1  ILE  19          2HG1      ILE  19  -0.325  11.967 -11.531
  136   1HG2  ILE  19          1HG2      ILE  19   0.676  13.054 -14.015
  137   2HG2  ILE  19          2HG2      ILE  19   2.425  13.020 -13.798
  138   3HG2  ILE  19          3HG2      ILE  19   1.447  11.634 -13.265
  139   1HD1  ILE  19          1HD1      ILE  19  -1.451  13.671 -12.936
  140   2HD1  ILE  19          2HD1      ILE  19  -2.210  13.581 -11.334
  141   3HD1  ILE  19          3HD1      ILE  19  -1.118  14.932 -11.718
  142    H    ALA  20           H        ALA  20   4.332  14.583 -11.669
  143    HA   ALA  20           HA       ALA  20   5.716  13.077 -13.704
  144   1HB   ALA  20          1HB       ALA  20   7.564  14.727 -13.441
  145   2HB   ALA  20          2HB       ALA  20   5.978  15.523 -13.449
  146   3HB   ALA  20          3HB       ALA  20   6.862  15.315 -11.916
  147    H    GLU  21           H        GLU  21   6.103  13.139 -10.200
  148    HA   GLU  21           HA       GLU  21   8.684  11.849  -9.842
  149   1HB   GLU  21          1HB       GLU  21   6.398  11.263  -7.931
  150   2HB   GLU  21          2HB       GLU  21   6.960  12.915  -8.095
  151   1HG   GLU  21          1HG       GLU  21   9.045  10.742  -7.574
  152   2HG   GLU  21          2HG       GLU  21   7.973  11.192  -6.259
  153    H    PHE  22           H        PHE  22   5.394  10.524 -10.177
  154    HA   PHE  22           HA       PHE  22   6.250   7.656 -10.055
  155   1HB   PHE  22          1HB       PHE  22   3.489   8.686 -10.931
  156   2HB   PHE  22          2HB       PHE  22   3.906   7.090 -10.367
  157    HD1  PHE  22           HD1      PHE  22   3.621  10.656  -9.185
  158    HD2  PHE  22           HD2      PHE  22   3.969   6.529  -8.011
  159    HE1  PHE  22           HE1      PHE  22   3.114  11.264  -6.857
  160    HE2  PHE  22           HE2      PHE  22   3.463   7.159  -5.687
  161    HZ   PHE  22           HZ       PHE  22   3.044   9.524  -5.103
  162    H    LYS  23           H        LYS  23   5.807  10.101 -12.493
  163    HA   LYS  23           HA       LYS  23   5.289   8.627 -14.918
  164   1HB   LYS  23          1HB       LYS  23   6.105  11.300 -14.299
  165   2HB   LYS  23          2HB       LYS  23   7.357  10.695 -15.361
  166   1HG   LYS  23          1HG       LYS  23   5.107  11.906 -16.270
  167   2HG   LYS  23          2HG       LYS  23   4.471  10.272 -16.198
  168   1HD   LYS  23          1HD       LYS  23   6.937  11.161 -17.817
  169   2HD   LYS  23          2HD       LYS  23   6.434   9.475 -17.653
  170   1HE   LYS  23          1HE       LYS  23   4.048  10.403 -18.526
  171   2HE   LYS  23          2HE       LYS  23   5.021  11.742 -19.151
  172   1HZ   LYS  23          1HZ       LYS  23   6.479   9.738 -20.045
  173   2HZ   LYS  23          2HZ       LYS  23   5.158  10.277 -20.877
  174   3HZ   LYS  23          3HZ       LYS  23   5.048   8.919 -19.943
  175    H    ALA  24           H        ALA  24   8.417   9.378 -13.360
  176    HA   ALA  24           HA       ALA  24  10.194   8.118 -15.285
  177   1HB   ALA  24          1HB       ALA  24  11.904   8.165 -13.480
  178   2HB   ALA  24          2HB       ALA  24  11.017   9.699 -13.566
  179   3HB   ALA  24          3HB       ALA  24  10.657   8.535 -12.265
  180    H    ALA  25           H        ALA  25   9.439   6.868 -12.018
  181    HA   ALA  25           HA       ALA  25  10.455   4.200 -12.249
  182   1HB   ALA  25          1HB       ALA  25   8.965   3.615 -10.345
  183   2HB   ALA  25          2HB       ALA  25   9.743   5.188 -10.090
  184   3HB   ALA  25          3HB       ALA  25   8.029   5.111 -10.574
  185    H    PHE  26           H        PHE  26   7.499   5.579 -13.509
  186    HA   PHE  26           HA       PHE  26   5.832   3.192 -13.809
  187   1HB   PHE  26          1HB       PHE  26   4.676   5.251 -14.049
  188   2HB   PHE  26          2HB       PHE  26   5.799   5.905 -15.210
  189    HD1  PHE  26           HD1      PHE  26   5.726   5.009 -17.643
  190    HD2  PHE  26           HD2      PHE  26   2.773   3.885 -14.724
  191    HE1  PHE  26           HE1      PHE  26   4.295   4.096 -19.427
  192    HE2  PHE  26           HE2      PHE  26   1.352   2.983 -16.521
  193    HZ   PHE  26           HZ       PHE  26   2.121   3.060 -18.868
  194    H    ASP  27           H        ASP  27   7.975   4.877 -16.128
  195    HA   ASP  27           HA       ASP  27   7.727   2.929 -18.328
  196   1HB   ASP  27          1HB       ASP  27   8.465   5.004 -19.108
  197   2HB   ASP  27          2HB       ASP  27   9.903   4.014 -19.193
  198    H    MET  28           H        MET  28   9.821   3.269 -15.522
  199    HA   MET  28           HA       MET  28  11.963   1.429 -16.136
  200   1HB   MET  28          1HB       MET  28  10.911   1.449 -13.286
  201   2HB   MET  28          2HB       MET  28  11.508   2.954 -13.960
  202   1HG   MET  28          1HG       MET  28  13.750   1.964 -14.388
  203   2HG   MET  28          2HG       MET  28  13.177   0.362 -13.893
  204   1HE   MET  28          1HE       MET  28  12.845   4.141 -12.501
  205   2HE   MET  28          2HE       MET  28  13.964   4.012 -11.111
  206   3HE   MET  28          3HE       MET  28  14.584   3.802 -12.775
  207    H    PHE  29           H        PHE  29   8.763   0.847 -14.692
  208    HA   PHE  29           HA       PHE  29   9.130  -2.081 -14.309
  209   1HB   PHE  29          1HB       PHE  29   6.553  -0.397 -14.245
  210   2HB   PHE  29          2HB       PHE  29   6.623  -2.095 -13.857
  211    HD1  PHE  29           HD1      PHE  29   5.528  -0.514 -11.778
  212    HD2  PHE  29           HD2      PHE  29   9.712  -1.079 -12.624
  213    HE1  PHE  29           HE1      PHE  29   6.090   0.072  -9.455
  214    HE2  PHE  29           HE2      PHE  29  10.250  -0.483 -10.299
  215    HZ   PHE  29           HZ       PHE  29   8.448   0.095  -8.714
  216    H    ASP  30           H        ASP  30   7.761   0.056 -16.757
  217    HA   ASP  30           HA       ASP  30   6.235  -1.736 -18.390
  218   1HB   ASP  30          1HB       ASP  30   7.934   0.406 -19.741
  219   2HB   ASP  30          2HB       ASP  30   6.661   0.877 -18.638
  220    H    ALA  31           H        ALA  31   9.700  -0.910 -18.698
  221    HA   ALA  31           HA       ALA  31  11.575  -2.341 -19.244
  222   1HB   ALA  31          1HB       ALA  31  11.237  -4.708 -19.932
  223   2HB   ALA  31          2HB       ALA  31  10.343  -4.327 -18.448
  224   3HB   ALA  31          3HB       ALA  31   9.474  -4.476 -19.997
  225    H    ASP  32           H        ASP  32   8.783  -2.276 -21.456
  226    HA   ASP  32           HA       ASP  32  10.601  -1.923 -23.874
  227   1HB   ASP  32          1HB       ASP  32   9.068  -2.977 -25.135
  228   2HB   ASP  32          2HB       ASP  32   8.336  -3.483 -23.629
  229    H    GLY  33           H        GLY  33   7.810  -0.422 -22.226
  230   1HA   GLY  33          1HA       GLY  33   7.472   1.989 -21.811
  231   2HA   GLY  33          2HA       GLY  33   8.808   2.322 -22.888
  232    H    GLY  34           H        GLY  34   5.700   0.568 -23.233
  233   1HA   GLY  34          1HA       GLY  34   5.232   1.754 -25.985
  234   2HA   GLY  34          2HA       GLY  34   4.320   0.422 -25.264
  235    H    GLY  35           H        GLY  35   3.843   1.709 -22.730
  236   1HA   GLY  35          1HA       GLY  35   2.762   4.017 -22.041
  237   2HA   GLY  35          2HA       GLY  35   1.805   3.862 -23.521
  238    H    ASP  36           H        ASP  36   2.670   1.263 -21.279
  239    HA   ASP  36           HA       ASP  36   0.359   0.900 -19.659
  240   1HB   ASP  36          1HB       ASP  36  -0.885  -0.910 -21.184
  241   2HB   ASP  36          2HB       ASP  36  -1.329   0.781 -21.182
  242    H    ILE  37           H        ILE  37   0.666  -0.822 -18.409
  243    HA   ILE  37           HA       ILE  37   3.115  -2.541 -18.957
  244    HB   ILE  37           HB       ILE  37   1.869  -2.783 -16.270
  245   1HG1  ILE  37          1HG1      ILE  37   2.916  -0.065 -17.184
  246   2HG1  ILE  37          2HG1      ILE  37   1.526  -0.444 -16.186
  247   1HG2  ILE  37          1HG2      ILE  37   4.214  -2.898 -15.519
  248   2HG2  ILE  37          2HG2      ILE  37   3.983  -3.951 -16.922
  249   3HG2  ILE  37          3HG2      ILE  37   4.800  -2.383 -17.119
  250   1HD1  ILE  37          1HD1      ILE  37   4.449  -0.610 -15.236
  251   2HD1  ILE  37          2HD1      ILE  37   3.225   0.593 -14.776
  252   3HD1  ILE  37          3HD1      ILE  37   3.035  -1.099 -14.262
  253    H    SER  38           H        SER  38   2.833  -4.748 -17.613
  254    HA   SER  38           HA       SER  38   0.230  -6.139 -18.190
  255   1HB   SER  38          1HB       SER  38   2.517  -6.317 -20.115
  256   2HB   SER  38          2HB       SER  38   1.807  -7.867 -19.656
  257    HG   SER  38           HG       SER  38   0.318  -7.372 -20.984
  258    H    THR  39           H        THR  39   1.037  -8.713 -18.139
  259    HA   THR  39           HA       THR  39   1.968  -9.100 -15.307
  260    HB   THR  39           HB       THR  39   1.641 -11.674 -16.420
  261    HG1  THR  39           HG1      THR  39  -0.617 -10.194 -17.127
  262   1HG2  THR  39          1HG2      THR  39  -0.392 -11.836 -15.052
  263   2HG2  THR  39          2HG2      THR  39   0.842 -10.941 -14.134
  264   3HG2  THR  39          3HG2      THR  39  -0.509 -10.068 -14.905
  265    H    LYS  40           H        LYS  40   2.990 -10.052 -18.594
  266    HA   LYS  40           HA       LYS  40   5.528 -11.310 -17.721
  267   1HB   LYS  40          1HB       LYS  40   4.470 -10.509 -20.476
  268   2HB   LYS  40          2HB       LYS  40   4.410 -12.103 -19.771
  269   1HG   LYS  40          1HG       LYS  40   6.792 -12.415 -20.145
  270   2HG   LYS  40          2HG       LYS  40   7.101 -10.702 -20.247
  271   1HD   LYS  40          1HD       LYS  40   6.203 -10.567 -22.546
  272   2HD   LYS  40          2HD       LYS  40   7.396 -11.824 -22.395
  273   1HE   LYS  40          1HE       LYS  40   4.646 -12.884 -22.001
  274   2HE   LYS  40          2HE       LYS  40   4.901 -12.193 -23.597
  275   1HZ   LYS  40          1HZ       LYS  40   6.106 -14.557 -22.375
  276   2HZ   LYS  40          2HZ       LYS  40   7.111 -13.683 -23.353
  277   3HZ   LYS  40          3HZ       LYS  40   5.692 -14.283 -23.950
  278    H    GLU  41           H        GLU  41   4.629  -8.270 -19.371
  279    HA   GLU  41           HA       GLU  41   7.108  -6.854 -19.564
  280   1HB   GLU  41          1HB       GLU  41   5.331  -4.855 -18.708
  281   2HB   GLU  41          2HB       GLU  41   4.268  -6.060 -19.403
  282   1HG   GLU  41          1HG       GLU  41   6.275  -4.270 -20.767
  283   2HG   GLU  41          2HG       GLU  41   6.189  -5.899 -21.402
  284    H    LEU  42           H        LEU  42   4.805  -6.433 -16.859
  285    HA   LEU  42           HA       LEU  42   6.592  -5.170 -14.969
  286   1HB   LEU  42          1HB       LEU  42   4.113  -5.224 -14.691
  287   2HB   LEU  42          2HB       LEU  42   4.149  -6.947 -14.388
  288    HG   LEU  42           HG       LEU  42   5.854  -6.130 -12.377
  289   1HD1  LEU  42          1HD1      LEU  42   4.933  -4.049 -11.319
  290   2HD1  LEU  42          2HD1      LEU  42   5.653  -3.704 -12.899
  291   3HD1  LEU  42          3HD1      LEU  42   3.881  -3.779 -12.732
  292   1HD2  LEU  42          1HD2      LEU  42   2.767  -6.173 -12.167
  293   2HD2  LEU  42          2HD2      LEU  42   3.842  -7.587 -12.044
  294   3HD2  LEU  42          3HD2      LEU  42   3.912  -6.318 -10.808
  295    H    GLY  43           H        GLY  43   6.050  -8.559 -15.757
  296   1HA   GLY  43          1HA       GLY  43   7.060 -10.046 -13.579
  297   2HA   GLY  43          2HA       GLY  43   7.341 -10.543 -15.252
  298    H    THR  44           H        THR  44   8.881  -8.146 -15.923
  299    HA   THR  44           HA       THR  44  11.549  -9.230 -15.473
  300    HB   THR  44           HB       THR  44  10.439  -6.946 -16.961
  301    HG1  THR  44           HG1      THR  44  11.494  -9.022 -17.569
  302   1HG2  THR  44          1HG2      THR  44  12.565  -5.645 -17.170
  303   2HG2  THR  44          2HG2      THR  44  11.887  -5.508 -15.534
  304   3HG2  THR  44          3HG2      THR  44  13.283  -6.576 -15.832
  305    H    VAL  45           H        VAL  45  10.015  -6.259 -14.209
  306    HA   VAL  45           HA       VAL  45  12.230  -5.424 -12.481
  307    HB   VAL  45           HB       VAL  45   9.438  -4.505 -12.926
  308   1HG1  VAL  45          1HG1      VAL  45  11.965  -2.878 -12.238
  309   2HG1  VAL  45          2HG1      VAL  45  11.566  -3.406 -13.877
  310   3HG1  VAL  45          3HG1      VAL  45  10.473  -2.296 -13.022
  311   1HG2  VAL  45          1HG2      VAL  45   9.153  -3.189 -10.890
  312   2HG2  VAL  45          2HG2      VAL  45   9.415  -4.869 -10.366
  313   3HG2  VAL  45          3HG2      VAL  45  10.736  -3.698 -10.246
  314    H    MET  46           H        MET  46   9.402  -7.492 -12.051
  315    HA   MET  46           HA       MET  46   9.436  -7.862  -9.142
  316   1HB   MET  46          1HB       MET  46   8.262  -9.446 -11.450
  317   2HB   MET  46          2HB       MET  46   8.453 -10.266  -9.912
  318   1HG   MET  46          1HG       MET  46   6.428  -8.263 -10.702
  319   2HG   MET  46          2HG       MET  46   7.229  -7.785  -9.196
  320   1HE   MET  46          1HE       MET  46   6.235 -11.324 -10.905
  321   2HE   MET  46          2HE       MET  46   4.821 -11.731  -9.889
  322   3HE   MET  46          3HE       MET  46   4.767 -10.299 -10.957
  323    NH1  ARG  47           NH1      ARG  47  17.973 -13.286 -13.927
  324    NH2  ARG  47           NH2      ARG  47  17.984 -14.612 -12.080
  325    H    ARG  47           H        ARG  47  11.148  -9.385 -11.833
  326    HA   ARG  47           HA       ARG  47  12.394 -11.676 -10.595
  327   1HB   ARG  47          1HB       ARG  47  14.063 -10.049 -12.533
  328   2HB   ARG  47          2HB       ARG  47  12.505 -10.640 -13.095
  329   1HG   ARG  47          1HG       ARG  47  13.317 -12.725 -13.428
  330   2HG   ARG  47          2HG       ARG  47  13.801 -12.859 -11.737
  331   1HD   ARG  47          1HD       ARG  47  15.498 -12.244 -14.144
  332   2HD   ARG  47          2HD       ARG  47  15.806 -11.175 -12.784
  333    HE   ARG  47           HE       ARG  47  15.885 -13.623 -11.475
  334   1HH1  ARG  47          1HH1      ARG  47  17.486 -12.567 -14.472
  335   2HH1  ARG  47          2HH1      ARG  47  18.869 -13.730 -14.156
  336   1HH2  ARG  47          1HH2      ARG  47  17.509 -14.905 -11.220
  337   2HH2  ARG  47          2HH2      ARG  47  18.880 -14.962 -12.438
  338    H    MET  48           H        MET  48  13.310  -8.247 -10.599
  339    HA   MET  48           HA       MET  48  15.734  -8.642  -8.853
  340   1HB   MET  48          1HB       MET  48  14.783  -5.841  -9.214
  341   2HB   MET  48          2HB       MET  48  16.375  -6.547  -9.418
  342   1HG   MET  48          1HG       MET  48  15.324  -7.557 -11.702
  343   2HG   MET  48          2HG       MET  48  14.187  -6.206 -11.500
  344   1HE   MET  48          1HE       MET  48  14.630  -3.870 -12.365
  345   2HE   MET  48          2HE       MET  48  16.067  -3.605 -13.396
  346   3HE   MET  48          3HE       MET  48  14.973  -4.980 -13.728
  347    H    LEU  49           H        LEU  49  14.361  -9.728  -7.233
  348    HA   LEU  49           HA       LEU  49  13.594  -7.793  -5.029
  349   1HB   LEU  49          1HB       LEU  49  11.600  -9.944  -5.952
  350   2HB   LEU  49          2HB       LEU  49  11.477  -8.261  -6.416
  351    HG   LEU  49           HG       LEU  49   9.981  -8.329  -4.632
  352   1HD1  LEU  49          1HD1      LEU  49  12.572  -7.694  -3.086
  353   2HD1  LEU  49          2HD1      LEU  49  11.758  -6.559  -4.180
  354   3HD1  LEU  49          3HD1      LEU  49  10.929  -7.118  -2.706
  355   1HD2  LEU  49          1HD2      LEU  49  10.140  -9.690  -2.588
  356   2HD2  LEU  49          2HD2      LEU  49  10.543 -10.752  -3.960
  357   3HD2  LEU  49          3HD2      LEU  49  11.835 -10.117  -2.931
  358    H    GLY  50           H        GLY  50  13.601 -11.212  -6.076
  359   1HA   GLY  50          1HA       GLY  50  14.216 -12.394  -3.439
  360   2HA   GLY  50          2HA       GLY  50  15.728 -12.149  -4.325
  361    H    GLN  51           H        GLN  51  12.449 -13.128  -5.343
  362    HA   GLN  51           HA       GLN  51  13.490 -15.854  -6.262
  363   1HB   GLN  51          1HB       GLN  51  10.932 -14.895  -5.080
  364   2HB   GLN  51          2HB       GLN  51  10.691 -15.898  -6.498
  365   1HG   GLN  51          1HG       GLN  51  12.100 -16.662  -3.886
  366   2HG   GLN  51          2HG       GLN  51  10.633 -17.344  -4.554
  367   1HE2  GLN  51          1HE2      GLN  51  12.402 -19.641  -6.735
  368   2HE2  GLN  51          2HE2      GLN  51  10.820 -18.759  -6.441
  369    H    ASN  52           H        ASN  52  11.578 -16.479  -8.105
  370    HA   ASN  52           HA       ASN  52  11.376 -14.365 -10.208
  371   1HB   ASN  52          1HB       ASN  52  12.940 -16.860 -11.025
  372   2HB   ASN  52          2HB       ASN  52  13.775 -15.510 -10.288
  373   1HD2  ASN  52          1HD2      ASN  52  14.063 -14.741 -13.879
  374   2HD2  ASN  52          2HD2      ASN  52  14.851 -15.620 -12.475
  375    HA   PRO  53           HA       PRO  53   7.946 -17.623 -10.357
  376   1HB   PRO  53          1HB       PRO  53   6.482 -16.195  -9.208
  377   2HB   PRO  53          2HB       PRO  53   5.834 -15.931 -10.835
  378   1HG   PRO  53          1HG       PRO  53   6.948 -13.894 -11.179
  379   2HG   PRO  53          2HG       PRO  53   6.736 -13.783  -9.417
  380   1HD   PRO  53          1HD       PRO  53   9.053 -14.269  -9.023
  381   2HD   PRO  53          2HD       PRO  53   9.241 -13.707 -10.711
  382    H    THR  54           H        THR  54   6.061 -17.851 -12.081
  383    HA   THR  54           HA       THR  54   7.332 -17.606 -14.847
  384    HB   THR  54           HB       THR  54   6.636 -19.926 -13.794
  385    HG1  THR  54           HG1      THR  54   6.370 -20.656 -15.863
  386   1HG2  THR  54          1HG2      THR  54   4.416 -20.757 -14.497
  387   2HG2  THR  54          2HG2      THR  54   4.218 -19.421 -13.341
  388   3HG2  THR  54          3HG2      THR  54   3.946 -19.143 -15.080
  389    H    LYS  55           H        LYS  55   5.227 -17.858 -16.473
  390    HA   LYS  55           HA       LYS  55   4.030 -15.106 -16.336
  391   1HB   LYS  55          1HB       LYS  55   3.837 -17.265 -18.531
  392   2HB   LYS  55          2HB       LYS  55   3.146 -15.662 -18.664
  393   1HG   LYS  55          1HG       LYS  55   5.055 -14.892 -19.525
  394   2HG   LYS  55          2HG       LYS  55   5.896 -15.196 -18.015
  395   1HD   LYS  55          1HD       LYS  55   5.581 -17.684 -19.677
  396   2HD   LYS  55          2HD       LYS  55   6.408 -16.392 -20.534
  397   1HE   LYS  55          1HE       LYS  55   7.291 -17.232 -17.722
  398   2HE   LYS  55          2HE       LYS  55   7.875 -18.077 -19.153
  399   1HZ   LYS  55          1HZ       LYS  55   9.470 -16.467 -18.894
  400   2HZ   LYS  55          2HZ       LYS  55   8.450 -15.338 -18.251
  401   3HZ   LYS  55          3HZ       LYS  55   8.461 -15.609 -19.881
  402    H    GLU  56           H        GLU  56   3.042 -18.491 -16.204
  403    HA   GLU  56           HA       GLU  56   0.120 -18.030 -16.253
  404   1HB   GLU  56          1HB       GLU  56   0.226 -20.529 -15.236
  405   2HB   GLU  56          2HB       GLU  56   1.888 -20.443 -15.786
  406   1HG   GLU  56          1HG       GLU  56  -0.386 -19.713 -17.714
  407   2HG   GLU  56          2HG       GLU  56   1.247 -20.227 -18.103
  408    H    GLU  57           H        GLU  57   2.605 -18.361 -13.775
  409    HA   GLU  57           HA       GLU  57   0.736 -18.300 -11.439
  410   1HB   GLU  57          1HB       GLU  57   3.389 -19.092 -11.760
  411   2HB   GLU  57          2HB       GLU  57   2.454 -19.041 -10.281
  412   1HG   GLU  57          1HG       GLU  57   4.685 -17.214 -11.208
  413   2HG   GLU  57          2HG       GLU  57   3.389 -16.409 -10.333
  414    H    LEU  58           H        LEU  58   2.660 -16.024 -13.316
  415    HA   LEU  58           HA       LEU  58   2.328 -13.616 -11.689
  416   1HB   LEU  58          1HB       LEU  58   3.230 -14.282 -14.449
  417   2HB   LEU  58          2HB       LEU  58   2.435 -12.724 -14.354
  418    HG   LEU  58           HG       LEU  58   4.478 -13.217 -12.189
  419   1HD1  LEU  58          1HD1      LEU  58   6.448 -12.751 -13.699
  420   2HD1  LEU  58          2HD1      LEU  58   5.707 -14.313 -14.075
  421   3HD1  LEU  58          3HD1      LEU  58   5.400 -12.914 -15.131
  422   1HD2  LEU  58          1HD2      LEU  58   3.992 -10.852 -14.115
  423   2HD2  LEU  58          2HD2      LEU  58   3.340 -11.011 -12.465
  424   3HD2  LEU  58          3HD2      LEU  58   5.089 -10.853 -12.711
  425    H    ASP  59           H        ASP  59   0.332 -15.287 -14.058
  426    HA   ASP  59           HA       ASP  59  -1.728 -13.433 -14.743
  427   1HB   ASP  59          1HB       ASP  59  -1.615 -15.749 -15.669
  428   2HB   ASP  59          2HB       ASP  59  -2.121 -16.416 -14.133
  429    H    ALA  60           H        ALA  60  -1.102 -15.045 -11.691
  430    HA   ALA  60           HA       ALA  60  -3.647 -14.383 -10.336
  431   1HB   ALA  60          1HB       ALA  60  -2.480 -15.104  -8.257
  432   2HB   ALA  60          2HB       ALA  60  -2.240 -16.269  -9.573
  433   3HB   ALA  60          3HB       ALA  60  -0.921 -15.161  -9.114
  434    H    ILE  61           H        ILE  61  -0.335 -13.047 -10.126
  435    HA   ILE  61           HA       ILE  61  -0.621 -10.894  -8.316
  436    HB   ILE  61           HB       ILE  61   1.056 -10.716 -10.867
  437   1HG1  ILE  61          1HG1      ILE  61   2.836 -11.559  -8.964
  438   2HG1  ILE  61          2HG1      ILE  61   1.971 -12.665 -10.030
  439   1HG2  ILE  61          1HG2      ILE  61   2.569  -9.235  -9.519
  440   2HG2  ILE  61          2HG2      ILE  61   0.964  -8.523  -9.668
  441   3HG2  ILE  61          3HG2      ILE  61   1.439  -9.309  -8.144
  442   1HD1  ILE  61          1HD1      ILE  61   0.297 -13.209  -8.293
  443   2HD1  ILE  61          2HD1      ILE  61   1.942 -13.458  -7.671
  444   3HD1  ILE  61          3HD1      ILE  61   1.022 -12.016  -7.180
  445    H    ILE  62           H        ILE  62  -1.460 -10.987 -11.774
  446    HA   ILE  62           HA       ILE  62  -2.406  -8.143 -11.882
  447    HB   ILE  62           HB       ILE  62  -2.115 -10.365 -13.903
  448   1HG1  ILE  62          1HG1      ILE  62  -1.207  -7.433 -13.697
  449   2HG1  ILE  62          2HG1      ILE  62  -0.214  -8.875 -13.733
  450   1HG2  ILE  62          1HG2      ILE  62  -3.400  -9.111 -15.658
  451   2HG2  ILE  62          2HG2      ILE  62  -4.473  -9.602 -14.349
  452   3HG2  ILE  62          3HG2      ILE  62  -3.923  -7.914 -14.448
  453   1HD1  ILE  62          1HD1      ILE  62  -1.755  -7.775 -16.158
  454   2HD1  ILE  62          2HD1      ILE  62  -0.001  -7.755 -15.882
  455   3HD1  ILE  62          3HD1      ILE  62  -0.834  -9.304 -16.145
  456    H    GLU  63           H        GLU  63  -3.729 -11.385 -11.513
  457    HA   GLU  63           HA       GLU  63  -6.515 -11.087 -11.925
  458   1HB   GLU  63          1HB       GLU  63  -5.205 -13.179 -11.145
  459   2HB   GLU  63          2HB       GLU  63  -5.436 -12.612  -9.502
  460   1HG   GLU  63          1HG       GLU  63  -7.284 -14.007  -9.651
  461   2HG   GLU  63          2HG       GLU  63  -8.046 -12.534 -10.227
  462    H    GLU  64           H        GLU  64  -5.000 -10.727  -8.699
  463    HA   GLU  64           HA       GLU  64  -7.198  -9.659  -7.250
  464   1HB   GLU  64          1HB       GLU  64  -4.216  -9.530  -6.873
  465   2HB   GLU  64          2HB       GLU  64  -5.154  -8.372  -5.951
  466   1HG   GLU  64          1HG       GLU  64  -4.637 -10.553  -4.735
  467   2HG   GLU  64          2HG       GLU  64  -5.621 -11.424  -5.898
  468    H    VAL  65           H        VAL  65  -4.491  -7.490  -8.020
  469    HA   VAL  65           HA       VAL  65  -5.976  -5.014  -8.001
  470    HB   VAL  65           HB       VAL  65  -3.824  -4.423  -7.851
  471   1HG1  VAL  65          1HG1      VAL  65  -3.768  -4.414 -10.938
  472   2HG1  VAL  65          2HG1      VAL  65  -4.657  -3.225  -9.967
  473   3HG1  VAL  65          3HG1      VAL  65  -2.886  -3.336  -9.828
  474   1HG2  VAL  65          1HG2      VAL  65  -1.839  -5.569  -8.689
  475   2HG2  VAL  65          2HG2      VAL  65  -2.971  -6.844  -8.178
  476   3HG2  VAL  65          3HG2      VAL  65  -2.774  -6.482  -9.898
  477    H    ASP  66           H        ASP  66  -6.178  -3.580 -10.028
  478    HA   ASP  66           HA       ASP  66  -6.975  -3.153 -12.278
  479   1HB   ASP  66          1HB       ASP  66  -7.232  -6.052 -13.059
  480   2HB   ASP  66          2HB       ASP  66  -5.609  -5.496 -12.722
  481    H    GLU  67           H        GLU  67  -8.661  -2.650 -10.630
  482    HA   GLU  67           HA       GLU  67 -11.055  -4.470 -10.443
  483   1HB   GLU  67          1HB       GLU  67 -10.809  -1.632  -9.323
  484   2HB   GLU  67          2HB       GLU  67 -10.107  -3.023  -8.518
  485   1HG   GLU  67          1HG       GLU  67 -12.681  -2.033  -8.089
  486   2HG   GLU  67          2HG       GLU  67 -13.029  -3.323  -9.227
  487    H    ASP  68           H        ASP  68 -10.184  -3.303 -13.060
  488    HA   ASP  68           HA       ASP  68 -12.681  -1.689 -13.789
  489   1HB   ASP  68          1HB       ASP  68 -11.529  -0.086 -14.871
  490   2HB   ASP  68          2HB       ASP  68 -10.152  -0.629 -13.940
  491    H    GLY  69           H        GLY  69 -10.226  -4.046 -14.808
  492   1HA   GLY  69          1HA       GLY  69 -12.256  -5.436 -16.617
  493   2HA   GLY  69          2HA       GLY  69 -10.776  -6.170 -15.985
  494    H    SER  70           H        SER  70  -8.953  -6.107 -17.115
  495    HA   SER  70           HA       SER  70  -8.906  -5.280 -19.974
  496   1HB   SER  70          1HB       SER  70  -7.079  -3.529 -19.722
  497   2HB   SER  70          2HB       SER  70  -8.690  -3.032 -19.197
  498    HG   SER  70           HG       SER  70  -7.188  -2.454 -17.681
  499    H    GLY  71           H        GLY  71  -6.981  -5.940 -17.042
  500   1HA   GLY  71          1HA       GLY  71  -5.524  -7.987 -16.796
  501   2HA   GLY  71          2HA       GLY  71  -5.334  -8.018 -18.554
  502    H    THR  72           H        THR  72  -4.898  -5.149 -18.788
  503    HA   THR  72           HA       THR  72  -1.966  -5.043 -17.973
  504    HB   THR  72           HB       THR  72  -1.879  -3.057 -19.627
  505    HG1  THR  72           HG1      THR  72  -4.140  -4.291 -20.739
  506   1HG2  THR  72          1HG2      THR  72  -1.599  -4.458 -21.632
  507   2HG2  THR  72          2HG2      THR  72  -0.877  -5.296 -20.241
  508   3HG2  THR  72          3HG2      THR  72  -2.455  -5.823 -20.882
  509    H    ILE  73           H        ILE  73  -1.115  -3.224 -16.959
  510    HA   ILE  73           HA       ILE  73  -3.087  -1.472 -15.399
  511    HB   ILE  73           HB       ILE  73  -0.323  -2.523 -14.658
  512   1HG1  ILE  73          1HG1      ILE  73  -1.899  -4.128 -13.920
  513   2HG1  ILE  73          2HG1      ILE  73  -3.156  -2.945 -13.625
  514   1HG2  ILE  73          1HG2      ILE  73  -0.298  -1.071 -12.634
  515   2HG2  ILE  73          2HG2      ILE  73  -0.372  -0.060 -14.084
  516   3HG2  ILE  73          3HG2      ILE  73  -1.835  -0.309 -13.102
  517   1HD1  ILE  73          1HD1      ILE  73  -2.088  -2.157 -11.530
  518   2HD1  ILE  73          2HD1      ILE  73  -2.322  -3.918 -11.498
  519   3HD1  ILE  73          3HD1      ILE  73  -0.701  -3.249 -11.799
  520    H    ASP  74           H        ASP  74  -3.348   0.070 -16.962
  521    HA   ASP  74           HA       ASP  74  -1.173   1.390 -18.458
  522   1HB   ASP  74          1HB       ASP  74  -2.769   2.758 -19.465
  523   2HB   ASP  74          2HB       ASP  74  -3.774   2.871 -18.039
  524    H    PHE  75           H        PHE  75  -1.415   4.031 -18.227
  525    HA   PHE  75           HA       PHE  75   0.134   4.671 -15.794
  526   1HB   PHE  75          1HB       PHE  75   0.552   5.791 -17.995
  527   2HB   PHE  75          2HB       PHE  75  -1.017   6.548 -17.945
  528    HD1  PHE  75           HD1      PHE  75  -0.638   8.877 -17.705
  529    HD2  PHE  75           HD2      PHE  75   1.592   6.187 -15.192
  530    HE1  PHE  75           HE1      PHE  75   0.353  10.791 -16.518
  531    HE2  PHE  75           HE2      PHE  75   2.567   8.117 -14.012
  532    HZ   PHE  75           HZ       PHE  75   1.960  10.416 -14.677
  533    H    GLU  76           H        GLU  76  -3.147   5.395 -16.960
  534    HA   GLU  76           HA       GLU  76  -4.044   7.123 -14.778
  535   1HB   GLU  76          1HB       GLU  76  -5.136   6.613 -17.139
  536   2HB   GLU  76          2HB       GLU  76  -6.056   7.215 -15.777
  537   1HG   GLU  76          1HG       GLU  76  -5.949   4.194 -16.221
  538   2HG   GLU  76          2HG       GLU  76  -7.179   5.152 -15.423
  539    H    GLU  77           H        GLU  77  -4.366   3.622 -15.347
  540    HA   GLU  77           HA       GLU  77  -5.797   2.986 -12.840
  541   1HB   GLU  77          1HB       GLU  77  -5.622   1.595 -15.070
  542   2HB   GLU  77          2HB       GLU  77  -4.162   0.934 -14.370
  543   1HG   GLU  77          1HG       GLU  77  -5.304  -0.396 -12.848
  544   2HG   GLU  77          2HG       GLU  77  -6.512   0.835 -12.500
  545    H    PHE  78           H        PHE  78  -2.437   3.335 -13.728
  546    HA   PHE  78           HA       PHE  78  -1.198   1.942 -11.471
  547   1HB   PHE  78          1HB       PHE  78  -0.051   4.269 -13.138
  548   2HB   PHE  78          2HB       PHE  78   0.013   2.590 -13.608
  549    HD1  PHE  78           HD1      PHE  78   0.564   1.702 -10.497
  550    HD2  PHE  78           HD2      PHE  78   2.421   4.447 -13.240
  551    HE1  PHE  78           HE1      PHE  78   2.696   1.491  -9.283
  552    HE2  PHE  78           HE2      PHE  78   4.544   4.221 -12.016
  553    HZ   PHE  78           HZ       PHE  78   4.688   2.742 -10.043
  554    H    LEU  79           H        LEU  79  -2.301   5.265 -11.990
  555    HA   LEU  79           HA       LEU  79  -1.208   6.389  -9.468
  556   1HB   LEU  79          1HB       LEU  79  -2.985   8.287 -10.065
  557   2HB   LEU  79          2HB       LEU  79  -3.152   7.432 -11.583
  558    HG   LEU  79           HG       LEU  79  -0.891   7.889 -12.265
  559   1HD1  LEU  79          1HD1      LEU  79  -0.216   8.922  -9.440
  560   2HD1  LEU  79          2HD1      LEU  79   0.209   7.309 -10.041
  561   3HD1  LEU  79          3HD1      LEU  79   0.905   8.754 -10.815
  562   1HD2  LEU  79          1HD2      LEU  79  -0.730  10.342 -12.247
  563   2HD2  LEU  79          2HD2      LEU  79  -2.463   9.932 -12.296
  564   3HD2  LEU  79          3HD2      LEU  79  -1.727  10.459 -10.775
  565    H    VAL  80           H        VAL  80  -4.285   5.020 -10.521
  566    HA   VAL  80           HA       VAL  80  -5.844   5.678  -8.097
  567    HB   VAL  80           HB       VAL  80  -6.884   5.210 -10.328
  568   1HG1  VAL  80          1HG1      VAL  80  -8.054   3.370  -8.150
  569   2HG1  VAL  80          2HG1      VAL  80  -8.196   5.132  -8.102
  570   3HG1  VAL  80          3HG1      VAL  80  -8.929   4.227  -9.446
  571   1HG2  VAL  80          1HG2      VAL  80  -7.342   2.938 -11.125
  572   2HG2  VAL  80          2HG2      VAL  80  -5.578   3.077 -10.937
  573   3HG2  VAL  80          3HG2      VAL  80  -6.525   2.207  -9.722
  574    H    MET  81           H        MET  81  -3.761   3.037  -9.132
  575    HA   MET  81           HA       MET  81  -4.424   1.042  -7.046
  576   1HB   MET  81          1HB       MET  81  -3.251   0.440  -9.192
  577   2HB   MET  81          2HB       MET  81  -1.834   1.333  -8.670
  578   1HG   MET  81          1HG       MET  81  -2.658  -0.694  -6.636
  579   2HG   MET  81          2HG       MET  81  -2.310  -1.406  -8.220
  580   1HE   MET  81          1HE       MET  81  -0.096  -2.260  -8.750
  581   2HE   MET  81          2HE       MET  81   1.334  -2.005  -7.705
  582   3HE   MET  81          3HE       MET  81  -0.151  -2.725  -7.020
  583    H    MET  82           H        MET  82  -1.847   3.486  -7.423
  584    HA   MET  82           HA       MET  82  -0.494   2.900  -4.861
  585   1HB   MET  82          1HB       MET  82  -0.228   5.093  -6.951
  586   2HB   MET  82          2HB       MET  82   0.513   5.338  -5.382
  587   1HG   MET  82          1HG       MET  82   1.169   2.639  -6.455
  588   2HG   MET  82          2HG       MET  82   1.603   3.923  -7.590
  589   1HE   MET  82          1HE       MET  82   4.723   2.588  -5.688
  590   2HE   MET  82          2HE       MET  82   3.180   1.792  -6.114
  591   3HE   MET  82          3HE       MET  82   3.577   2.102  -4.398
  592    H    VAL  83           H        VAL  83  -3.046   5.083  -5.903
  593    HA   VAL  83           HA       VAL  83  -3.014   6.975  -3.663
  594    HB   VAL  83           HB       VAL  83  -4.928   6.398  -5.903
  595   1HG1  VAL  83          1HG1      VAL  83  -3.937   9.098  -4.794
  596   2HG1  VAL  83          2HG1      VAL  83  -3.042   8.159  -5.997
  597   3HG1  VAL  83          3HG1      VAL  83  -4.665   8.772  -6.388
  598   1HG2  VAL  83          1HG2      VAL  83  -6.757   7.781  -5.066
  599   2HG2  VAL  83          2HG2      VAL  83  -6.474   6.530  -3.835
  600   3HG2  VAL  83          3HG2      VAL  83  -5.878   8.174  -3.566
  601    NH1  ARG  84           NH1      ARG  84  -8.118  -2.081  -5.480
  602    NH2  ARG  84           NH2      ARG  84  -8.242  -2.625  -3.278
  603    H    ARG  84           H        ARG  84  -4.537   3.850  -4.233
  604    HA   ARG  84           HA       ARG  84  -6.532   3.787  -2.102
  605   1HB   ARG  84          1HB       ARG  84  -5.093   1.644  -3.716
  606   2HB   ARG  84          2HB       ARG  84  -5.938   1.155  -2.255
  607   1HG   ARG  84          1HG       ARG  84  -8.088   1.959  -3.059
  608   2HG   ARG  84          2HG       ARG  84  -7.357   2.820  -4.415
  609   1HD   ARG  84          1HD       ARG  84  -6.630   0.672  -5.464
  610   2HD   ARG  84          2HD       ARG  84  -8.378   0.688  -5.217
  611    HE   ARG  84           HE       ARG  84  -6.704  -0.637  -3.054
  612   1HH1  ARG  84          1HH1      ARG  84  -7.804  -1.411  -6.191
  613   2HH1  ARG  84          2HH1      ARG  84  -8.596  -2.974  -5.646
  614   1HH2  ARG  84          1HH2      ARG  84  -8.060  -2.352  -2.306
  615   2HH2  ARG  84          2HH2      ARG  84  -8.667  -3.502  -3.601
  616    H    GLN  85           H        GLN  85  -3.070   3.040  -2.159
  617    HA   GLN  85           HA       GLN  85  -3.021   1.937   0.641
  618   1HB   GLN  85          1HB       GLN  85  -0.417   1.993   0.125
  619   2HB   GLN  85          2HB       GLN  85  -0.913   2.331  -1.523
  620   1HG   GLN  85          1HG       GLN  85  -1.659   0.186  -1.918
  621   2HG   GLN  85          2HG       GLN  85  -2.364  -0.004  -0.328
  622   1HE2  GLN  85          1HE2      GLN  85   0.707  -1.383   1.114
  623   2HE2  GLN  85          2HE2      GLN  85  -0.660  -0.226   1.514
  624    H    MET  86           H        MET  86  -2.230   4.916  -1.064
  625    HA   MET  86           HA       MET  86  -0.586   6.254   0.950
  626   1HB   MET  86          1HB       MET  86  -1.340   6.855  -1.654
  627   2HB   MET  86          2HB       MET  86  -0.398   7.870  -0.577
  628   1HG   MET  86          1HG       MET  86  -3.414   8.017  -1.206
  629   2HG   MET  86          2HG       MET  86  -2.768   8.819   0.233
  630   1HE   MET  86          1HE       MET  86  -4.065   9.730  -2.975
  631   2HE   MET  86          2HE       MET  86  -2.790  10.495  -3.969
  632   3HE   MET  86          3HE       MET  86  -2.810   8.720  -3.758
  633    H    LYS  87           H        LYS  87  -4.076   6.168   0.333
  634    HA   LYS  87           HA       LYS  87  -4.768   8.022   2.633
  635   1HB   LYS  87          1HB       LYS  87  -6.423   6.605   0.488
  636   2HB   LYS  87          2HB       LYS  87  -7.199   7.127   1.976
  637   1HG   LYS  87          1HG       LYS  87  -6.069   9.487   1.476
  638   2HG   LYS  87          2HG       LYS  87  -5.901   8.885  -0.165
  639   1HD   LYS  87          1HD       LYS  87  -8.134   9.195  -0.621
  640   2HD   LYS  87          2HD       LYS  87  -8.625   8.403   0.872
  641   1HE   LYS  87          1HE       LYS  87  -7.481  11.093   1.450
  642   2HE   LYS  87          2HE       LYS  87  -8.824  11.199   0.304
  643   1HZ   LYS  87          1HZ       LYS  87 -10.263  10.137   1.836
  644   2HZ   LYS  87          2HZ       LYS  87  -9.425  11.244   2.732
  645   3HZ   LYS  87          3HZ       LYS  87  -9.037   9.641   2.825
  646    H    GLU  88           H        GLU  88  -6.028   7.337   4.398
  647    HA   GLU  88           HA       GLU  88  -6.692   5.922   6.218
  648   1HB   GLU  88          1HB       GLU  88  -6.822   3.972   3.895
  649   2HB   GLU  88          2HB       GLU  88  -6.926   3.344   5.528
  650   1HG   GLU  88          1HG       GLU  88  -8.789   5.562   4.460
  651   2HG   GLU  88          2HG       GLU  88  -9.156   3.851   4.323
  652    H    ASP  89           H        ASP  89  -4.907   3.324   4.691
  653    HA   ASP  89           HA       ASP  89  -2.943   2.102   5.360
  654   1HB   ASP  89          1HB       ASP  89  -2.053   4.314   4.235
  655   2HB   ASP  89          2HB       ASP  89  -0.964   3.202   5.032
  656    H    ALA  90           H        ALA  90  -4.951   2.651   7.324
  657    HA   ALA  90           HA       ALA  90  -5.292   2.130   9.656
  658   1HB   ALA  90          1HB       ALA  90  -3.351   1.264  10.987
  659   2HB   ALA  90          2HB       ALA  90  -3.428   0.471   9.402
  660   3HB   ALA  90          3HB       ALA  90  -2.216   1.741   9.700
   
  Start of MODEL           7
 Raw file had  660 H/Q atoms
  Start of MODEL    7
    1   1H    ALA   1          1H        ALA   1 -19.291  15.470 -19.308
    2   2H    ALA   1          2H        ALA   1 -20.688  14.535 -19.238
    3   3H    ALA   1          3H        ALA   1 -20.713  16.127 -18.696
    4    HA   ALA   1           HA       ALA   1 -18.972  15.490 -17.040
    5   1HB   ALA   1          1HB       ALA   1 -20.973  15.952 -15.962
    6   2HB   ALA   1          2HB       ALA   1 -20.954  14.205 -15.653
    7   3HB   ALA   1          3HB       ALA   1 -21.942  14.863 -16.983
    8    H    SER   2           H        SER   2 -17.472  13.998 -16.823
    9    HA   SER   2           HA       SER   2 -17.704  11.237 -18.036
   10   1HB   SER   2          1HB       SER   2 -15.239  12.136 -16.514
   11   2HB   SER   2          2HB       SER   2 -15.378  11.091 -17.930
   12    HG   SER   2           HG       SER   2 -14.609  13.106 -18.488
   13    H    MET   3           H        MET   3 -18.165   9.480 -16.921
   14    HA   MET   3           HA       MET   3 -18.552   9.602 -13.901
   15   1HB   MET   3          1HB       MET   3 -20.154   8.538 -15.962
   16   2HB   MET   3          2HB       MET   3 -19.434   7.105 -15.251
   17   1HG   MET   3          1HG       MET   3 -20.647   9.172 -13.357
   18   2HG   MET   3          2HG       MET   3 -21.733   8.162 -14.320
   19   1HE   MET   3          1HE       MET   3 -22.579   5.673 -13.072
   20   2HE   MET   3          2HE       MET   3 -22.819   7.300 -12.369
   21   3HE   MET   3          3HE       MET   3 -22.239   5.962 -11.336
   22    H    THR   4           H        THR   4 -15.970   9.649 -14.449
   23    HA   THR   4           HA       THR   4 -14.912   6.803 -14.241
   24    HB   THR   4           HB       THR   4 -12.709   7.649 -14.952
   25    HG1  THR   4           HG1      THR   4 -14.150  10.052 -15.076
   26   1HG2  THR   4          1HG2      THR   4 -14.605   8.640 -17.125
   27   2HG2  THR   4          2HG2      THR   4 -14.580   6.909 -16.718
   28   3HG2  THR   4          3HG2      THR   4 -13.095   7.716 -17.287
   29    H    ASP   5           H        ASP   5 -15.194   6.463 -12.084
   30    HA   ASP   5           HA       ASP   5 -14.431   8.443  -9.975
   31   1HB   ASP   5          1HB       ASP   5 -16.394   6.734  -9.833
   32   2HB   ASP   5          2HB       ASP   5 -15.454   7.088  -8.402
   33    H    GLN   6           H        GLN   6 -13.014   5.685 -11.575
   34    HA   GLN   6           HA       GLN   6 -11.089   4.601  -9.818
   35   1HB   GLN   6          1HB       GLN   6  -9.562   4.393 -11.953
   36   2HB   GLN   6          2HB       GLN   6 -10.886   5.156 -12.814
   37   1HG   GLN   6          1HG       GLN   6 -11.048   2.733 -13.074
   38   2HG   GLN   6          2HG       GLN   6 -12.441   3.309 -12.186
   39   1HE2  GLN   6          1HE2      GLN   6  -9.720   0.817 -10.279
   40   2HE2  GLN   6          2HE2      GLN   6  -9.240   1.768 -11.773
   41    H    GLN   7           H        GLN   7  -9.882   6.884 -12.249
   42    HA   GLN   7           HA       GLN   7  -7.771   7.887 -10.311
   43   1HB   GLN   7          1HB       GLN   7  -6.513   8.621 -12.168
   44   2HB   GLN   7          2HB       GLN   7  -7.244   7.113 -12.708
   45   1HG   GLN   7          1HG       GLN   7  -7.915   9.949 -13.604
   46   2HG   GLN   7          2HG       GLN   7  -7.455   8.569 -14.589
   47   1HE2  GLN   7          1HE2      GLN   7 -10.876   7.255 -14.657
   48   2HE2  GLN   7          2HE2      GLN   7  -9.101   6.812 -14.801
   49    H    ALA   8           H        ALA   8 -10.719   8.718 -10.303
   50    HA   ALA   8           HA       ALA   8 -10.722  11.631 -11.010
   51   1HB   ALA   8          1HB       ALA   8 -13.049  11.614 -10.124
   52   2HB   ALA   8          2HB       ALA   8 -12.788  10.299 -11.285
   53   3HB   ALA   8          3HB       ALA   8 -12.848   9.945  -9.539
   54    H    GLU   9           H        GLU   9 -10.874   9.673  -8.024
   55    HA   GLU   9           HA       GLU   9 -10.672  12.065  -6.213
   56   1HB   GLU   9          1HB       GLU   9 -10.886  10.519  -4.326
   57   2HB   GLU   9          2HB       GLU   9 -12.144  10.230  -5.520
   58   1HG   GLU   9          1HG       GLU   9  -9.650   8.480  -5.698
   59   2HG   GLU   9          2HG       GLU   9 -11.305   8.112  -6.172
   60    H    ALA  10           H        ALA  10  -8.626   9.462  -7.410
   61    HA   ALA  10           HA       ALA  10  -6.391   9.758  -5.494
   62   1HB   ALA  10          1HB       ALA  10  -5.135   8.279  -7.053
   63   2HB   ALA  10          2HB       ALA  10  -6.756   7.640  -6.721
   64   3HB   ALA  10          3HB       ALA  10  -6.416   8.433  -8.280
   65    NH1  ARG  11           NH1      ARG  11  -9.292  14.568 -12.846
   66    NH2  ARG  11           NH2      ARG  11  -9.309  12.886 -14.373
   67    H    ARG  11           H        ARG  11  -7.239  11.155  -8.612
   68    HA   ARG  11           HA       ARG  11  -4.603  12.418  -9.244
   69   1HB   ARG  11          1HB       ARG  11  -6.507  11.777 -10.930
   70   2HB   ARG  11          2HB       ARG  11  -7.314  13.245 -10.399
   71   1HG   ARG  11          1HG       ARG  11  -4.984  14.442 -10.959
   72   2HG   ARG  11          2HG       ARG  11  -4.698  13.011 -11.952
   73   1HD   ARG  11          1HD       ARG  11  -6.885  15.128 -12.257
   74   2HD   ARG  11          2HD       ARG  11  -5.738  14.559 -13.472
   75    HE   ARG  11           HE       ARG  11  -7.174  12.251 -13.182
   76   1HH1  ARG  11          1HH1      ARG  11  -8.778  15.064 -12.109
   77   2HH1  ARG  11          2HH1      ARG  11 -10.245  14.764 -13.169
   78   1HH2  ARG  11          1HH2      ARG  11  -8.803  12.109 -14.812
   79   2HH2  ARG  11          2HH2      ARG  11 -10.267  13.189 -14.577
   80    H    ALA  12           H        ALA  12  -7.625  13.349  -7.672
   81    HA   ALA  12           HA       ALA  12  -7.055  16.252  -7.373
   82   1HB   ALA  12          1HB       ALA  12  -8.997  16.265  -5.821
   83   2HB   ALA  12          2HB       ALA  12  -9.383  15.409  -7.327
   84   3HB   ALA  12          3HB       ALA  12  -9.062  14.486  -5.838
   85    H    PHE  13           H        PHE  13  -6.428  13.317  -5.526
   86    HA   PHE  13           HA       PHE  13  -5.665  14.471  -2.966
   87   1HB   PHE  13          1HB       PHE  13  -4.664  11.841  -4.198
   88   2HB   PHE  13          2HB       PHE  13  -6.220  12.033  -3.432
   89    HD1  PHE  13           HD1      PHE  13  -6.387  11.791  -1.015
   90    HD2  PHE  13           HD2      PHE  13  -2.502  12.372  -2.776
   91    HE1  PHE  13           HE1      PHE  13  -5.320  11.282   1.144
   92    HE2  PHE  13           HE2      PHE  13  -1.455  11.857  -0.611
   93    HZ   PHE  13           HZ       PHE  13  -2.856  11.312   1.350
   94    H    LEU  14           H        LEU  14  -3.680  13.371  -5.733
   95    HA   LEU  14           HA       LEU  14  -1.361  15.175  -4.827
   96   1HB   LEU  14          1HB       LEU  14  -0.074  13.339  -6.395
   97   2HB   LEU  14          2HB       LEU  14  -0.174  13.258  -4.649
   98    HG   LEU  14           HG       LEU  14  -2.326  11.778  -4.998
   99   1HD1  LEU  14          1HD1      LEU  14   0.395  10.599  -5.842
  100   2HD1  LEU  14          2HD1      LEU  14  -0.059  10.962  -4.167
  101   3HD1  LEU  14          3HD1      LEU  14  -0.960   9.727  -5.082
  102   1HD2  LEU  14          1HD2      LEU  14  -2.523  10.544  -7.118
  103   2HD2  LEU  14          2HD2      LEU  14  -2.540  12.280  -7.514
  104   3HD2  LEU  14          3HD2      LEU  14  -1.070  11.332  -7.783
  105    H    SER  15           H        SER  15  -1.092  16.798  -6.130
  106    HA   SER  15           HA       SER  15  -2.574  17.182  -8.642
  107   1HB   SER  15          1HB       SER  15  -0.237  18.979  -7.919
  108   2HB   SER  15          2HB       SER  15  -1.803  19.388  -8.623
  109    HG   SER  15           HG       SER  15  -1.996  19.969  -6.586
  110    H    GLU  16           H        GLU  16  -0.628  18.538 -10.194
  111    HA   GLU  16           HA       GLU  16   0.497  16.283 -11.773
  112   1HB   GLU  16          1HB       GLU  16  -0.510  18.188 -12.922
  113   2HB   GLU  16          2HB       GLU  16   0.625  19.314 -12.203
  114   1HG   GLU  16          1HG       GLU  16   1.386  17.061 -14.175
  115   2HG   GLU  16          2HG       GLU  16   2.523  18.196 -13.469
  116    H    GLU  17           H        GLU  17   1.685  18.742  -9.574
  117    HA   GLU  17           HA       GLU  17   4.542  18.634 -10.152
  118   1HB   GLU  17          1HB       GLU  17   3.095  19.428  -7.584
  119   2HB   GLU  17          2HB       GLU  17   4.846  19.414  -7.678
  120   1HG   GLU  17          1HG       GLU  17   4.338  21.665  -8.168
  121   2HG   GLU  17          2HG       GLU  17   4.567  21.000  -9.776
  122    H    MET  18           H        MET  18   2.490  16.748  -7.952
  123    HA   MET  18           HA       MET  18   4.765  15.117  -6.836
  124   1HB   MET  18          1HB       MET  18   3.226  14.127  -5.332
  125   2HB   MET  18          2HB       MET  18   1.846  14.393  -6.382
  126   1HG   MET  18          1HG       MET  18   1.897  15.879  -4.306
  127   2HG   MET  18          2HG       MET  18   1.722  16.765  -5.830
  128   1HE   MET  18          1HE       MET  18   4.753  15.144  -3.698
  129   2HE   MET  18          2HE       MET  18   5.474  16.660  -3.082
  130   3HE   MET  18          3HE       MET  18   3.805  16.214  -2.618
  131    H    ILE  19           H        ILE  19   2.135  14.838  -9.171
  132    HA   ILE  19           HA       ILE  19   2.101  11.960  -9.608
  133    HB   ILE  19           HB       ILE  19   0.987  14.316 -11.000
  134   1HG1  ILE  19          1HG1      ILE  19  -0.048  12.146  -9.593
  135   2HG1  ILE  19          2HG1      ILE  19  -0.305  11.596 -11.235
  136   1HG2  ILE  19          1HG2      ILE  19   0.597  13.239 -13.231
  137   2HG2  ILE  19          2HG2      ILE  19   2.324  13.469 -12.960
  138   3HG2  ILE  19          3HG2      ILE  19   1.611  11.851 -12.764
  139   1HD1  ILE  19          1HD1      ILE  19  -1.684  13.574 -11.811
  140   2HD1  ILE  19          2HD1      ILE  19  -2.306  12.782 -10.349
  141   3HD1  ILE  19          3HD1      ILE  19  -1.371  14.290 -10.206
  142    H    ALA  20           H        ALA  20   4.148  14.567 -10.824
  143    HA   ALA  20           HA       ALA  20   5.492  13.298 -13.030
  144   1HB   ALA  20          1HB       ALA  20   7.300  14.978 -12.693
  145   2HB   ALA  20          2HB       ALA  20   5.693  15.718 -12.560
  146   3HB   ALA  20          3HB       ALA  20   6.650  15.400 -11.091
  147    H    GLU  21           H        GLU  21   6.331  13.325  -9.562
  148    HA   GLU  21           HA       GLU  21   8.894  11.934  -9.702
  149   1HB   GLU  21          1HB       GLU  21   7.921  11.249  -7.185
  150   2HB   GLU  21          2HB       GLU  21   6.984  12.688  -7.535
  151   1HG   GLU  21          1HG       GLU  21   9.265  12.952  -6.273
  152   2HG   GLU  21          2HG       GLU  21  10.052  12.644  -7.811
  153    H    PHE  22           H        PHE  22   5.542  10.854  -9.479
  154    HA   PHE  22           HA       PHE  22   6.068   7.973  -9.009
  155   1HB   PHE  22          1HB       PHE  22   3.570   9.546  -9.823
  156   2HB   PHE  22          2HB       PHE  22   3.576   7.806  -9.905
  157    HD1  PHE  22           HD1      PHE  22   4.597  10.457  -7.365
  158    HD2  PHE  22           HD2      PHE  22   2.788   6.611  -8.043
  159    HE1  PHE  22           HE1      PHE  22   4.116  10.249  -4.963
  160    HE2  PHE  22           HE2      PHE  22   2.315   6.422  -5.635
  161    HZ   PHE  22           HZ       PHE  22   2.947   8.250  -4.097
  162    H    LYS  23           H        LYS  23   5.751  10.068 -11.809
  163    HA   LYS  23           HA       LYS  23   5.243   8.222 -13.972
  164   1HB   LYS  23          1HB       LYS  23   6.686  10.898 -13.831
  165   2HB   LYS  23          2HB       LYS  23   6.888   9.938 -15.280
  166   1HG   LYS  23          1HG       LYS  23   4.304  11.157 -14.178
  167   2HG   LYS  23          2HG       LYS  23   4.245   9.828 -15.323
  168   1HD   LYS  23          1HD       LYS  23   6.011  12.184 -16.074
  169   2HD   LYS  23          2HD       LYS  23   4.263  12.443 -16.116
  170   1HE   LYS  23          1HE       LYS  23   4.487   9.969 -17.442
  171   2HE   LYS  23          2HE       LYS  23   5.978  10.780 -17.945
  172   1HZ   LYS  23          1HZ       LYS  23   3.196  11.539 -18.480
  173   2HZ   LYS  23          2HZ       LYS  23   4.513  11.593 -19.475
  174   3HZ   LYS  23          3HZ       LYS  23   4.292  12.767 -18.334
  175    H    ALA  24           H        ALA  24   8.356   9.271 -12.565
  176    HA   ALA  24           HA       ALA  24  10.199   7.905 -14.305
  177   1HB   ALA  24          1HB       ALA  24  11.854   8.088 -12.457
  178   2HB   ALA  24          2HB       ALA  24  10.936   9.593 -12.649
  179   3HB   ALA  24          3HB       ALA  24  10.564   8.491 -11.299
  180    H    ALA  25           H        ALA  25   9.044   6.808 -11.093
  181    HA   ALA  25           HA       ALA  25  10.271   4.154 -11.130
  182   1HB   ALA  25          1HB       ALA  25   8.816   3.667  -9.173
  183   2HB   ALA  25          2HB       ALA  25   9.577   5.263  -9.025
  184   3HB   ALA  25          3HB       ALA  25   7.858   5.136  -9.477
  185    H    PHE  26           H        PHE  26   7.301   5.420 -12.463
  186    HA   PHE  26           HA       PHE  26   5.699   2.949 -12.605
  187   1HB   PHE  26          1HB       PHE  26   4.434   4.943 -12.798
  188   2HB   PHE  26          2HB       PHE  26   5.480   5.655 -13.998
  189    HD1  PHE  26           HD1      PHE  26   3.122   2.713 -13.520
  190    HD2  PHE  26           HD2      PHE  26   4.842   5.490 -16.320
  191    HE1  PHE  26           HE1      PHE  26   1.585   1.917 -15.270
  192    HE2  PHE  26           HE2      PHE  26   3.295   4.683 -18.057
  193    HZ   PHE  26           HZ       PHE  26   1.692   2.873 -17.547
  194    H    ASP  27           H        ASP  27   8.056   4.524 -14.714
  195    HA   ASP  27           HA       ASP  27   7.847   2.627 -17.002
  196   1HB   ASP  27          1HB       ASP  27  10.165   3.595 -17.641
  197   2HB   ASP  27          2HB       ASP  27  10.013   4.665 -16.266
  198    H    MET  28           H        MET  28   9.820   2.946 -14.080
  199    HA   MET  28           HA       MET  28  11.769   0.872 -14.365
  200   1HB   MET  28          1HB       MET  28  11.214   2.469 -12.270
  201   2HB   MET  28          2HB       MET  28  10.334   1.065 -11.694
  202   1HG   MET  28          1HG       MET  28  12.583  -0.286 -12.132
  203   2HG   MET  28          2HG       MET  28  13.345   1.312 -12.194
  204   1HE   MET  28          1HE       MET  28  13.830   2.845 -10.189
  205   2HE   MET  28          2HE       MET  28  14.074   2.018  -8.621
  206   3HE   MET  28          3HE       MET  28  14.833   1.362 -10.102
  207    H    PHE  29           H        PHE  29   8.353   0.622 -13.410
  208    HA   PHE  29           HA       PHE  29   8.390  -2.316 -12.927
  209   1HB   PHE  29          1HB       PHE  29   5.909  -0.546 -13.349
  210   2HB   PHE  29          2HB       PHE  29   5.937  -2.149 -12.664
  211    HD1  PHE  29           HD1      PHE  29   8.743  -1.340 -11.089
  212    HD2  PHE  29           HD2      PHE  29   4.751   0.264 -11.257
  213    HE1  PHE  29           HE1      PHE  29   9.000  -0.429  -8.817
  214    HE2  PHE  29           HE2      PHE  29   5.028   1.159  -8.982
  215    HZ   PHE  29           HZ       PHE  29   7.143   0.809  -7.757
  216    H    ASP  30           H        ASP  30   7.513  -0.129 -15.562
  217    HA   ASP  30           HA       ASP  30   6.084  -1.815 -17.371
  218   1HB   ASP  30          1HB       ASP  30   8.164   0.117 -18.490
  219   2HB   ASP  30          2HB       ASP  30   6.787   0.732 -17.606
  220    H    ALA  31           H        ALA  31   9.624  -1.317 -17.235
  221    HA   ALA  31           HA       ALA  31  11.412  -2.930 -17.484
  222   1HB   ALA  31          1HB       ALA  31  10.947  -5.288 -18.125
  223   2HB   ALA  31          2HB       ALA  31   9.912  -4.761 -16.784
  224   3HB   ALA  31          3HB       ALA  31   9.235  -4.907 -18.427
  225    H    ASP  32           H        ASP  32   8.939  -2.715 -20.038
  226    HA   ASP  32           HA       ASP  32  11.067  -2.687 -22.215
  227   1HB   ASP  32          1HB       ASP  32   8.735  -2.565 -23.650
  228   2HB   ASP  32          2HB       ASP  32   9.580  -4.036 -23.225
  229    H    GLY  33           H        GLY  33   7.942  -0.984 -21.956
  230   1HA   GLY  33          1HA       GLY  33   8.116   1.650 -21.535
  231   2HA   GLY  33          2HA       GLY  33   9.341   1.602 -22.782
  232    H    GLY  34           H        GLY  34   6.288  -0.224 -22.648
  233   1HA   GLY  34          1HA       GLY  34   5.323   0.683 -25.332
  234   2HA   GLY  34          2HA       GLY  34   4.427  -0.341 -24.202
  235    H    GLY  35           H        GLY  35   3.642   0.766 -22.189
  236   1HA   GLY  35          1HA       GLY  35   3.379   3.586 -21.725
  237   2HA   GLY  35          2HA       GLY  35   2.042   3.206 -22.819
  238    H    ASP  36           H        ASP  36   1.708   0.482 -21.849
  239    HA   ASP  36           HA       ASP  36   0.574   0.941 -19.037
  240   1HB   ASP  36          1HB       ASP  36  -0.870  -1.192 -20.433
  241   2HB   ASP  36          2HB       ASP  36  -1.474   0.218 -19.594
  242    H    ILE  37           H        ILE  37   0.531  -0.914 -17.686
  243    HA   ILE  37           HA       ILE  37   2.989  -2.656 -18.077
  244    HB   ILE  37           HB       ILE  37   1.555  -2.792 -15.459
  245   1HG1  ILE  37          1HG1      ILE  37   2.829  -0.184 -16.395
  246   2HG1  ILE  37          2HG1      ILE  37   1.370  -0.440 -15.457
  247   1HG2  ILE  37          1HG2      ILE  37   3.832  -3.038 -14.551
  248   2HG2  ILE  37          2HG2      ILE  37   3.619  -4.124 -15.932
  249   3HG2  ILE  37          3HG2      ILE  37   4.555  -2.622 -16.124
  250   1HD1  ILE  37          1HD1      ILE  37   4.227  -0.754 -14.354
  251   2HD1  ILE  37          2HD1      ILE  37   3.061   0.539 -13.997
  252   3HD1  ILE  37          3HD1      ILE  37   2.739  -1.119 -13.439
  253    H    SER  38           H        SER  38   2.837  -4.895 -17.141
  254    HA   SER  38           HA       SER  38   0.145  -6.251 -17.662
  255   1HB   SER  38          1HB       SER  38   0.892  -7.647 -19.350
  256   2HB   SER  38          2HB       SER  38   1.793  -6.177 -19.730
  257    HG   SER  38           HG       SER  38   2.649  -8.606 -18.716
  258    H    THR  39           H        THR  39   0.892  -8.825 -17.405
  259    HA   THR  39           HA       THR  39   1.531  -9.085 -14.475
  260    HB   THR  39           HB       THR  39   1.190 -11.701 -15.463
  261    HG1  THR  39           HG1      THR  39   0.372 -11.194 -17.337
  262   1HG2  THR  39          1HG2      THR  39  -0.976 -11.697 -14.307
  263   2HG2  THR  39          2HG2      THR  39   0.196 -10.791 -13.322
  264   3HG2  THR  39          3HG2      THR  39  -1.029  -9.919 -14.281
  265    H    LYS  40           H        LYS  40   2.755 -10.397 -17.575
  266    HA   LYS  40           HA       LYS  40   5.065 -11.807 -16.566
  267   1HB   LYS  40          1HB       LYS  40   4.584 -10.518 -19.300
  268   2HB   LYS  40          2HB       LYS  40   4.199 -12.162 -18.861
  269   1HG   LYS  40          1HG       LYS  40   6.913 -12.191 -18.391
  270   2HG   LYS  40          2HG       LYS  40   6.873 -10.812 -19.458
  271   1HD   LYS  40          1HD       LYS  40   7.066 -13.550 -20.235
  272   2HD   LYS  40          2HD       LYS  40   5.409 -13.134 -20.564
  273   1HE   LYS  40          1HE       LYS  40   6.290 -11.038 -21.853
  274   2HE   LYS  40          2HE       LYS  40   7.858 -11.834 -21.856
  275   1HZ   LYS  40          1HZ       LYS  40   6.236 -12.225 -23.797
  276   2HZ   LYS  40          2HZ       LYS  40   5.440 -13.276 -22.802
  277   3HZ   LYS  40          3HZ       LYS  40   7.021 -13.550 -23.198
  278    H    GLU  41           H        GLU  41   4.520  -8.422 -17.399
  279    HA   GLU  41           HA       GLU  41   7.359  -7.538 -17.371
  280   1HB   GLU  41          1HB       GLU  41   6.350  -5.188 -17.294
  281   2HB   GLU  41          2HB       GLU  41   4.766  -5.932 -17.326
  282   1HG   GLU  41          1HG       GLU  41   6.892  -6.199 -19.546
  283   2HG   GLU  41          2HG       GLU  41   5.341  -7.010 -19.557
  284    H    LEU  42           H        LEU  42   4.604  -6.808 -15.201
  285    HA   LEU  42           HA       LEU  42   6.023  -5.407 -13.116
  286   1HB   LEU  42          1HB       LEU  42   3.598  -5.349 -13.144
  287   2HB   LEU  42          2HB       LEU  42   3.463  -7.089 -13.015
  288    HG   LEU  42           HG       LEU  42   4.714  -6.711 -10.646
  289   1HD1  LEU  42          1HD1      LEU  42   1.718  -6.059 -10.968
  290   2HD1  LEU  42          2HD1      LEU  42   2.385  -7.696 -11.074
  291   3HD1  LEU  42          3HD1      LEU  42   2.519  -6.784  -9.550
  292   1HD2  LEU  42          1HD2      LEU  42   4.105  -4.598  -9.522
  293   2HD2  LEU  42          2HD2      LEU  42   4.997  -4.194 -11.009
  294   3HD2  LEU  42          3HD2      LEU  42   3.233  -4.020 -10.966
  295    H    GLY  43           H        GLY  43   5.565  -8.849 -13.712
  296   1HA   GLY  43          1HA       GLY  43   6.246 -10.100 -11.228
  297   2HA   GLY  43          2HA       GLY  43   6.629 -10.814 -12.799
  298    H    THR  44           H        THR  44   8.440  -9.097 -13.866
  299    HA   THR  44           HA       THR  44  10.931 -10.094 -12.887
  300    HB   THR  44           HB       THR  44  10.177  -8.013 -14.863
  301    HG1  THR  44           HG1      THR  44  11.979  -9.128 -15.882
  302   1HG2  THR  44          1HG2      THR  44  12.492  -7.116 -15.170
  303   2HG2  THR  44          2HG2      THR  44  11.794  -6.579 -13.627
  304   3HG2  THR  44          3HG2      THR  44  13.006  -7.885 -13.648
  305    H    VAL  45           H        VAL  45   9.584  -6.819 -12.400
  306    HA   VAL  45           HA       VAL  45  11.709  -5.715 -10.765
  307    HB   VAL  45           HB       VAL  45   8.930  -4.900 -11.416
  308   1HG1  VAL  45          1HG1      VAL  45   8.702  -3.196  -9.607
  309   2HG1  VAL  45          2HG1      VAL  45   8.681  -4.826  -8.922
  310   3HG1  VAL  45          3HG1      VAL  45  10.151  -3.834  -8.786
  311   1HG2  VAL  45          1HG2      VAL  45  11.510  -3.249 -10.998
  312   2HG2  VAL  45          2HG2      VAL  45  10.901  -3.851 -12.558
  313   3HG2  VAL  45          3HG2      VAL  45   9.972  -2.639 -11.663
  314    H    MET  46           H        MET  46   8.744  -7.492  -9.906
  315    HA   MET  46           HA       MET  46   8.756  -7.251  -7.039
  316   1HB   MET  46          1HB       MET  46   7.658  -9.656  -7.095
  317   2HB   MET  46          2HB       MET  46   7.738  -9.497  -8.840
  318   1HG   MET  46          1HG       MET  46   6.368  -7.342  -7.123
  319   2HG   MET  46          2HG       MET  46   6.223  -7.598  -8.870
  320   1HE   MET  46          1HE       MET  46   4.470  -8.004  -5.607
  321   2HE   MET  46          2HE       MET  46   3.844  -9.677  -5.536
  322   3HE   MET  46          3HE       MET  46   5.585  -9.367  -5.279
  323    NH1  ARG  47           NH1      ARG  47   7.364 -13.901  -5.631
  324    NH2  ARG  47           NH2      ARG  47   6.817 -15.551  -7.096
  325    H    ARG  47           H        ARG  47  10.042 -10.003  -8.934
  326    HA   ARG  47           HA       ARG  47  11.855 -10.897  -6.688
  327   1HB   ARG  47          1HB       ARG  47  12.531 -12.646  -8.584
  328   2HB   ARG  47          2HB       ARG  47  11.098 -12.042  -9.405
  329   1HG   ARG  47          1HG       ARG  47  10.818 -14.144  -7.883
  330   2HG   ARG  47          2HG       ARG  47  10.960 -13.048  -6.508
  331   1HD   ARG  47          1HD       ARG  47   8.832 -12.132  -6.813
  332   2HD   ARG  47          2HD       ARG  47   8.983 -12.114  -8.564
  333    HE   ARG  47           HE       ARG  47   8.297 -14.511  -8.671
  334   1HH1  ARG  47          1HH1      ARG  47   7.907 -13.050  -5.450
  335   2HH1  ARG  47          2HH1      ARG  47   6.724 -14.372  -4.981
  336   1HH2  ARG  47          1HH2      ARG  47   6.941 -15.960  -8.029
  337   2HH2  ARG  47          2HH2      ARG  47   6.216 -15.906  -6.344
  338    H    MET  48           H        MET  48  12.466  -8.330  -7.631
  339    HA   MET  48           HA       MET  48  14.719  -8.189  -9.537
  340   1HB   MET  48          1HB       MET  48  13.630  -6.334  -7.421
  341   2HB   MET  48          2HB       MET  48  15.329  -6.144  -7.812
  342   1HG   MET  48          1HG       MET  48  14.041  -6.295 -10.372
  343   2HG   MET  48          2HG       MET  48  12.977  -5.296  -9.368
  344   1HE   MET  48          1HE       MET  48  14.537  -3.615  -7.348
  345   2HE   MET  48          2HE       MET  48  15.107  -2.231  -8.326
  346   3HE   MET  48          3HE       MET  48  13.459  -2.878  -8.573
  347    H    LEU  49           H        LEU  49  14.356  -9.085  -6.159
  348    HA   LEU  49           HA       LEU  49  16.988  -8.901  -5.077
  349   1HB   LEU  49          1HB       LEU  49  16.430 -10.833  -3.591
  350   2HB   LEU  49          2HB       LEU  49  15.058 -11.249  -4.596
  351    HG   LEU  49           HG       LEU  49  15.227  -9.324  -2.387
  352   1HD1  LEU  49          1HD1      LEU  49  12.769 -10.285  -3.979
  353   2HD1  LEU  49          2HD1      LEU  49  13.540 -11.212  -2.679
  354   3HD1  LEU  49          3HD1      LEU  49  12.786  -9.639  -2.319
  355   1HD2  LEU  49          1HD2      LEU  49  13.963  -7.416  -3.280
  356   2HD2  LEU  49          2HD2      LEU  49  15.409  -7.609  -4.300
  357   3HD2  LEU  49          3HD2      LEU  49  13.838  -8.170  -4.889
  358    H    GLY  50           H        GLY  50  15.595 -11.792  -6.670
  359   1HA   GLY  50          1HA       GLY  50  17.427 -12.373  -8.702
  360   2HA   GLY  50          2HA       GLY  50  18.333 -12.928  -7.289
  361    H    GLN  51           H        GLN  51  15.249 -13.311  -8.988
  362    HA   GLN  51           HA       GLN  51  15.314 -16.312  -8.489
  363   1HB   GLN  51          1HB       GLN  51  13.197 -14.469  -7.398
  364   2HB   GLN  51          2HB       GLN  51  12.607 -15.903  -8.216
  365   1HG   GLN  51          1HG       GLN  51  14.545 -15.869  -5.825
  366   2HG   GLN  51          2HG       GLN  51  12.840 -16.256  -5.760
  367   1HE2  GLN  51          1HE2      GLN  51  15.242 -19.349  -6.156
  368   2HE2  GLN  51          2HE2      GLN  51  15.446 -17.786  -5.217
  369    H    ASN  52           H        ASN  52  13.004 -16.990  -9.724
  370    HA   ASN  52           HA       ASN  52  12.593 -15.444 -12.251
  371   1HB   ASN  52          1HB       ASN  52  13.481 -18.344 -12.632
  372   2HB   ASN  52          2HB       ASN  52  14.678 -17.074 -12.501
  373   1HD2  ASN  52          1HD2      ASN  52  13.822 -17.612 -16.154
  374   2HD2  ASN  52          2HD2      ASN  52  14.414 -18.659 -14.768
  375    HA   PRO  53           HA       PRO  53   8.724 -17.827 -10.893
  376   1HB   PRO  53          1HB       PRO  53   6.852 -15.843 -11.285
  377   2HB   PRO  53          2HB       PRO  53   7.925 -15.927  -9.881
  378   1HG   PRO  53          1HG       PRO  53   8.217 -14.173 -12.360
  379   2HG   PRO  53          2HG       PRO  53   8.466 -13.719 -10.658
  380   1HD   PRO  53          1HD       PRO  53  10.699 -14.569 -10.681
  381   2HD   PRO  53          2HD       PRO  53  10.535 -14.459 -12.459
  382    H    THR  54           H        THR  54   6.487 -17.933 -12.172
  383    HA   THR  54           HA       THR  54   7.067 -18.271 -15.161
  384    HB   THR  54           HB       THR  54   6.625 -20.366 -13.585
  385    HG1  THR  54           HG1      THR  54   5.228 -20.219 -16.020
  386   1HG2  THR  54          1HG2      THR  54   4.294 -21.191 -13.649
  387   2HG2  THR  54          2HG2      THR  54   4.371 -19.680 -12.713
  388   3HG2  THR  54          3HG2      THR  54   3.728 -19.668 -14.375
  389    H    LYS  55           H        LYS  55   5.086 -18.172 -16.510
  390    HA   LYS  55           HA       LYS  55   3.812 -15.526 -16.118
  391   1HB   LYS  55          1HB       LYS  55   4.373 -16.059 -18.384
  392   2HB   LYS  55          2HB       LYS  55   3.662 -17.657 -18.310
  393   1HG   LYS  55          1HG       LYS  55   1.917 -15.156 -18.117
  394   2HG   LYS  55          2HG       LYS  55   2.456 -15.758 -19.674
  395   1HD   LYS  55          1HD       LYS  55   0.271 -16.758 -17.914
  396   2HD   LYS  55          2HD       LYS  55   0.524 -16.990 -19.637
  397   1HE   LYS  55          1HE       LYS  55   2.059 -18.611 -17.528
  398   2HE   LYS  55          2HE       LYS  55   0.512 -19.139 -18.186
  399   1HZ   LYS  55          1HZ       LYS  55   1.473 -19.573 -20.232
  400   2HZ   LYS  55          2HZ       LYS  55   2.767 -19.887 -19.255
  401   3HZ   LYS  55          3HZ       LYS  55   2.679 -18.455 -20.074
  402    H    GLU  56           H        GLU  56   2.850 -18.905 -15.836
  403    HA   GLU  56           HA       GLU  56  -0.051 -18.585 -15.698
  404   1HB   GLU  56          1HB       GLU  56   0.856 -20.752 -16.206
  405   2HB   GLU  56          2HB       GLU  56   1.795 -20.819 -14.727
  406   1HG   GLU  56          1HG       GLU  56   0.089 -21.922 -13.701
  407   2HG   GLU  56          2HG       GLU  56  -0.947 -20.516 -13.876
  408    H    GLU  57           H        GLU  57   2.339 -19.154 -13.091
  409    HA   GLU  57           HA       GLU  57   0.541 -18.844 -10.828
  410   1HB   GLU  57          1HB       GLU  57   3.509 -18.932 -11.140
  411   2HB   GLU  57          2HB       GLU  57   2.434 -19.879 -10.135
  412   1HG   GLU  57          1HG       GLU  57   4.185 -17.841  -9.260
  413   2HG   GLU  57          2HG       GLU  57   2.632 -17.016  -9.230
  414    H    LEU  58           H        LEU  58   2.395 -16.522 -12.721
  415    HA   LEU  58           HA       LEU  58   2.224 -14.215 -10.950
  416   1HB   LEU  58          1HB       LEU  58   3.369 -14.830 -13.503
  417   2HB   LEU  58          2HB       LEU  58   2.327 -13.450 -13.784
  418    HG   LEU  58           HG       LEU  58   4.424 -13.508 -11.525
  419   1HD1  LEU  58          1HD1      LEU  58   3.187 -11.060 -12.949
  420   2HD1  LEU  58          2HD1      LEU  58   2.585 -11.695 -11.411
  421   3HD1  LEU  58          3HD1      LEU  58   4.243 -11.052 -11.513
  422   1HD2  LEU  58          1HD2      LEU  58   6.022 -12.388 -13.034
  423   2HD2  LEU  58          2HD2      LEU  58   5.502 -13.913 -13.794
  424   3HD2  LEU  58          3HD2      LEU  58   4.834 -12.371 -14.361
  425    H    ASP  59           H        ASP  59   0.201 -15.373 -13.630
  426    HA   ASP  59           HA       ASP  59  -1.745 -13.294 -13.955
  427   1HB   ASP  59          1HB       ASP  59  -2.153 -16.329 -14.125
  428   2HB   ASP  59          2HB       ASP  59  -1.780 -15.228 -15.431
  429    H    ALA  60           H        ALA  60  -1.390 -15.706 -11.407
  430    HA   ALA  60           HA       ALA  60  -3.901 -15.240  -9.963
  431   1HB   ALA  60          1HB       ALA  60  -2.808 -16.441  -8.075
  432   2HB   ALA  60          2HB       ALA  60  -2.556 -17.287  -9.614
  433   3HB   ALA  60          3HB       ALA  60  -1.228 -16.346  -8.888
  434    H    ILE  61           H        ILE  61  -0.579 -14.023  -9.470
  435    HA   ILE  61           HA       ILE  61  -0.798 -12.351  -7.204
  436    HB   ILE  61           HB       ILE  61   0.876 -11.948  -9.711
  437   1HG1  ILE  61          1HG1      ILE  61   1.643 -12.786  -6.835
  438   2HG1  ILE  61          2HG1      ILE  61   2.697 -12.757  -8.241
  439   1HG2  ILE  61          1HG2      ILE  61   2.248 -10.251  -8.470
  440   2HG2  ILE  61          2HG2      ILE  61   0.611  -9.658  -8.746
  441   3HG2  ILE  61          3HG2      ILE  61   1.070 -10.256  -7.134
  442   1HD1  ILE  61          1HD1      ILE  61   1.518 -14.642  -9.312
  443   2HD1  ILE  61          2HD1      ILE  61   2.007 -15.077  -7.660
  444   3HD1  ILE  61          3HD1      ILE  61   0.310 -14.663  -7.998
  445    H    ILE  62           H        ILE  62  -1.567 -11.492 -10.592
  446    HA   ILE  62           HA       ILE  62  -2.501  -8.740 -10.010
  447    HB   ILE  62           HB       ILE  62  -2.539 -10.498 -12.478
  448   1HG1  ILE  62          1HG1      ILE  62  -0.458  -9.310 -12.204
  449   2HG1  ILE  62          2HG1      ILE  62  -1.244  -7.833 -11.686
  450   1HG2  ILE  62          1HG2      ILE  62  -3.766  -8.749 -13.798
  451   2HG2  ILE  62          2HG2      ILE  62  -4.807  -9.405 -12.537
  452   3HG2  ILE  62          3HG2      ILE  62  -4.060  -7.807 -12.315
  453   1HD1  ILE  62          1HD1      ILE  62  -2.073  -7.330 -13.968
  454   2HD1  ILE  62          2HD1      ILE  62  -0.320  -7.614 -13.986
  455   3HD1  ILE  62          3HD1      ILE  62  -1.424  -8.880 -14.571
  456    H    GLU  63           H        GLU  63  -3.962 -11.938 -10.330
  457    HA   GLU  63           HA       GLU  63  -6.753 -11.445 -10.386
  458   1HB   GLU  63          1HB       GLU  63  -5.727 -13.571  -8.472
  459   2HB   GLU  63          2HB       GLU  63  -5.370 -13.715 -10.182
  460   1HG   GLU  63          1HG       GLU  63  -7.347 -14.974 -10.011
  461   2HG   GLU  63          2HG       GLU  63  -8.021 -13.977  -8.734
  462    H    GLU  64           H        GLU  64  -4.607 -11.452  -7.536
  463    HA   GLU  64           HA       GLU  64  -6.469 -10.922  -5.398
  464   1HB   GLU  64          1HB       GLU  64  -3.828  -9.485  -5.265
  465   2HB   GLU  64          2HB       GLU  64  -3.748 -11.218  -5.517
  466   1HG   GLU  64          1HG       GLU  64  -4.317 -11.680  -3.336
  467   2HG   GLU  64          2HG       GLU  64  -5.650 -10.538  -3.330
  468    H    VAL  65           H        VAL  65  -4.430  -8.463  -7.019
  469    HA   VAL  65           HA       VAL  65  -6.342  -6.226  -6.452
  470    HB   VAL  65           HB       VAL  65  -3.719  -6.095  -6.630
  471   1HG1  VAL  65          1HG1      VAL  65  -2.844  -5.296  -8.832
  472   2HG1  VAL  65          2HG1      VAL  65  -3.465  -6.952  -8.964
  473   3HG1  VAL  65          3HG1      VAL  65  -4.423  -5.593  -9.601
  474   1HG2  VAL  65          1HG2      VAL  65  -5.481  -3.840  -7.816
  475   2HG2  VAL  65          2HG2      VAL  65  -5.128  -4.103  -6.091
  476   3HG2  VAL  65          3HG2      VAL  65  -3.822  -3.651  -7.196
  477    H    ASP  66           H        ASP  66  -5.953  -4.955  -9.070
  478    HA   ASP  66           HA       ASP  66  -7.151  -4.700 -11.131
  479   1HB   ASP  66          1HB       ASP  66  -5.865  -7.313 -11.259
  480   2HB   ASP  66          2HB       ASP  66  -7.426  -7.428 -12.037
  481    H    GLU  67           H        GLU  67  -8.886  -4.123  -9.668
  482    HA   GLU  67           HA       GLU  67 -11.127  -6.071  -9.165
  483   1HB   GLU  67          1HB       GLU  67 -11.677  -3.190  -8.648
  484   2HB   GLU  67          2HB       GLU  67 -10.237  -3.777  -7.837
  485   1HG   GLU  67          1HG       GLU  67 -11.679  -5.704  -6.864
  486   2HG   GLU  67          2HG       GLU  67 -12.015  -4.089  -6.263
  487    H    ASP  68           H        ASP  68 -10.129  -3.906 -11.649
  488    HA   ASP  68           HA       ASP  68 -12.845  -3.242 -12.720
  489   1HB   ASP  68          1HB       ASP  68 -11.866  -1.759 -14.142
  490   2HB   ASP  68          2HB       ASP  68 -10.559  -1.875 -12.986
  491    H    GLY  69           H        GLY  69 -10.157  -5.411 -13.642
  492   1HA   GLY  69          1HA       GLY  69 -12.094  -6.985 -15.447
  493   2HA   GLY  69          2HA       GLY  69 -10.975  -7.803 -14.362
  494    H    SER  70           H        SER  70 -10.246  -4.929 -16.282
  495    HA   SER  70           HA       SER  70  -9.332  -5.753 -18.757
  496   1HB   SER  70          1HB       SER  70  -9.261  -3.397 -17.849
  497   2HB   SER  70          2HB       SER  70  -7.885  -3.836 -18.867
  498    HG   SER  70           HG       SER  70  -7.661  -4.317 -16.128
  499    H    GLY  71           H        GLY  71  -7.549  -6.166 -15.708
  500   1HA   GLY  71          1HA       GLY  71  -5.923  -8.435 -16.920
  501   2HA   GLY  71          2HA       GLY  71  -6.086  -8.097 -15.193
  502    H    THR  72           H        THR  72  -5.377  -5.535 -17.461
  503    HA   THR  72           HA       THR  72  -2.417  -5.495 -16.794
  504    HB   THR  72           HB       THR  72  -2.424  -3.419 -18.360
  505    HG1  THR  72           HG1      THR  72  -4.089  -3.215 -19.686
  506   1HG2  THR  72          1HG2      THR  72  -2.264  -4.742 -20.430
  507   2HG2  THR  72          2HG2      THR  72  -1.455  -5.628 -19.119
  508   3HG2  THR  72          3HG2      THR  72  -3.068  -6.139 -19.681
  509    H    ILE  73           H        ILE  73  -1.595  -3.154 -16.389
  510    HA   ILE  73           HA       ILE  73  -3.380  -1.578 -14.488
  511    HB   ILE  73           HB       ILE  73  -0.663  -2.726 -13.673
  512   1HG1  ILE  73          1HG1      ILE  73  -3.538  -3.268 -12.777
  513   2HG1  ILE  73          2HG1      ILE  73  -2.257  -3.385 -11.590
  514   1HG2  ILE  73          1HG2      ILE  73  -0.808  -1.403 -11.567
  515   2HG2  ILE  73          2HG2      ILE  73  -0.833  -0.307 -12.956
  516   3HG2  ILE  73          3HG2      ILE  73  -2.342  -0.663 -12.081
  517   1HD1  ILE  73          1HD1      ILE  73  -1.074  -5.151 -12.868
  518   2HD1  ILE  73          2HD1      ILE  73  -2.768  -5.604 -12.581
  519   3HD1  ILE  73          3HD1      ILE  73  -2.268  -5.027 -14.189
  520    H    ASP  74           H        ASP  74  -3.479   0.068 -15.906
  521    HA   ASP  74           HA       ASP  74  -1.129   1.140 -17.423
  522   1HB   ASP  74          1HB       ASP  74  -2.664   2.065 -18.760
  523   2HB   ASP  74          2HB       ASP  74  -3.255   3.077 -17.464
  524    H    PHE  75           H        PHE  75  -1.288   3.816 -17.227
  525    HA   PHE  75           HA       PHE  75   0.106   4.451 -14.700
  526   1HB   PHE  75          1HB       PHE  75  -0.892   6.353 -16.908
  527   2HB   PHE  75          2HB       PHE  75   0.650   5.542 -16.903
  528    HD1  PHE  75           HD1      PHE  75   1.554   7.949 -17.147
  529    HD2  PHE  75           HD2      PHE  75  -0.350   6.580 -13.538
  530    HE1  PHE  75           HE1      PHE  75   2.410   9.914 -15.938
  531    HE2  PHE  75           HE2      PHE  75   0.512   8.557 -12.348
  532    HZ   PHE  75           HZ       PHE  75   1.870  10.234 -13.547
  533    H    GLU  76           H        GLU  76  -3.064   5.270 -16.100
  534    HA   GLU  76           HA       GLU  76  -4.057   7.072 -14.062
  535   1HB   GLU  76          1HB       GLU  76  -5.385   5.428 -16.205
  536   2HB   GLU  76          2HB       GLU  76  -6.403   6.012 -14.907
  537   1HG   GLU  76          1HG       GLU  76  -5.971   8.344 -15.455
  538   2HG   GLU  76          2HG       GLU  76  -4.591   7.938 -16.453
  539    H    GLU  77           H        GLU  77  -4.448   3.548 -14.414
  540    HA   GLU  77           HA       GLU  77  -5.994   3.161 -11.908
  541   1HB   GLU  77          1HB       GLU  77  -6.415   1.543 -13.569
  542   2HB   GLU  77          2HB       GLU  77  -4.721   1.252 -13.891
  543   1HG   GLU  77          1HG       GLU  77  -6.071   0.455 -11.236
  544   2HG   GLU  77          2HG       GLU  77  -4.448   0.012 -11.752
  545    H    PHE  78           H        PHE  78  -2.606   3.120 -12.801
  546    HA   PHE  78           HA       PHE  78  -1.436   1.766 -10.529
  547   1HB   PHE  78          1HB       PHE  78  -0.295   4.021 -12.285
  548   2HB   PHE  78          2HB       PHE  78  -0.088   2.305 -12.527
  549    HD1  PHE  78           HD1      PHE  78   0.664   1.372  -9.727
  550    HD2  PHE  78           HD2      PHE  78   1.823   4.940 -11.833
  551    HE1  PHE  78           HE1      PHE  78   2.687   1.551  -8.335
  552    HE2  PHE  78           HE2      PHE  78   3.846   5.095 -10.441
  553    HZ   PHE  78           HZ       PHE  78   4.281   3.406  -8.691
  554    H    LEU  79           H        LEU  79  -2.387   5.147 -11.010
  555    HA   LEU  79           HA       LEU  79  -1.324   6.200  -8.461
  556   1HB   LEU  79          1HB       LEU  79  -2.611   8.256  -8.961
  557   2HB   LEU  79          2HB       LEU  79  -3.539   7.437 -10.199
  558    HG   LEU  79           HG       LEU  79  -1.182   7.028 -11.382
  559   1HD1  LEU  79          1HD1      LEU  79  -1.435   9.184 -12.616
  560   2HD1  LEU  79          2HD1      LEU  79  -3.019   8.440 -12.327
  561   3HD1  LEU  79          3HD1      LEU  79  -2.496   9.824 -11.335
  562   1HD2  LEU  79          1HD2      LEU  79  -0.487   9.447  -9.583
  563   2HD2  LEU  79          2HD2      LEU  79   0.299   7.850  -9.544
  564   3HD2  LEU  79          3HD2      LEU  79   0.472   8.879 -10.973
  565    H    VAL  80           H        VAL  80  -4.343   4.721  -9.470
  566    HA   VAL  80           HA       VAL  80  -5.977   5.463  -7.129
  567    HB   VAL  80           HB       VAL  80  -6.435   3.069  -8.982
  568   1HG1  VAL  80          1HG1      VAL  80  -8.842   3.308  -8.333
  569   2HG1  VAL  80          2HG1      VAL  80  -7.841   2.962  -6.916
  570   3HG1  VAL  80          3HG1      VAL  80  -8.425   4.618  -7.198
  571   1HG2  VAL  80          1HG2      VAL  80  -7.545   5.933  -9.319
  572   2HG2  VAL  80          2HG2      VAL  80  -6.320   5.178 -10.365
  573   3HG2  VAL  80          3HG2      VAL  80  -7.961   4.516 -10.314
  574    H    MET  81           H        MET  81  -3.900   2.715  -7.979
  575    HA   MET  81           HA       MET  81  -4.474   0.939  -5.702
  576   1HB   MET  81          1HB       MET  81  -3.248   0.259  -7.849
  577   2HB   MET  81          2HB       MET  81  -1.832   1.107  -7.253
  578   1HG   MET  81          1HG       MET  81  -2.057  -0.456  -5.102
  579   2HG   MET  81          2HG       MET  81  -3.095  -1.448  -6.141
  580   1HE   MET  81          1HE       MET  81  -0.973  -3.151  -5.269
  581   2HE   MET  81          2HE       MET  81   0.660  -3.058  -5.994
  582   3HE   MET  81          3HE       MET  81   0.155  -1.846  -4.781
  583    H    MET  82           H        MET  82  -1.988   3.429  -6.296
  584    HA   MET  82           HA       MET  82  -0.623   3.095  -3.681
  585   1HB   MET  82          1HB       MET  82  -0.363   5.069  -5.984
  586   2HB   MET  82          2HB       MET  82   0.403   5.444  -4.452
  587   1HG   MET  82          1HG       MET  82   0.899   2.714  -5.773
  588   2HG   MET  82          2HG       MET  82   1.754   4.155  -6.339
  589   1HE   MET  82          1HE       MET  82   4.396   2.596  -5.118
  590   2HE   MET  82          2HE       MET  82   2.934   1.616  -5.435
  591   3HE   MET  82          3HE       MET  82   3.725   1.541  -3.834
  592    H    VAL  83           H        VAL  83  -3.260   5.043  -4.911
  593    HA   VAL  83           HA       VAL  83  -3.203   7.251  -2.969
  594    HB   VAL  83           HB       VAL  83  -5.048   6.377  -5.125
  595   1HG1  VAL  83          1HG1      VAL  83  -4.409   9.219  -4.120
  596   2HG1  VAL  83          2HG1      VAL  83  -3.370   8.334  -5.245
  597   3HG1  VAL  83          3HG1      VAL  83  -5.035   8.740  -5.718
  598   1HG2  VAL  83          1HG2      VAL  83  -7.052   7.580  -4.417
  599   2HG2  VAL  83          2HG2      VAL  83  -6.677   6.426  -3.116
  600   3HG2  VAL  83          3HG2      VAL  83  -6.280   8.138  -2.911
  601    NH1  ARG  84           NH1      ARG  84 -11.169   0.439  -3.389
  602    NH2  ARG  84           NH2      ARG  84  -9.946  -1.474  -3.308
  603    H    ARG  84           H        ARG  84  -5.319   4.369  -3.252
  604    HA   ARG  84           HA       ARG  84  -6.904   4.652  -0.847
  605   1HB   ARG  84          1HB       ARG  84  -6.170   2.331  -2.636
  606   2HB   ARG  84          2HB       ARG  84  -6.685   1.914  -1.008
  607   1HG   ARG  84          1HG       ARG  84  -8.873   2.653  -1.296
  608   2HG   ARG  84          2HG       ARG  84  -8.441   3.921  -2.445
  609   1HD   ARG  84          1HD       ARG  84  -7.821   1.945  -4.101
  610   2HD   ARG  84          2HD       ARG  84  -9.521   2.361  -3.872
  611    HE   ARG  84           HE       ARG  84  -8.238   0.073  -2.285
  612   1HH1  ARG  84          1HH1      ARG  84  -9.028  -1.911  -3.171
  613   2HH1  ARG  84          2HH1      ARG  84 -10.832  -1.953  -3.504
  614   1HH2  ARG  84          1HH2      ARG  84 -11.174   1.465  -3.372
  615   2HH2  ARG  84          2HH2      ARG  84 -11.978  -0.178  -3.521
  616    H    GLN  85           H        GLN  85  -3.831   2.889  -1.354
  617    HA   GLN  85           HA       GLN  85  -3.504   1.850   1.366
  618   1HB   GLN  85          1HB       GLN  85  -2.236   1.282  -0.934
  619   2HB   GLN  85          2HB       GLN  85  -1.559   0.929   0.645
  620   1HG   GLN  85          1HG       GLN  85  -0.250   2.296  -1.382
  621   2HG   GLN  85          2HG       GLN  85  -0.850   3.651  -0.452
  622   1HE2  GLN  85          1HE2      GLN  85   2.387   3.069   1.174
  623   2HE2  GLN  85          2HE2      GLN  85   1.665   3.773  -0.359
  624    H    MET  86           H        MET  86  -2.606   4.864  -0.228
  625    HA   MET  86           HA       MET  86  -0.764   5.983   1.729
  626   1HB   MET  86          1HB       MET  86  -2.154   6.975  -0.667
  627   2HB   MET  86          2HB       MET  86  -2.187   8.192   0.595
  628   1HG   MET  86          1HG       MET  86   0.510   7.348   0.686
  629   2HG   MET  86          2HG       MET  86   0.120   7.228  -1.038
  630   1HE   MET  86          1HE       MET  86  -1.930   9.381  -1.840
  631   2HE   MET  86          2HE       MET  86  -0.920  10.834  -2.097
  632   3HE   MET  86          3HE       MET  86  -0.347   9.239  -2.666
  633    H    LYS  87           H        LYS  87  -4.287   6.007   1.461
  634    HA   LYS  87           HA       LYS  87  -4.936   8.008   3.500
  635   1HB   LYS  87          1HB       LYS  87  -7.179   6.597   3.683
  636   2HB   LYS  87          2HB       LYS  87  -6.532   5.676   2.332
  637   1HG   LYS  87          1HG       LYS  87  -7.179   7.224   0.836
  638   2HG   LYS  87          2HG       LYS  87  -6.263   8.491   1.634
  639   1HD   LYS  87          1HD       LYS  87  -9.201   7.837   1.770
  640   2HD   LYS  87          2HD       LYS  87  -8.477   8.262   3.317
  641   1HE   LYS  87          1HE       LYS  87  -7.454  10.303   1.659
  642   2HE   LYS  87          2HE       LYS  87  -9.057  10.037   0.961
  643   1HZ   LYS  87          1HZ       LYS  87  -9.105  10.110   3.842
  644   2HZ   LYS  87          2HZ       LYS  87 -10.025  10.942   2.750
  645   3HZ   LYS  87          3HZ       LYS  87  -8.534  11.512   3.178
  646    H    GLU  88           H        GLU  88  -4.414   4.498   3.625
  647    HA   GLU  88           HA       GLU  88  -5.235   3.852   6.313
  648   1HB   GLU  88          1HB       GLU  88  -4.711   1.917   5.260
  649   2HB   GLU  88          2HB       GLU  88  -3.429   2.622   4.294
  650   1HG   GLU  88          1HG       GLU  88  -1.974   2.588   6.494
  651   2HG   GLU  88          2HG       GLU  88  -3.241   1.593   7.190
  652    H    ASP  89           H        ASP  89  -2.045   4.936   5.113
  653    HA   ASP  89           HA       ASP  89  -0.631   5.167   7.614
  654   1HB   ASP  89          1HB       ASP  89  -0.242   6.757   5.021
  655   2HB   ASP  89          2HB       ASP  89   0.777   6.988   6.424
  656    H    ALA  90           H        ALA  90  -1.320   6.172   9.328
  657    HA   ALA  90           HA       ALA  90  -2.583   8.965   9.127
  658   1HB   ALA  90          1HB       ALA  90  -4.000   8.425  11.125
  659   2HB   ALA  90          2HB       ALA  90  -4.360   7.321   9.783
  660   3HB   ALA  90          3HB       ALA  90  -3.374   6.757  11.155
   
  Start of MODEL           8
 Raw file had  660 H/Q atoms
  Start of MODEL    8
    1   1H    ALA   1          1H        ALA   1 -20.683   0.004 -14.114
    2   2H    ALA   1          2H        ALA   1 -21.886   1.116 -14.493
    3   3H    ALA   1          3H        ALA   1 -21.787  -0.335 -15.336
    4    HA   ALA   1           HA       ALA   1 -19.511   0.339 -16.057
    5   1HB   ALA   1          1HB       ALA   1 -21.776   0.408 -17.406
    6   2HB   ALA   1          2HB       ALA   1 -20.392   1.310 -18.052
    7   3HB   ALA   1          3HB       ALA   1 -21.698   2.174 -17.202
    8    H    SER   2           H        SER   2 -18.456   1.333 -14.236
    9    HA   SER   2           HA       SER   2 -18.068   4.309 -14.597
   10   1HB   SER   2          1HB       SER   2 -19.956   3.606 -12.730
   11   2HB   SER   2          2HB       SER   2 -18.513   3.605 -11.713
   12    HG   SER   2           HG       SER   2 -18.373   5.664 -11.904
   13    H    MET   3           H        MET   3 -15.963   4.190 -15.010
   14    HA   MET   3           HA       MET   3 -14.090   2.805 -13.014
   15   1HB   MET   3          1HB       MET   3 -12.510   2.562 -15.101
   16   2HB   MET   3          2HB       MET   3 -13.786   1.391 -14.824
   17   1HG   MET   3          1HG       MET   3 -14.552   3.731 -16.589
   18   2HG   MET   3          2HG       MET   3 -13.320   2.638 -17.235
   19   1HE   MET   3          1HE       MET   3 -15.435   3.036 -18.825
   20   2HE   MET   3          2HE       MET   3 -17.090   2.560 -18.344
   21   3HE   MET   3          3HE       MET   3 -16.072   1.423 -19.275
   22    H    THR   4           H        THR   4 -15.096   5.498 -12.995
   23    HA   THR   4           HA       THR   4 -12.565   7.107 -13.550
   24    HB   THR   4           HB       THR   4 -15.053   8.682 -13.171
   25    HG1  THR   4           HG1      THR   4 -16.086   7.673 -14.579
   26   1HG2  THR   4          1HG2      THR   4 -14.045   9.615 -15.514
   27   2HG2  THR   4          2HG2      THR   4 -12.538   8.946 -14.849
   28   3HG2  THR   4          3HG2      THR   4 -13.443  10.186 -13.943
   29    H    ASP   5           H        ASP   5 -15.202   6.455 -11.277
   30    HA   ASP   5           HA       ASP   5 -14.562   8.076  -9.002
   31   1HB   ASP   5          1HB       ASP   5 -16.516   6.421  -9.196
   32   2HB   ASP   5          2HB       ASP   5 -15.765   6.609  -7.628
   33    H    GLN   6           H        GLN   6 -12.959   5.230 -10.294
   34    HA   GLN   6           HA       GLN   6 -11.259   4.452  -8.077
   35   1HB   GLN   6          1HB       GLN   6 -11.671   3.251 -10.379
   36   2HB   GLN   6          2HB       GLN   6 -10.352   4.236 -10.985
   37   1HG   GLN   6          1HG       GLN   6  -8.716   3.068  -9.831
   38   2HG   GLN   6          2HG       GLN   6  -9.718   2.781  -8.426
   39   1HE2  GLN   6          1HE2      GLN   6  -9.328  -0.163 -11.205
   40   2HE2  GLN   6          2HE2      GLN   6  -8.475   1.457 -11.331
   41    H    GLN   7           H        GLN   7 -10.546   6.593 -10.857
   42    HA   GLN   7           HA       GLN   7  -7.958   7.556  -9.567
   43   1HB   GLN   7          1HB       GLN   7  -7.371   8.525 -11.714
   44   2HB   GLN   7          2HB       GLN   7  -7.944   6.884 -11.982
   45   1HG   GLN   7          1HG       GLN   7 -10.311   8.084 -12.454
   46   2HG   GLN   7          2HG       GLN   7  -9.310   9.494 -12.766
   47   1HE2  GLN   7          1HE2      GLN   7  -9.552   6.503 -15.548
   48   2HE2  GLN   7          2HE2      GLN   7 -10.528   6.542 -13.995
   49    H    ALA   8           H        ALA   8 -10.826   8.294  -8.749
   50    HA   ALA   8           HA       ALA   8 -11.005  11.261  -9.295
   51   1HB   ALA   8          1HB       ALA   8 -13.127  11.146  -7.993
   52   2HB   ALA   8          2HB       ALA   8 -13.095   9.937  -9.291
   53   3HB   ALA   8          3HB       ALA   8 -12.830   9.435  -7.601
   54    H    GLU   9           H        GLU   9 -10.157   8.996  -6.727
   55    HA   GLU   9           HA       GLU   9  -9.960  11.051  -4.553
   56   1HB   GLU   9          1HB       GLU   9  -8.740   8.874  -3.415
   57   2HB   GLU   9          2HB       GLU   9 -10.468   9.195  -3.387
   58   1HG   GLU   9          1HG       GLU   9 -10.920   7.646  -5.236
   59   2HG   GLU   9          2HG       GLU   9  -9.209   7.454  -5.597
   60    H    ALA  10           H        ALA  10  -7.710   9.089  -6.499
   61    HA   ALA  10           HA       ALA  10  -5.234   9.956  -5.155
   62   1HB   ALA  10          1HB       ALA  10  -4.059   8.850  -7.052
   63   2HB   ALA  10          2HB       ALA  10  -5.350   7.820  -6.403
   64   3HB   ALA  10          3HB       ALA  10  -5.590   8.683  -7.944
   65    NH1  ARG  11           NH1      ARG  11  -3.454  11.321 -12.528
   66    NH2  ARG  11           NH2      ARG  11  -4.114  11.477 -14.696
   67    H    ARG  11           H        ARG  11  -7.049  11.058  -7.981
   68    HA   ARG  11           HA       ARG  11  -4.985  12.980  -9.002
   69   1HB   ARG  11          1HB       ARG  11  -7.735  12.090  -9.853
   70   2HB   ARG  11          2HB       ARG  11  -7.346  13.765 -10.215
   71   1HG   ARG  11          1HG       ARG  11  -5.390  11.538 -10.984
   72   2HG   ARG  11          2HG       ARG  11  -6.769  11.932 -12.013
   73   1HD   ARG  11          1HD       ARG  11  -5.966  14.394 -12.012
   74   2HD   ARG  11          2HD       ARG  11  -4.494  13.862 -11.196
   75    HE   ARG  11           HE       ARG  11  -4.750  13.807 -13.994
   76   1HH1  ARG  11          1HH1      ARG  11  -3.452  11.738 -11.590
   77   2HH1  ARG  11          2HH1      ARG  11  -3.006  10.443 -12.811
   78   1HH2  ARG  11          1HH2      ARG  11  -4.630  12.004 -15.409
   79   2HH2  ARG  11          2HH2      ARG  11  -3.605  10.597 -14.831
   80    H    ALA  12           H        ALA  12  -7.907  13.069  -7.020
   81    HA   ALA  12           HA       ALA  12  -8.190  16.029  -6.860
   82   1HB   ALA  12          1HB       ALA  12  -9.871  15.563  -5.088
   83   2HB   ALA  12          2HB       ALA  12 -10.150  14.553  -6.521
   84   3HB   ALA  12          3HB       ALA  12  -9.413  13.843  -5.063
   85    H    PHE  13           H        PHE  13  -6.480  13.518  -5.088
   86    HA   PHE  13           HA       PHE  13  -5.900  15.044  -2.623
   87   1HB   PHE  13          1HB       PHE  13  -4.407  12.591  -3.709
   88   2HB   PHE  13          2HB       PHE  13  -5.934  12.493  -2.873
   89    HD1  PHE  13           HD1      PHE  13  -3.209  14.941  -1.949
   90    HD2  PHE  13           HD2      PHE  13  -5.101  11.203  -0.961
   91    HE1  PHE  13           HE1      PHE  13  -1.967  14.860   0.174
   92    HE2  PHE  13           HE2      PHE  13  -3.856  11.144   1.159
   93    HZ   PHE  13           HZ       PHE  13  -2.285  12.965   1.729
   94    H    LEU  14           H        LEU  14  -4.030  14.176  -5.541
   95    HA   LEU  14           HA       LEU  14  -2.087  16.502  -5.049
   96   1HB   LEU  14          1HB       LEU  14  -0.543  14.914  -4.529
   97   2HB   LEU  14          2HB       LEU  14  -0.396  14.788  -6.268
   98    HG   LEU  14           HG       LEU  14  -2.321  12.940  -4.758
   99   1HD1  LEU  14          1HD1      LEU  14  -1.931  11.424  -6.703
  100   2HD1  LEU  14          2HD1      LEU  14  -2.527  13.002  -7.249
  101   3HD1  LEU  14          3HD1      LEU  14  -0.802  12.597  -7.427
  102   1HD2  LEU  14          1HD2      LEU  14   0.696  12.410  -5.195
  103   2HD2  LEU  14          2HD2      LEU  14  -0.114  12.631  -3.625
  104   3HD2  LEU  14          3HD2      LEU  14  -0.495  11.217  -4.619
  105    H    SER  15           H        SER  15  -1.674  17.697  -6.776
  106    HA   SER  15           HA       SER  15  -3.387  17.499  -9.184
  107   1HB   SER  15          1HB       SER  15  -1.494  19.485  -9.762
  108   2HB   SER  15          2HB       SER  15  -1.552  19.507  -7.997
  109    HG   SER  15           HG       SER  15  -3.505  20.078  -9.874
  110    H    GLU  16           H        GLU  16  -1.803  18.313 -11.249
  111    HA   GLU  16           HA       GLU  16  -0.659  15.796 -12.283
  112   1HB   GLU  16          1HB       GLU  16  -0.610  18.632 -13.438
  113   2HB   GLU  16          2HB       GLU  16  -1.789  17.381 -13.777
  114   1HG   GLU  16          1HG       GLU  16   1.144  17.516 -14.673
  115   2HG   GLU  16          2HG       GLU  16   0.297  15.978 -14.678
  116    H    GLU  17           H        GLU  17   0.607  18.731 -10.839
  117    HA   GLU  17           HA       GLU  17   3.430  18.470 -11.562
  118   1HB   GLU  17          1HB       GLU  17   2.018  20.034  -9.389
  119   2HB   GLU  17          2HB       GLU  17   2.887  20.610 -10.798
  120   1HG   GLU  17          1HG       GLU  17   5.079  20.068  -9.733
  121   2HG   GLU  17          2HG       GLU  17   4.278  19.280  -8.384
  122    H    MET  18           H        MET  18   1.555  17.321  -8.768
  123    HA   MET  18           HA       MET  18   3.867  16.126  -7.305
  124   1HB   MET  18          1HB       MET  18   0.864  16.175  -6.848
  125   2HB   MET  18          2HB       MET  18   1.796  14.907  -6.073
  126   1HG   MET  18          1HG       MET  18   1.368  17.391  -4.953
  127   2HG   MET  18          2HG       MET  18   2.935  17.683  -5.726
  128   1HE   MET  18          1HE       MET  18   5.206  16.562  -5.086
  129   2HE   MET  18          2HE       MET  18   5.339  15.062  -4.120
  130   3HE   MET  18          3HE       MET  18   4.552  15.021  -5.726
  131    H    ILE  19           H        ILE  19   1.360  15.049  -9.540
  132    HA   ILE  19           HA       ILE  19   1.660  12.149  -9.233
  133    HB   ILE  19           HB       ILE  19   0.233  13.945 -11.117
  134   1HG1  ILE  19          1HG1      ILE  19  -0.360  11.725  -9.261
  135   2HG1  ILE  19          2HG1      ILE  19  -1.087  11.396 -10.819
  136   1HG2  ILE  19          1HG2      ILE  19  -0.118  12.253 -12.933
  137   2HG2  ILE  19          2HG2      ILE  19   1.583  12.708 -12.846
  138   3HG2  ILE  19          3HG2      ILE  19   1.053  11.152 -12.166
  139   1HD1  ILE  19          1HD1      ILE  19  -2.371  13.517 -10.804
  140   2HD1  ILE  19          2HD1      ILE  19  -2.666  12.596  -9.315
  141   3HD1  ILE  19          3HD1      ILE  19  -1.586  14.009  -9.279
  142    H    ALA  20           H        ALA  20   3.333  14.623 -11.109
  143    HA   ALA  20           HA       ALA  20   4.841  13.098 -13.007
  144   1HB   ALA  20          1HB       ALA  20   6.479  14.977 -13.002
  145   2HB   ALA  20          2HB       ALA  20   4.807  15.573 -13.002
  146   3HB   ALA  20          3HB       ALA  20   5.772  15.629 -11.505
  147    H    GLU  21           H        GLU  21   5.465  13.684  -9.566
  148    HA   GLU  21           HA       GLU  21   8.179  12.700  -9.345
  149   1HB   GLU  21          1HB       GLU  21   7.208  12.079  -6.861
  150   2HB   GLU  21          2HB       GLU  21   5.935  13.161  -7.391
  151   1HG   GLU  21          1HG       GLU  21   7.838  14.252  -6.067
  152   2HG   GLU  21          2HG       GLU  21   8.933  13.900  -7.392
  153    H    PHE  22           H        PHE  22   5.046  11.060  -9.215
  154    HA   PHE  22           HA       PHE  22   6.091   8.320  -8.700
  155   1HB   PHE  22          1HB       PHE  22   3.344   8.931  -9.920
  156   2HB   PHE  22          2HB       PHE  22   3.839   7.531  -9.007
  157    HD1  PHE  22           HD1      PHE  22   3.376  11.267  -8.558
  158    HD2  PHE  22           HD2      PHE  22   3.473   7.405  -6.658
  159    HE1  PHE  22           HE1      PHE  22   2.739  12.293  -6.417
  160    HE2  PHE  22           HE2      PHE  22   2.827   8.452  -4.526
  161    HZ   PHE  22           HZ       PHE  22   2.505  10.898  -4.390
  162    H    LYS  23           H        LYS  23   5.408  10.323 -11.499
  163    HA   LYS  23           HA       LYS  23   5.134   8.412 -13.647
  164   1HB   LYS  23          1HB       LYS  23   5.146  11.153 -13.584
  165   2HB   LYS  23          2HB       LYS  23   6.761  10.908 -14.211
  166   1HG   LYS  23          1HG       LYS  23   4.464   9.441 -15.580
  167   2HG   LYS  23          2HG       LYS  23   4.601  11.179 -15.787
  168   1HD   LYS  23          1HD       LYS  23   7.200  10.548 -16.352
  169   2HD   LYS  23          2HD       LYS  23   6.468   8.999 -16.787
  170   1HE   LYS  23          1HE       LYS  23   5.049  11.453 -17.870
  171   2HE   LYS  23          2HE       LYS  23   6.656  11.135 -18.540
  172   1HZ   LYS  23          1HZ       LYS  23   5.581   8.686 -18.651
  173   2HZ   LYS  23          2HZ       LYS  23   5.462   9.783 -19.881
  174   3HZ   LYS  23          3HZ       LYS  23   4.207   9.588 -18.824
  175    H    ALA  24           H        ALA  24   8.051   9.830 -12.179
  176    HA   ALA  24           HA       ALA  24  10.086   8.863 -13.986
  177   1HB   ALA  24          1HB       ALA  24  11.689   9.193 -12.113
  178   2HB   ALA  24          2HB       ALA  24  10.558  10.553 -12.239
  179   3HB   ALA  24          3HB       ALA  24  10.349   9.340 -10.951
  180    H    ALA  25           H        ALA  25   8.912   7.410 -10.931
  181    HA   ALA  25           HA       ALA  25  10.552   4.953 -11.079
  182   1HB   ALA  25          1HB       ALA  25   9.189   4.183  -9.144
  183   2HB   ALA  25          2HB       ALA  25   9.749   5.850  -8.910
  184   3HB   ALA  25          3HB       ALA  25   8.054   5.537  -9.362
  185    H    PHE  26           H        PHE  26   7.493   5.929 -12.420
  186    HA   PHE  26           HA       PHE  26   6.141   3.349 -12.694
  187   1HB   PHE  26          1HB       PHE  26   4.741   5.238 -13.000
  188   2HB   PHE  26          2HB       PHE  26   5.800   6.010 -14.151
  189    HD1  PHE  26           HD1      PHE  26   2.813   4.114 -13.784
  190    HD2  PHE  26           HD2      PHE  26   6.159   4.519 -16.457
  191    HE1  PHE  26           HE1      PHE  26   1.455   3.224 -15.636
  192    HE2  PHE  26           HE2      PHE  26   4.787   3.624 -18.295
  193    HZ   PHE  26           HZ       PHE  26   2.442   2.962 -17.886
  194    H    ASP  27           H        ASP  27   8.511   5.075 -14.670
  195    HA   ASP  27           HA       ASP  27   8.475   3.214 -16.977
  196   1HB   ASP  27          1HB       ASP  27   9.240   5.635 -17.124
  197   2HB   ASP  27          2HB       ASP  27  10.688   5.209 -16.241
  198    H    MET  28           H        MET  28  10.277   3.494 -13.971
  199    HA   MET  28           HA       MET  28  12.399   1.493 -14.484
  200   1HB   MET  28          1HB       MET  28  11.303   2.002 -11.679
  201   2HB   MET  28          2HB       MET  28  12.203   3.256 -12.513
  202   1HG   MET  28          1HG       MET  28  14.247   1.976 -12.544
  203   2HG   MET  28          2HG       MET  28  13.407   0.447 -12.230
  204   1HE   MET  28          1HE       MET  28  13.041  -0.579  -9.947
  205   2HE   MET  28          2HE       MET  28  12.673   0.372  -8.477
  206   3HE   MET  28          3HE       MET  28  11.583   0.463  -9.892
  207    H    PHE  29           H        PHE  29   9.052   1.393 -13.397
  208    HA   PHE  29           HA       PHE  29   9.012  -1.459 -12.523
  209   1HB   PHE  29          1HB       PHE  29   7.366   0.524 -11.857
  210   2HB   PHE  29          2HB       PHE  29   6.516   0.120 -13.324
  211    HD1  PHE  29           HD1      PHE  29   4.561  -0.346 -11.714
  212    HD2  PHE  29           HD2      PHE  29   8.095  -2.806 -11.767
  213    HE1  PHE  29           HE1      PHE  29   3.388  -2.082 -10.422
  214    HE2  PHE  29           HE2      PHE  29   6.903  -4.524 -10.469
  215    HZ   PHE  29           HZ       PHE  29   4.562  -4.158  -9.777
  216    H    ASP  30           H        ASP  30   8.353   0.396 -15.451
  217    HA   ASP  30           HA       ASP  30   7.177  -1.775 -17.063
  218   1HB   ASP  30          1HB       ASP  30   7.185   0.889 -17.451
  219   2HB   ASP  30          2HB       ASP  30   8.610   0.543 -18.403
  220    H    ALA  31           H        ALA  31   8.517  -1.972 -19.361
  221    HA   ALA  31           HA       ALA  31  11.425  -2.725 -18.880
  222   1HB   ALA  31          1HB       ALA  31  11.083  -5.082 -19.633
  223   2HB   ALA  31          2HB       ALA  31  10.200  -4.734 -18.134
  224   3HB   ALA  31          3HB       ALA  31   9.320  -4.841 -19.681
  225    H    ASP  32           H        ASP  32   8.636  -2.746 -21.092
  226    HA   ASP  32           HA       ASP  32  10.359  -2.571 -23.576
  227   1HB   ASP  32          1HB       ASP  32   8.542  -3.150 -24.850
  228   2HB   ASP  32          2HB       ASP  32   8.090  -3.916 -23.345
  229    H    GLY  33           H        GLY  33   7.804  -0.658 -21.949
  230   1HA   GLY  33          1HA       GLY  33   7.847   1.791 -21.517
  231   2HA   GLY  33          2HA       GLY  33   9.238   1.914 -22.570
  232    H    GLY  34           H        GLY  34   5.802   0.909 -22.737
  233   1HA   GLY  34          1HA       GLY  34   4.386   1.107 -24.851
  234   2HA   GLY  34          2HA       GLY  34   5.457   2.409 -25.383
  235    H    GLY  35           H        GLY  35   3.318   1.589 -22.650
  236   1HA   GLY  35          1HA       GLY  35   2.889   4.216 -21.520
  237   2HA   GLY  35          2HA       GLY  35   1.704   4.075 -22.826
  238    H    ASP  36           H        ASP  36   2.965   1.559 -20.652
  239    HA   ASP  36           HA       ASP  36   0.851   1.218 -18.762
  240   1HB   ASP  36          1HB       ASP  36  -0.863   1.012 -20.400
  241   2HB   ASP  36          2HB       ASP  36  -0.585  -0.596 -19.771
  242    H    ILE  37           H        ILE  37   1.066  -0.679 -17.577
  243    HA   ILE  37           HA       ILE  37   3.589  -2.306 -18.096
  244    HB   ILE  37           HB       ILE  37   2.164  -2.855 -15.555
  245   1HG1  ILE  37          1HG1      ILE  37   2.756  -0.017 -16.169
  246   2HG1  ILE  37          2HG1      ILE  37   1.828  -0.720 -14.859
  247   1HG2  ILE  37          1HG2      ILE  37   4.451  -2.987 -14.647
  248   2HG2  ILE  37          2HG2      ILE  37   4.361  -3.880 -16.172
  249   3HG2  ILE  37          3HG2      ILE  37   5.131  -2.276 -16.131
  250   1HD1  ILE  37          1HD1      ILE  37   4.886  -0.369 -14.834
  251   2HD1  ILE  37          2HD1      ILE  37   3.681   0.541 -13.897
  252   3HD1  ILE  37          3HD1      ILE  37   3.947  -1.183 -13.553
  253    H    SER  38           H        SER  38   3.388  -4.649 -17.333
  254    HA   SER  38           HA       SER  38   0.704  -5.914 -18.086
  255   1HB   SER  38          1HB       SER  38   2.470  -5.857 -20.030
  256   2HB   SER  38          2HB       SER  38   1.566  -7.339 -19.711
  257    HG   SER  38           HG       SER  38   3.629  -7.932 -19.846
  258    H    THR  39           H        THR  39   1.335  -8.505 -17.805
  259    HA   THR  39           HA       THR  39   1.729  -8.830 -14.841
  260    HB   THR  39           HB       THR  39   1.411 -11.419 -15.786
  261    HG1  THR  39           HG1      THR  39   0.205 -11.431 -17.471
  262   1HG2  THR  39          1HG2      THR  39  -0.918 -11.306 -15.017
  263   2HG2  THR  39          2HG2      THR  39   0.096 -10.366 -13.898
  264   3HG2  THR  39          3HG2      THR  39  -0.924  -9.530 -15.098
  265    H    LYS  40           H        LYS  40   3.274  -9.873 -17.877
  266    HA   LYS  40           HA       LYS  40   5.400 -11.532 -16.752
  267   1HB   LYS  40          1HB       LYS  40   4.910 -11.789 -19.053
  268   2HB   LYS  40          2HB       LYS  40   5.069 -10.096 -19.439
  269   1HG   LYS  40          1HG       LYS  40   7.648 -10.702 -18.548
  270   2HG   LYS  40          2HG       LYS  40   7.138 -12.287 -19.066
  271   1HD   LYS  40          1HD       LYS  40   6.948 -11.601 -21.410
  272   2HD   LYS  40          2HD       LYS  40   6.900  -9.923 -20.955
  273   1HE   LYS  40          1HE       LYS  40   9.230  -9.765 -20.457
  274   2HE   LYS  40          2HE       LYS  40   9.473 -11.506 -20.456
  275   1HZ   LYS  40          1HZ       LYS  40   9.523 -11.542 -22.742
  276   2HZ   LYS  40          2HZ       LYS  40  10.047  -9.990 -22.527
  277   3HZ   LYS  40          3HZ       LYS  40   8.474 -10.281 -22.940
  278    H    GLU  41           H        GLU  41   5.059  -8.073 -17.430
  279    HA   GLU  41           HA       GLU  41   7.889  -7.342 -16.802
  280   1HB   GLU  41          1HB       GLU  41   7.336  -5.081 -17.269
  281   2HB   GLU  41          2HB       GLU  41   5.625  -5.327 -16.996
  282   1HG   GLU  41          1HG       GLU  41   7.252  -6.312 -19.417
  283   2HG   GLU  41          2HG       GLU  41   5.617  -6.851 -19.099
  284    H    LEU  42           H        LEU  42   4.743  -7.246 -15.189
  285    HA   LEU  42           HA       LEU  42   5.252  -5.824 -12.758
  286   1HB   LEU  42          1HB       LEU  42   3.699  -8.474 -12.884
  287   2HB   LEU  42          2HB       LEU  42   3.053  -6.965 -13.489
  288    HG   LEU  42           HG       LEU  42   2.426  -7.816 -11.055
  289   1HD1  LEU  42          1HD1      LEU  42   3.882  -6.891  -9.234
  290   2HD1  LEU  42          2HD1      LEU  42   4.739  -8.115 -10.184
  291   3HD1  LEU  42          3HD1      LEU  42   5.096  -6.389 -10.438
  292   1HD2  LEU  42          1HD2      LEU  42   3.161  -4.845 -11.517
  293   2HD2  LEU  42          2HD2      LEU  42   1.631  -5.627 -11.984
  294   3HD2  LEU  42          3HD2      LEU  42   2.050  -5.468 -10.269
  295    H    GLY  43           H        GLY  43   5.603  -9.362 -13.181
  296   1HA   GLY  43          1HA       GLY  43   7.100 -10.976 -12.153
  297   2HA   GLY  43          2HA       GLY  43   6.794 -10.048 -10.679
  298    H    THR  44           H        THR  44   8.273  -8.601 -13.507
  299    HA   THR  44           HA       THR  44  11.052  -9.147 -13.142
  300    HB   THR  44           HB       THR  44  10.124  -6.405 -14.105
  301    HG1  THR  44           HG1      THR  44  10.301  -7.838 -16.162
  302   1HG2  THR  44          1HG2      THR  44  12.020  -6.624 -15.720
  303   2HG2  THR  44          2HG2      THR  44  12.598  -6.675 -14.042
  304   3HG2  THR  44          3HG2      THR  44  12.482  -8.181 -14.988
  305    H    VAL  45           H        VAL  45   9.291  -6.263 -11.967
  306    HA   VAL  45           HA       VAL  45  11.553  -5.235 -10.350
  307    HB   VAL  45           HB       VAL  45   8.813  -4.299 -11.002
  308   1HG1  VAL  45          1HG1      VAL  45  11.352  -2.672 -10.363
  309   2HG1  VAL  45          2HG1      VAL  45  11.014  -3.359 -11.956
  310   3HG1  VAL  45          3HG1      VAL  45   9.916  -2.138 -11.274
  311   1HG2  VAL  45          1HG2      VAL  45   8.473  -2.771  -9.129
  312   2HG2  VAL  45          2HG2      VAL  45   8.660  -4.393  -8.422
  313   3HG2  VAL  45          3HG2      VAL  45  10.009  -3.249  -8.359
  314    H    MET  46           H        MET  46   8.697  -7.225  -9.791
  315    HA   MET  46           HA       MET  46   8.584  -7.371  -6.911
  316   1HB   MET  46          1HB       MET  46   8.024  -9.656  -8.895
  317   2HB   MET  46          2HB       MET  46   7.623  -9.683  -7.187
  318   1HG   MET  46          1HG       MET  46   6.177  -8.356  -9.428
  319   2HG   MET  46          2HG       MET  46   6.398  -7.279  -8.038
  320   1HE   MET  46          1HE       MET  46   4.869  -7.240  -6.029
  321   2HE   MET  46          2HE       MET  46   4.285  -8.719  -5.212
  322   3HE   MET  46          3HE       MET  46   6.041  -8.416  -5.354
  323    NH1  ARG  47           NH1      ARG  47  18.011 -11.523  -9.901
  324    NH2  ARG  47           NH2      ARG  47  18.713  -9.844  -8.539
  325    H    ARG  47           H        ARG  47  10.812  -8.816  -9.214
  326    HA   ARG  47           HA       ARG  47  12.049 -10.794  -7.366
  327   1HB   ARG  47          1HB       ARG  47  12.633 -11.651  -9.358
  328   2HB   ARG  47          2HB       ARG  47  12.187 -10.171 -10.195
  329   1HG   ARG  47          1HG       ARG  47  14.503  -9.195  -9.518
  330   2HG   ARG  47          2HG       ARG  47  14.460 -10.437 -10.770
  331   1HD   ARG  47          1HD       ARG  47  14.769 -11.569  -7.993
  332   2HD   ARG  47          2HD       ARG  47  15.582 -12.004  -9.489
  333    HE   ARG  47           HE       ARG  47  16.444  -9.632  -7.790
  334   1HH1  ARG  47          1HH1      ARG  47  17.228 -12.097 -10.233
  335   2HH1  ARG  47          2HH1      ARG  47  18.990 -11.586 -10.199
  336   1HH2  ARG  47          1HH2      ARG  47  18.470  -9.139  -7.834
  337   2HH2  ARG  47          2HH2      ARG  47  19.643 -10.025  -8.932
  338    H    MET  48           H        MET  48  12.681  -7.477  -8.346
  339    HA   MET  48           HA       MET  48  15.441  -7.076  -7.729
  340   1HB   MET  48          1HB       MET  48  13.085  -5.246  -7.851
  341   2HB   MET  48          2HB       MET  48  14.329  -4.701  -6.741
  342   1HG   MET  48          1HG       MET  48  14.314  -4.280  -9.527
  343   2HG   MET  48          2HG       MET  48  15.495  -5.587  -9.342
  344   1HE   MET  48          1HE       MET  48  14.624  -1.806  -8.658
  345   2HE   MET  48          2HE       MET  48  16.317  -1.232  -8.692
  346   3HE   MET  48          3HE       MET  48  15.663  -2.163 -10.072
  347    H    LEU  49           H        LEU  49  12.695  -7.412  -5.551
  348    HA   LEU  49           HA       LEU  49  14.356  -6.877  -3.068
  349   1HB   LEU  49          1HB       LEU  49  12.208  -5.897  -2.881
  350   2HB   LEU  49          2HB       LEU  49  12.168  -7.302  -1.838
  351    HG   LEU  49           HG       LEU  49  10.997  -7.358  -4.682
  352   1HD1  LEU  49          1HD1      LEU  49   9.436  -6.773  -2.088
  353   2HD1  LEU  49          2HD1      LEU  49   9.896  -5.539  -3.276
  354   3HD1  LEU  49          3HD1      LEU  49   8.777  -6.844  -3.742
  355   1HD2  LEU  49          1HD2      LEU  49   9.751  -9.346  -3.939
  356   2HD2  LEU  49          2HD2      LEU  49  11.463  -9.612  -3.525
  357   3HD2  LEU  49          3HD2      LEU  49  10.315  -9.147  -2.261
  358    H    GLY  50           H        GLY  50  15.336  -8.958  -4.508
  359   1HA   GLY  50          1HA       GLY  50  16.052 -11.275  -4.311
  360   2HA   GLY  50          2HA       GLY  50  15.820 -10.984  -2.583
  361    H    GLN  51           H        GLN  51  14.009 -11.801  -5.531
  362    HA   GLN  51           HA       GLN  51  12.613 -14.087  -4.154
  363   1HB   GLN  51          1HB       GLN  51  10.633 -12.267  -5.508
  364   2HB   GLN  51          2HB       GLN  51  11.272 -11.689  -3.981
  365   1HG   GLN  51          1HG       GLN  51  10.315 -14.562  -4.008
  366   2HG   GLN  51          2HG       GLN  51   9.082 -13.339  -4.216
  367   1HE2  GLN  51          1HE2      GLN  51   9.023 -12.544  -0.734
  368   2HE2  GLN  51          2HE2      GLN  51   8.193 -12.585  -2.370
  369    H    ASN  52           H        ASN  52  10.995 -15.022  -5.888
  370    HA   ASN  52           HA       ASN  52  11.776 -14.545  -8.738
  371   1HB   ASN  52          1HB       ASN  52  12.133 -17.413  -7.744
  372   2HB   ASN  52          2HB       ASN  52  13.449 -16.267  -7.602
  373   1HD2  ASN  52          1HD2      ASN  52  13.413 -18.262 -10.940
  374   2HD2  ASN  52          2HD2      ASN  52  13.361 -18.697  -9.158
  375    HA   PRO  53           HA       PRO  53   7.282 -15.894  -8.122
  376   1HB   PRO  53          1HB       PRO  53   6.576 -13.654  -8.216
  377   2HB   PRO  53          2HB       PRO  53   6.101 -14.127  -9.855
  378   1HG   PRO  53          1HG       PRO  53   7.990 -13.198 -10.901
  379   2HG   PRO  53          2HG       PRO  53   7.828 -12.045  -9.557
  380   1HD   PRO  53          1HD       PRO  53   9.700 -13.000  -8.399
  381   2HD   PRO  53          2HD       PRO  53  10.142 -13.586 -10.030
  382    H    THR  54           H        THR  54   5.508 -16.348  -9.916
  383    HA   THR  54           HA       THR  54   6.764 -17.712 -12.354
  384    HB   THR  54           HB       THR  54   6.166 -19.358 -10.535
  385    HG1  THR  54           HG1      THR  54   5.230 -20.757 -11.995
  386   1HG2  THR  54          1HG2      THR  54   3.818 -20.074 -10.231
  387   2HG2  THR  54          2HG2      THR  54   4.005 -18.389  -9.695
  388   3HG2  THR  54          3HG2      THR  54   3.233 -18.746 -11.261
  389    H    LYS  55           H        LYS  55   5.295 -17.997 -14.134
  390    HA   LYS  55           HA       LYS  55   4.019 -15.499 -14.901
  391   1HB   LYS  55          1HB       LYS  55   4.052 -18.288 -16.170
  392   2HB   LYS  55          2HB       LYS  55   4.923 -16.853 -16.671
  393   1HG   LYS  55          1HG       LYS  55   2.064 -16.291 -16.825
  394   2HG   LYS  55          2HG       LYS  55   3.278 -16.220 -18.091
  395   1HD   LYS  55          1HD       LYS  55   2.782 -18.410 -18.885
  396   2HD   LYS  55          2HD       LYS  55   1.210 -17.857 -18.331
  397   1HE   LYS  55          1HE       LYS  55   2.909 -19.339 -16.306
  398   2HE   LYS  55          2HE       LYS  55   1.155 -19.306 -16.465
  399   1HZ   LYS  55          1HZ       LYS  55   1.757 -21.408 -17.219
  400   2HZ   LYS  55          2HZ       LYS  55   3.116 -20.900 -18.009
  401   3HZ   LYS  55          3HZ       LYS  55   1.625 -20.602 -18.656
  402    H    GLU  56           H        GLU  56   2.774 -18.564 -13.663
  403    HA   GLU  56           HA       GLU  56  -0.093 -18.045 -14.097
  404   1HB   GLU  56          1HB       GLU  56   0.658 -19.939 -11.895
  405   2HB   GLU  56          2HB       GLU  56   1.373 -20.291 -13.456
  406   1HG   GLU  56          1HG       GLU  56  -0.557 -21.365 -14.013
  407   2HG   GLU  56          2HG       GLU  56  -1.358 -19.805 -14.094
  408    H    GLU  57           H        GLU  57   2.175 -17.522 -11.435
  409    HA   GLU  57           HA       GLU  57   0.204 -16.831  -9.342
  410   1HB   GLU  57          1HB       GLU  57   3.189 -16.777  -9.545
  411   2HB   GLU  57          2HB       GLU  57   2.137 -17.504  -8.350
  412   1HG   GLU  57          1HG       GLU  57   3.623 -15.021  -8.164
  413   2HG   GLU  57          2HG       GLU  57   1.924 -14.566  -8.125
  414    H    LEU  58           H        LEU  58   1.980 -15.050 -11.806
  415    HA   LEU  58           HA       LEU  58   1.516 -12.331 -10.763
  416   1HB   LEU  58          1HB       LEU  58   2.714 -13.559 -13.224
  417   2HB   LEU  58          2HB       LEU  58   2.011 -11.974 -13.474
  418    HG   LEU  58           HG       LEU  58   4.432 -11.824 -12.962
  419   1HD1  LEU  58          1HD1      LEU  58   4.414 -10.192 -11.035
  420   2HD1  LEU  58          2HD1      LEU  58   3.083  -9.875 -12.156
  421   3HD1  LEU  58          3HD1      LEU  58   2.759 -10.698 -10.611
  422   1HD2  LEU  58          1HD2      LEU  58   3.793 -13.161 -10.252
  423   2HD2  LEU  58          2HD2      LEU  58   4.673 -13.909 -11.608
  424   3HD2  LEU  58          3HD2      LEU  58   5.377 -12.521 -10.759
  425    H    ASP  59           H        ASP  59  -0.146 -14.520 -12.967
  426    HA   ASP  59           HA       ASP  59  -2.049 -12.643 -14.167
  427   1HB   ASP  59          1HB       ASP  59  -2.349 -15.687 -13.870
  428   2HB   ASP  59          2HB       ASP  59  -1.514 -14.871 -15.172
  429    H    ALA  60           H        ALA  60  -2.042 -14.569 -11.220
  430    HA   ALA  60           HA       ALA  60  -4.935 -14.148 -10.564
  431   1HB   ALA  60          1HB       ALA  60  -4.413 -15.398  -8.474
  432   2HB   ALA  60          2HB       ALA  60  -3.819 -16.256  -9.909
  433   3HB   ALA  60          3HB       ALA  60  -2.675 -15.380  -8.861
  434    H    ILE  61           H        ILE  61  -1.796 -12.829  -9.628
  435    HA   ILE  61           HA       ILE  61  -2.561 -11.202  -7.337
  436    HB   ILE  61           HB       ILE  61  -0.190 -11.385  -9.094
  437   1HG1  ILE  61          1HG1      ILE  61  -0.832 -11.738  -6.313
  438   2HG1  ILE  61          2HG1      ILE  61   0.692 -12.048  -7.116
  439   1HG2  ILE  61          1HG2      ILE  61   0.791  -9.138  -8.548
  440   2HG2  ILE  61          2HG2      ILE  61  -0.652  -8.959  -9.544
  441   3HG2  ILE  61          3HG2      ILE  61  -0.743  -8.631  -7.798
  442   1HD1  ILE  61          1HD1      ILE  61  -0.039  -9.379  -5.773
  443   2HD1  ILE  61          2HD1      ILE  61   1.121 -10.600  -5.208
  444   3HD1  ILE  61          3HD1      ILE  61   1.461  -9.681  -6.692
  445    H    ILE  62           H        ILE  62  -2.592 -10.622 -10.835
  446    HA   ILE  62           HA       ILE  62  -3.439  -7.767 -10.674
  447    HB   ILE  62           HB       ILE  62  -3.135  -9.720 -12.989
  448   1HG1  ILE  62          1HG1      ILE  62  -1.024  -8.723 -12.216
  449   2HG1  ILE  62          2HG1      ILE  62  -1.711  -7.113 -12.175
  450   1HG2  ILE  62          1HG2      ILE  62  -3.822  -7.929 -14.609
  451   2HG2  ILE  62          2HG2      ILE  62  -5.173  -8.358 -13.563
  452   3HG2  ILE  62          3HG2      ILE  62  -4.272  -6.855 -13.261
  453   1HD1  ILE  62          1HD1      ILE  62  -1.862  -6.984 -14.647
  454   2HD1  ILE  62          2HD1      ILE  62  -0.216  -7.416 -14.142
  455   3HD1  ILE  62          3HD1      ILE  62  -1.295  -8.670 -14.793
  456    H    GLU  63           H        GLU  63  -4.976 -10.905 -11.377
  457    HA   GLU  63           HA       GLU  63  -7.676 -10.181 -11.893
  458   1HB   GLU  63          1HB       GLU  63  -6.622 -12.595 -10.340
  459   2HB   GLU  63          2HB       GLU  63  -6.978 -12.497 -12.054
  460   1HG   GLU  63          1HG       GLU  63  -9.258 -11.997 -10.077
  461   2HG   GLU  63          2HG       GLU  63  -9.338 -12.616 -11.717
  462    H    GLU  64           H        GLU  64  -5.920 -10.245  -8.837
  463    HA   GLU  64           HA       GLU  64  -8.215  -9.903  -7.025
  464   1HB   GLU  64          1HB       GLU  64  -6.670 -10.518  -5.553
  465   2HB   GLU  64          2HB       GLU  64  -5.393 -10.337  -6.739
  466   1HG   GLU  64          1HG       GLU  64  -4.775  -8.172  -5.959
  467   2HG   GLU  64          2HG       GLU  64  -6.366  -7.823  -5.304
  468    H    VAL  65           H        VAL  65  -5.569  -7.601  -7.755
  469    HA   VAL  65           HA       VAL  65  -7.393  -5.266  -7.070
  470    HB   VAL  65           HB       VAL  65  -5.302  -5.332  -5.825
  471   1HG1  VAL  65          1HG1      VAL  65  -5.145  -2.957  -7.791
  472   2HG1  VAL  65          2HG1      VAL  65  -6.342  -3.079  -6.489
  473   3HG1  VAL  65          3HG1      VAL  65  -4.609  -3.000  -6.093
  474   1HG2  VAL  65          1HG2      VAL  65  -3.055  -5.124  -6.768
  475   2HG2  VAL  65          2HG2      VAL  65  -3.833  -6.480  -7.619
  476   3HG2  VAL  65          3HG2      VAL  65  -3.683  -4.909  -8.420
  477    H    ASP  66           H        ASP  66  -8.533  -5.733  -9.111
  478    HA   ASP  66           HA       ASP  66  -7.841  -3.808 -11.228
  479   1HB   ASP  66          1HB       ASP  66  -7.417  -6.733 -12.065
  480   2HB   ASP  66          2HB       ASP  66  -6.128  -5.593 -11.757
  481    H    GLU  67           H        GLU  67  -9.987  -3.625 -10.067
  482    HA   GLU  67           HA       GLU  67 -12.226  -5.414 -10.995
  483   1HB   GLU  67          1HB       GLU  67 -11.985  -4.420  -8.627
  484   2HB   GLU  67          2HB       GLU  67 -12.473  -2.875  -9.297
  485   1HG   GLU  67          1HG       GLU  67 -14.706  -3.698  -9.851
  486   2HG   GLU  67          2HG       GLU  67 -14.231  -5.376  -9.654
  487    H    ASP  68           H        ASP  68 -10.668  -3.738 -12.928
  488    HA   ASP  68           HA       ASP  68 -12.777  -1.760 -13.920
  489   1HB   ASP  68          1HB       ASP  68 -10.346  -0.945 -13.479
  490   2HB   ASP  68          2HB       ASP  68 -11.161  -0.449 -14.944
  491    H    GLY  69           H        GLY  69 -10.611  -4.416 -14.886
  492   1HA   GLY  69          1HA       GLY  69 -11.330  -6.304 -16.364
  493   2HA   GLY  69          2HA       GLY  69 -12.583  -5.255 -17.044
  494    H    SER  70           H        SER  70  -9.032  -5.100 -16.675
  495    HA   SER  70           HA       SER  70  -8.738  -4.563 -19.678
  496   1HB   SER  70          1HB       SER  70  -8.524  -2.386 -18.638
  497   2HB   SER  70          2HB       SER  70  -6.930  -2.900 -19.195
  498    HG   SER  70           HG       SER  70  -6.322  -3.314 -17.161
  499    H    GLY  71           H        GLY  71  -6.957  -5.288 -16.650
  500   1HA   GLY  71          1HA       GLY  71  -5.422  -7.541 -18.065
  501   2HA   GLY  71          2HA       GLY  71  -5.725  -7.478 -16.323
  502    H    THR  72           H        THR  72  -4.781  -4.665 -18.195
  503    HA   THR  72           HA       THR  72  -1.888  -4.843 -17.306
  504    HB   THR  72           HB       THR  72  -1.596  -2.780 -18.827
  505    HG1  THR  72           HG1      THR  72  -3.797  -3.585 -20.248
  506   1HG2  THR  72          1HG2      THR  72  -1.474  -4.059 -20.927
  507   2HG2  THR  72          2HG2      THR  72  -0.845  -5.066 -19.604
  508   3HG2  THR  72          3HG2      THR  72  -2.473  -5.372 -20.266
  509    H    ILE  73           H        ILE  73  -0.907  -3.323 -16.045
  510    HA   ILE  73           HA       ILE  73  -2.720  -1.624 -14.281
  511    HB   ILE  73           HB       ILE  73   0.157  -2.577 -13.879
  512   1HG1  ILE  73          1HG1      ILE  73  -2.543  -3.370 -12.687
  513   2HG1  ILE  73          2HG1      ILE  73  -1.133  -3.439 -11.651
  514   1HG2  ILE  73          1HG2      ILE  73   0.210  -1.385 -11.692
  515   2HG2  ILE  73          2HG2      ILE  73  -0.059  -0.218 -12.994
  516   3HG2  ILE  73          3HG2      ILE  73  -1.418  -0.721 -11.960
  517   1HD1  ILE  73          1HD1      ILE  73   0.026  -5.051 -13.137
  518   2HD1  ILE  73          2HD1      ILE  73  -1.588  -5.645 -12.696
  519   3HD1  ILE  73          3HD1      ILE  73  -1.312  -4.962 -14.316
  520    H    ASP  74           H        ASP  74  -3.118  -0.115 -15.947
  521    HA   ASP  74           HA       ASP  74  -0.985   1.464 -17.264
  522   1HB   ASP  74          1HB       ASP  74  -3.854   2.476 -17.050
  523   2HB   ASP  74          2HB       ASP  74  -2.673   2.763 -18.307
  524    H    PHE  75           H        PHE  75  -0.855   3.851 -17.008
  525    HA   PHE  75           HA       PHE  75   0.102   4.595 -14.369
  526   1HB   PHE  75          1HB       PHE  75  -0.815   6.603 -16.511
  527   2HB   PHE  75          2HB       PHE  75   0.664   5.693 -16.658
  528    HD1  PHE  75           HD1      PHE  75   2.262   5.818 -14.409
  529    HD2  PHE  75           HD2      PHE  75  -0.671   8.763 -15.526
  530    HE1  PHE  75           HE1      PHE  75   3.350   7.472 -12.946
  531    HE2  PHE  75           HE2      PHE  75   0.438  10.405 -14.063
  532    HZ   PHE  75           HZ       PHE  75   2.424   9.755 -12.748
  533    H    GLU  76           H        GLU  76  -3.082   4.677 -15.814
  534    HA   GLU  76           HA       GLU  76  -4.283   6.537 -13.775
  535   1HB   GLU  76          1HB       GLU  76  -6.170   6.664 -15.117
  536   2HB   GLU  76          2HB       GLU  76  -5.972   5.059 -15.793
  537   1HG   GLU  76          1HG       GLU  76  -4.615   7.662 -16.635
  538   2HG   GLU  76          2HG       GLU  76  -3.793   6.149 -16.952
  539    H    GLU  77           H        GLU  77  -3.171   4.223 -12.668
  540    HA   GLU  77           HA       GLU  77  -5.424   3.237 -11.011
  541   1HB   GLU  77          1HB       GLU  77  -4.694   0.713 -11.568
  542   2HB   GLU  77          2HB       GLU  77  -6.059   1.518 -12.306
  543   1HG   GLU  77          1HG       GLU  77  -3.366   0.810 -13.552
  544   2HG   GLU  77          2HG       GLU  77  -4.233   2.195 -14.205
  545    H    PHE  78           H        PHE  78  -2.080   2.775 -12.102
  546    HA   PHE  78           HA       PHE  78  -0.907   1.476  -9.837
  547   1HB   PHE  78          1HB       PHE  78   0.278   1.962 -12.020
  548   2HB   PHE  78          2HB       PHE  78   0.423   3.646 -11.586
  549    HD1  PHE  78           HD1      PHE  78   1.000   0.467  -9.545
  550    HD2  PHE  78           HD2      PHE  78   2.742   4.036 -11.199
  551    HE1  PHE  78           HE1      PHE  78   3.150  -0.074  -8.476
  552    HE2  PHE  78           HE2      PHE  78   4.887   3.474 -10.131
  553    HZ   PHE  78           HZ       PHE  78   5.100   1.415  -8.781
  554    H    LEU  79           H        LEU  79  -1.436   4.948 -10.416
  555    HA   LEU  79           HA       LEU  79  -0.245   5.891  -7.873
  556   1HB   LEU  79          1HB       LEU  79  -0.567   7.219 -10.100
  557   2HB   LEU  79          2HB       LEU  79  -0.709   8.055  -8.569
  558    HG   LEU  79           HG       LEU  79  -3.389   7.228  -9.188
  559   1HD1  LEU  79          1HD1      LEU  79  -2.095   8.496 -11.683
  560   2HD1  LEU  79          2HD1      LEU  79  -2.558   6.789 -11.557
  561   3HD1  LEU  79          3HD1      LEU  79  -3.808   8.054 -11.472
  562   1HD2  LEU  79          1HD2      LEU  79  -3.873   9.636  -9.295
  563   2HD2  LEU  79          2HD2      LEU  79  -2.609   9.411  -8.060
  564   3HD2  LEU  79          3HD2      LEU  79  -2.174  10.026  -9.662
  565    H    VAL  80           H        VAL  80  -3.456   4.944  -8.944
  566    HA   VAL  80           HA       VAL  80  -5.024   5.970  -6.693
  567    HB   VAL  80           HB       VAL  80  -5.587   3.797  -8.746
  568   1HG1  VAL  80          1HG1      VAL  80  -7.917   3.567  -7.856
  569   2HG1  VAL  80          2HG1      VAL  80  -6.734   2.997  -6.672
  570   3HG1  VAL  80          3HG1      VAL  80  -7.502   4.586  -6.454
  571   1HG2  VAL  80          1HG2      VAL  80  -6.997   6.495  -8.216
  572   2HG2  VAL  80          2HG2      VAL  80  -5.832   6.186  -9.524
  573   3HG2  VAL  80          3HG2      VAL  80  -7.385   5.338  -9.513
  574    H    MET  81           H        MET  81  -3.088   3.081  -7.214
  575    HA   MET  81           HA       MET  81  -3.980   1.573  -4.794
  576   1HB   MET  81          1HB       MET  81  -2.591   0.832  -7.096
  577   2HB   MET  81          2HB       MET  81  -1.289   0.908  -5.922
  578   1HG   MET  81          1HG       MET  81  -3.771  -0.897  -5.825
  579   2HG   MET  81          2HG       MET  81  -2.781  -0.619  -4.382
  580   1HE   MET  81          1HE       MET  81  -2.669  -1.659  -8.217
  581   2HE   MET  81          2HE       MET  81  -1.731  -3.175  -8.068
  582   3HE   MET  81          3HE       MET  81  -3.307  -3.019  -7.240
  583    H    MET  82           H        MET  82  -1.103   3.482  -5.711
  584    HA   MET  82           HA       MET  82   0.416   3.155  -3.245
  585   1HB   MET  82          1HB       MET  82   0.550   5.114  -5.554
  586   2HB   MET  82          2HB       MET  82   1.402   5.541  -4.082
  587   1HG   MET  82          1HG       MET  82   2.095   2.779  -4.622
  588   2HG   MET  82          2HG       MET  82   2.163   3.633  -6.169
  589   1HE   MET  82          1HE       MET  82   4.675   2.310  -4.215
  590   2HE   MET  82          2HE       MET  82   3.830   2.945  -2.772
  591   3HE   MET  82          3HE       MET  82   5.464   3.544  -3.182
  592    H    VAL  83           H        VAL  83  -2.150   5.366  -4.198
  593    HA   VAL  83           HA       VAL  83  -1.980   7.253  -1.931
  594    HB   VAL  83           HB       VAL  83  -3.974   6.759  -4.123
  595   1HG1  VAL  83          1HG1      VAL  83  -2.897   9.417  -2.993
  596   2HG1  VAL  83          2HG1      VAL  83  -2.062   8.489  -4.246
  597   3HG1  VAL  83          3HG1      VAL  83  -3.687   9.137  -4.567
  598   1HG2  VAL  83          1HG2      VAL  83  -5.748   8.153  -3.193
  599   2HG2  VAL  83          2HG2      VAL  83  -5.443   6.870  -1.999
  600   3HG2  VAL  83          3HG2      VAL  83  -4.811   8.499  -1.717
  601    NH1  ARG  84           NH1      ARG  84  -8.820  -0.415  -4.257
  602    NH2  ARG  84           NH2      ARG  84  -8.473  -1.733  -2.440
  603    H    ARG  84           H        ARG  84  -3.758   4.260  -2.618
  604    HA   ARG  84           HA       ARG  84  -5.527   4.146  -0.297
  605   1HB   ARG  84          1HB       ARG  84  -4.571   2.196  -2.367
  606   2HB   ARG  84          2HB       ARG  84  -4.950   1.463  -0.815
  607   1HG   ARG  84          1HG       ARG  84  -7.005   3.414  -1.880
  608   2HG   ARG  84          2HG       ARG  84  -7.238   1.949  -0.922
  609   1HD   ARG  84          1HD       ARG  84  -6.209   1.745  -3.807
  610   2HD   ARG  84          2HD       ARG  84  -7.936   1.944  -3.502
  611    HE   ARG  84           HE       ARG  84  -6.338  -0.391  -2.311
  612   1HH1  ARG  84          1HH1      ARG  84  -7.931  -1.906  -1.585
  613   2HH1  ARG  84          2HH1      ARG  84  -9.250  -2.296  -2.800
  614   1HH2  ARG  84          1HH2      ARG  84  -8.581   0.445  -4.762
  615   2HH2  ARG  84          2HH2      ARG  84  -9.531  -1.106  -4.523
  616    H    GLN  85           H        GLN  85  -2.162   3.175  -0.806
  617    HA   GLN  85           HA       GLN  85  -1.850   1.752   1.803
  618   1HB   GLN  85          1HB       GLN  85   0.736   2.104   1.005
  619   2HB   GLN  85          2HB       GLN  85  -0.051   2.398  -0.535
  620   1HG   GLN  85          1HG       GLN  85  -1.356   0.074   0.172
  621   2HG   GLN  85          2HG       GLN  85   0.080   0.143  -0.826
  622   1HE2  GLN  85          1HE2      GLN  85   0.928  -2.361   1.779
  623   2HE2  GLN  85          2HE2      GLN  85  -0.223  -2.171   0.363
  624    H    MET  86           H        MET  86  -1.214   4.958   0.485
  625    HA   MET  86           HA       MET  86   0.545   6.047   2.547
  626   1HB   MET  86          1HB       MET  86  -0.414   6.990   0.123
  627   2HB   MET  86          2HB       MET  86   0.573   7.877   1.269
  628   1HG   MET  86          1HG       MET  86  -1.761   8.613   2.365
  629   2HG   MET  86          2HG       MET  86  -2.483   7.987   0.876
  630   1HE   MET  86          1HE       MET  86  -3.270   9.778  -0.718
  631   2HE   MET  86          2HE       MET  86  -2.083  10.740  -1.648
  632   3HE   MET  86          3HE       MET  86  -1.965   8.956  -1.630
  633    H    LYS  87           H        LYS  87  -2.976   5.921   2.187
  634    HA   LYS  87           HA       LYS  87  -3.688   7.496   4.618
  635   1HB   LYS  87          1HB       LYS  87  -5.866   7.212   4.027
  636   2HB   LYS  87          2HB       LYS  87  -5.204   6.666   2.493
  637   1HG   LYS  87          1HG       LYS  87  -5.371   4.286   3.176
  638   2HG   LYS  87          2HG       LYS  87  -5.918   4.732   4.783
  639   1HD   LYS  87          1HD       LYS  87  -7.650   3.983   2.892
  640   2HD   LYS  87          2HD       LYS  87  -8.069   5.209   4.083
  641   1HE   LYS  87          1HE       LYS  87  -7.850   7.035   2.506
  642   2HE   LYS  87          2HE       LYS  87  -6.898   6.071   1.369
  643   1HZ   LYS  87          1HZ       LYS  87  -9.519   6.466   1.126
  644   2HZ   LYS  87          2HZ       LYS  87  -9.560   5.032   1.945
  645   3HZ   LYS  87          3HZ       LYS  87  -8.754   5.139   0.507
  646    H    GLU  88           H        GLU  88  -4.895   6.436   6.421
  647    HA   GLU  88           HA       GLU  88  -3.236   4.297   7.675
  648   1HB   GLU  88          1HB       GLU  88  -4.864   4.587   9.634
  649   2HB   GLU  88          2HB       GLU  88  -3.836   5.943   9.216
  650   1HG   GLU  88          1HG       GLU  88  -5.635   7.294   8.543
  651   2HG   GLU  88          2HG       GLU  88  -6.582   5.947   7.934
  652    H    ASP  89           H        ASP  89  -3.502   2.330   6.891
  653    HA   ASP  89           HA       ASP  89  -6.252   1.027   7.052
  654   1HB   ASP  89          1HB       ASP  89  -4.469   0.194   4.732
  655   2HB   ASP  89          2HB       ASP  89  -5.433   1.644   4.573
  656    H    ALA  90           H        ALA  90  -5.183   0.542   9.115
  657    HA   ALA  90           HA       ALA  90  -4.262  -1.125  10.617
  658   1HB   ALA  90          1HB       ALA  90  -3.464  -3.317   9.698
  659   2HB   ALA  90          2HB       ALA  90  -5.062  -2.908   9.045
  660   3HB   ALA  90          3HB       ALA  90  -3.613  -2.707   8.031
   
  Start of MODEL           9
 Raw file had  660 H/Q atoms
  Start of MODEL    9
    1   1H    ALA   1          1H        ALA   1 -25.659   6.726 -11.255
    2   2H    ALA   1          2H        ALA   1 -25.751   8.404 -11.318
    3   3H    ALA   1          3H        ALA   1 -26.816   7.469 -12.224
    4    HA   ALA   1           HA       ALA   1 -25.307   6.874 -13.775
    5   1HB   ALA   1          1HB       ALA   1 -24.398   8.936 -14.618
    6   2HB   ALA   1          2HB       ALA   1 -24.169   9.625 -13.000
    7   3HB   ALA   1          3HB       ALA   1 -25.812   9.447 -13.666
    8    H    SER   2           H        SER   2 -22.946   6.917 -14.435
    9    HA   SER   2           HA       SER   2 -21.355   5.216 -12.668
   10   1HB   SER   2          1HB       SER   2 -21.231   5.377 -15.234
   11   2HB   SER   2          2HB       SER   2 -20.232   6.818 -15.026
   12    HG   SER   2           HG       SER   2 -18.739   5.625 -13.924
   13    H    MET   3           H        MET   3 -19.195   5.737 -11.860
   14    HA   MET   3           HA       MET   3 -18.712   8.638 -11.029
   15   1HB   MET   3          1HB       MET   3 -18.065   7.356  -8.682
   16   2HB   MET   3          2HB       MET   3 -19.573   8.200  -8.988
   17   1HG   MET   3          1HG       MET   3 -20.514   5.878  -9.818
   18   2HG   MET   3          2HG       MET   3 -19.060   5.175  -9.099
   19   1HE   MET   3          1HE       MET   3 -21.623   7.937  -8.550
   20   2HE   MET   3          2HE       MET   3 -21.930   7.958  -6.789
   21   3HE   MET   3          3HE       MET   3 -22.800   6.793  -7.829
   22    H    THR   4           H        THR   4 -17.436   5.333 -10.477
   23    HA   THR   4           HA       THR   4 -15.350   4.316 -10.965
   24    HB   THR   4           HB       THR   4 -14.600   6.765 -12.592
   25    HG1  THR   4           HG1      THR   4 -16.150   4.513 -13.293
   26   1HG2  THR   4          1HG2      THR   4 -13.350   5.232 -14.046
   27   2HG2  THR   4          2HG2      THR   4 -13.836   3.818 -13.084
   28   3HG2  THR   4          3HG2      THR   4 -12.740   5.040 -12.388
   29    H    ASP   5           H        ASP   5 -15.613   5.327  -8.542
   30    HA   ASP   5           HA       ASP   5 -13.938   7.345  -7.460
   31   1HB   ASP   5          1HB       ASP   5 -14.146   6.381  -5.336
   32   2HB   ASP   5          2HB       ASP   5 -14.036   4.737  -5.922
   33    H    GLN   6           H        GLN   6 -13.035   4.236  -8.774
   34    HA   GLN   6           HA       GLN   6 -10.505   3.601  -7.674
   35   1HB   GLN   6          1HB       GLN   6 -11.800   3.110 -10.324
   36   2HB   GLN   6          2HB       GLN   6 -11.088   1.993  -9.175
   37   1HG   GLN   6          1HG       GLN   6  -8.775   3.183 -10.063
   38   2HG   GLN   6          2HG       GLN   6  -9.770   3.467 -11.474
   39   1HE2  GLN   6          1HE2      GLN   6  -8.302  -0.293 -10.773
   40   2HE2  GLN   6          2HE2      GLN   6  -7.976   1.136  -9.669
   41    H    GLN   7           H        GLN   7 -10.512   5.113 -10.883
   42    HA   GLN   7           HA       GLN   7  -7.951   6.631 -10.187
   43   1HB   GLN   7          1HB       GLN   7  -7.800   5.178 -12.176
   44   2HB   GLN   7          2HB       GLN   7  -7.608   6.875 -12.604
   45   1HG   GLN   7          1HG       GLN   7 -10.429   6.239 -12.911
   46   2HG   GLN   7          2HG       GLN   7  -9.284   6.778 -14.130
   47   1HE2  GLN   7          1HE2      GLN   7 -10.680   3.159 -14.692
   48   2HE2  GLN   7          2HE2      GLN   7 -11.491   4.691 -14.089
   49    H    ALA   8           H        ALA   8 -10.845   7.397  -9.525
   50    HA   ALA   8           HA       ALA   8 -11.329   9.922 -11.107
   51   1HB   ALA   8          1HB       ALA   8 -13.376  10.146  -9.706
   52   2HB   ALA   8          2HB       ALA   8 -13.277   8.543 -10.458
   53   3HB   ALA   8          3HB       ALA   8 -12.899   8.738  -8.728
   54    H    GLU   9           H        GLU   9 -10.805   9.034  -7.676
   55    HA   GLU   9           HA       GLU   9 -10.277  11.870  -6.839
   56   1HB   GLU   9          1HB       GLU   9  -9.979  10.949  -4.527
   57   2HB   GLU   9          2HB       GLU   9 -11.537  10.583  -5.255
   58   1HG   GLU   9          1HG       GLU   9 -11.065   8.253  -5.533
   59   2HG   GLU   9          2HG       GLU   9  -9.322   8.470  -5.425
   60    H    ALA  10           H        ALA  10  -8.470   8.924  -7.489
   61    HA   ALA  10           HA       ALA  10  -5.924   9.615  -6.216
   62   1HB   ALA  10          1HB       ALA  10  -4.964   7.763  -7.576
   63   2HB   ALA  10          2HB       ALA  10  -6.494   7.283  -6.818
   64   3HB   ALA  10          3HB       ALA  10  -6.447   7.673  -8.556
   65    NH1  ARG  11           NH1      ARG  11  -8.791  13.112 -15.981
   66    NH2  ARG  11           NH2      ARG  11  -9.919  11.144 -16.105
   67    H    ARG  11           H        ARG  11  -7.295  10.201  -9.417
   68    HA   ARG  11           HA       ARG  11  -4.788  11.221 -10.709
   69   1HB   ARG  11          1HB       ARG  11  -6.307  10.210 -12.243
   70   2HB   ARG  11          2HB       ARG  11  -7.707  11.016 -11.551
   71   1HG   ARG  11          1HG       ARG  11  -7.335  13.052 -12.659
   72   2HG   ARG  11          2HG       ARG  11  -5.595  12.799 -12.824
   73   1HD   ARG  11          1HD       ARG  11  -6.472  12.511 -15.044
   74   2HD   ARG  11          2HD       ARG  11  -6.112  10.873 -14.493
   75    HE   ARG  11           HE       ARG  11  -8.665  10.665 -13.979
   76   1HH1  ARG  11          1HH1      ARG  11 -10.035  10.187 -15.753
   77   2HH1  ARG  11          2HH1      ARG  11 -10.472  11.600 -16.839
   78   1HH2  ARG  11          1HH2      ARG  11  -8.004  13.635 -15.582
   79   2HH2  ARG  11          2HH2      ARG  11  -9.468  13.452 -16.673
   80    H    ALA  12           H        ALA  12  -7.892  12.669  -9.683
   81    HA   ALA  12           HA       ALA  12  -7.361  15.470 -10.008
   82   1HB   ALA  12          1HB       ALA  12  -9.035  15.889  -8.218
   83   2HB   ALA  12          2HB       ALA  12  -9.585  14.621  -9.331
   84   3HB   ALA  12          3HB       ALA  12  -8.972  14.181  -7.717
   85    H    PHE  13           H        PHE  13  -6.274  13.227  -7.510
   86    HA   PHE  13           HA       PHE  13  -5.250  15.139  -5.548
   87   1HB   PHE  13          1HB       PHE  13  -4.350  12.239  -6.018
   88   2HB   PHE  13          2HB       PHE  13  -5.774  12.695  -5.120
   89    HD1  PHE  13           HD1      PHE  13  -5.559  13.367  -2.768
   90    HD2  PHE  13           HD2      PHE  13  -2.011  13.017  -5.181
   91    HE1  PHE  13           HE1      PHE  13  -4.156  13.541  -0.753
   92    HE2  PHE  13           HE2      PHE  13  -0.628  13.188  -3.154
   93    HZ   PHE  13           HZ       PHE  13  -1.693  13.453  -0.940
   94    H    LEU  14           H        LEU  14  -3.397  12.990  -7.735
   95    HA   LEU  14           HA       LEU  14  -0.847  14.465  -7.513
   96   1HB   LEU  14          1HB       LEU  14  -1.433  12.662  -9.895
   97   2HB   LEU  14          2HB       LEU  14   0.078  12.922  -9.051
   98    HG   LEU  14           HG       LEU  14  -2.219  11.070  -8.336
   99   1HD1  LEU  14          1HD1      LEU  14  -0.356   9.465  -7.906
  100   2HD1  LEU  14          2HD1      LEU  14  -0.209  10.176  -9.523
  101   3HD1  LEU  14          3HD1      LEU  14   0.850  10.742  -8.207
  102   1HD2  LEU  14          1HD2      LEU  14  -0.261  12.153  -6.200
  103   2HD2  LEU  14          2HD2      LEU  14  -2.023  12.407  -6.232
  104   3HD2  LEU  14          3HD2      LEU  14  -1.375  10.779  -5.986
  105    H    SER  15           H        SER  15  -0.349  16.300  -8.402
  106    HA   SER  15           HA       SER  15  -2.052  17.711 -10.409
  107   1HB   SER  15          1HB       SER  15  -0.464  18.620  -8.388
  108   2HB   SER  15          2HB       SER  15   0.670  18.811  -9.727
  109    HG   SER  15           HG       SER  15  -0.435  20.593  -9.866
  110    H    GLU  16           H        GLU  16  -0.183  19.013 -11.959
  111    HA   GLU  16           HA       GLU  16   0.412  16.994 -14.076
  112   1HB   GLU  16          1HB       GLU  16  -0.540  19.219 -14.629
  113   2HB   GLU  16          2HB       GLU  16   0.905  20.022 -14.045
  114   1HG   GLU  16          1HG       GLU  16   1.675  18.017 -16.064
  115   2HG   GLU  16          2HG       GLU  16   0.357  18.990 -16.694
  116    H    GLU  17           H        GLU  17   2.172  18.955 -11.745
  117    HA   GLU  17           HA       GLU  17   4.901  18.263 -12.827
  118   1HB   GLU  17          1HB       GLU  17   4.388  19.735 -10.203
  119   2HB   GLU  17          2HB       GLU  17   5.836  19.748 -11.192
  120   1HG   GLU  17          1HG       GLU  17   3.441  20.747 -12.684
  121   2HG   GLU  17          2HG       GLU  17   3.735  21.654 -11.211
  122    H    MET  18           H        MET  18   2.738  17.423 -10.169
  123    HA   MET  18           HA       MET  18   4.624  15.847  -8.538
  124   1HB   MET  18          1HB       MET  18   1.574  16.027  -8.591
  125   2HB   MET  18          2HB       MET  18   2.367  14.770  -7.658
  126   1HG   MET  18          1HG       MET  18   3.149  17.715  -7.253
  127   2HG   MET  18          2HG       MET  18   1.745  17.005  -6.438
  128   1HE   MET  18          1HE       MET  18   2.136  14.280  -5.371
  129   2HE   MET  18          2HE       MET  18   3.128  14.499  -3.899
  130   3HE   MET  18          3HE       MET  18   1.832  15.670  -4.282
  131    H    ILE  19           H        ILE  19   2.436  15.144 -11.217
  132    HA   ILE  19           HA       ILE  19   2.505  12.200 -11.064
  133    HB   ILE  19           HB       ILE  19   1.583  14.164 -13.180
  134   1HG1  ILE  19          1HG1      ILE  19   0.196  13.260 -11.074
  135   2HG1  ILE  19          2HG1      ILE  19   0.001  11.805 -12.027
  136   1HG2  ILE  19          1HG2      ILE  19   0.959  12.307 -14.745
  137   2HG2  ILE  19          2HG2      ILE  19   2.708  12.361 -14.533
  138   3HG2  ILE  19          3HG2      ILE  19   1.760  11.117 -13.689
  139   1HD1  ILE  19          1HD1      ILE  19  -1.172  13.009 -13.849
  140   2HD1  ILE  19          2HD1      ILE  19  -1.949  13.330 -12.285
  141   3HD1  ILE  19          3HD1      ILE  19  -0.906  14.569 -13.023
  142    H    ALA  20           H        ALA  20   4.430  14.697 -12.661
  143    HA   ALA  20           HA       ALA  20   6.001  13.101 -14.492
  144   1HB   ALA  20          1HB       ALA  20   7.612  15.002 -14.501
  145   2HB   ALA  20          2HB       ALA  20   5.935  15.572 -14.602
  146   3HB   ALA  20          3HB       ALA  20   6.831  15.710 -13.068
  147    H    GLU  21           H        GLU  21   6.334  13.692 -11.037
  148    HA   GLU  21           HA       GLU  21   9.129  12.904 -10.654
  149   1HB   GLU  21          1HB       GLU  21   8.260  12.439  -8.194
  150   2HB   GLU  21          2HB       GLU  21   6.762  13.157  -8.754
  151   1HG   GLU  21          1HG       GLU  21   8.456  15.138  -9.591
  152   2HG   GLU  21          2HG       GLU  21   7.746  15.096  -7.986
  153    H    PHE  22           H        PHE  22   6.062  11.156 -10.693
  154    HA   PHE  22           HA       PHE  22   7.217   8.511  -9.852
  155   1HB   PHE  22          1HB       PHE  22   4.401   9.088 -10.958
  156   2HB   PHE  22          2HB       PHE  22   4.939   7.609 -10.211
  157    HD1  PHE  22           HD1      PHE  22   6.087   7.975  -7.716
  158    HD2  PHE  22           HD2      PHE  22   3.186  10.579  -9.541
  159    HE1  PHE  22           HE1      PHE  22   5.447   8.832  -5.501
  160    HE2  PHE  22           HE2      PHE  22   2.550  11.412  -7.314
  161    HZ   PHE  22           HZ       PHE  22   3.673  10.540  -5.293
  162    H    LYS  23           H        LYS  23   6.410  10.244 -12.791
  163    HA   LYS  23           HA       LYS  23   6.145   8.285 -14.832
  164   1HB   LYS  23          1HB       LYS  23   7.001  11.104 -14.763
  165   2HB   LYS  23          2HB       LYS  23   7.963  10.228 -15.933
  166   1HG   LYS  23          1HG       LYS  23   5.107  11.052 -16.061
  167   2HG   LYS  23          2HG       LYS  23   5.327   9.365 -16.494
  168   1HD   LYS  23          1HD       LYS  23   6.274  11.838 -17.947
  169   2HD   LYS  23          2HD       LYS  23   7.389  10.467 -17.981
  170   1HE   LYS  23          1HE       LYS  23   5.205   9.046 -18.665
  171   2HE   LYS  23          2HE       LYS  23   4.543  10.624 -19.116
  172   1HZ   LYS  23          1HZ       LYS  23   6.799  10.858 -20.374
  173   2HZ   LYS  23          2HZ       LYS  23   5.596   9.938 -21.034
  174   3HZ   LYS  23          3HZ       LYS  23   6.864   9.211 -20.264
  175    H    ALA  24           H        ALA  24   9.107   9.394 -13.226
  176    HA   ALA  24           HA       ALA  24  11.142   8.200 -14.900
  177   1HB   ALA  24          1HB       ALA  24  12.635   8.340 -12.916
  178   2HB   ALA  24          2HB       ALA  24  11.685   9.825 -13.113
  179   3HB   ALA  24          3HB       ALA  24  11.243   8.647 -11.851
  180    H    ALA  25           H        ALA  25   9.715   6.909 -11.876
  181    HA   ALA  25           HA       ALA  25  11.028   4.284 -11.959
  182   1HB   ALA  25          1HB       ALA  25   9.476   3.674 -10.114
  183   2HB   ALA  25          2HB       ALA  25  10.195   5.273  -9.844
  184   3HB   ALA  25          3HB       ALA  25   8.507   5.140 -10.399
  185    H    PHE  26           H        PHE  26   8.127   5.567 -13.413
  186    HA   PHE  26           HA       PHE  26   6.535   3.123 -13.742
  187   1HB   PHE  26          1HB       PHE  26   5.381   5.208 -14.049
  188   2HB   PHE  26          2HB       PHE  26   6.490   5.781 -15.266
  189    HD1  PHE  26           HD1      PHE  26   3.292   4.365 -14.751
  190    HD2  PHE  26           HD2      PHE  26   6.617   4.065 -17.464
  191    HE1  PHE  26           HE1      PHE  26   1.796   3.501 -16.506
  192    HE2  PHE  26           HE2      PHE  26   5.109   3.186 -19.201
  193    HZ   PHE  26           HZ       PHE  26   2.704   2.885 -18.720
  194    H    ASP  27           H        ASP  27   8.973   4.738 -15.772
  195    HA   ASP  27           HA       ASP  27   8.853   2.886 -18.058
  196   1HB   ASP  27          1HB       ASP  27  11.160   4.748 -17.250
  197   2HB   ASP  27          2HB       ASP  27  11.069   3.858 -18.752
  198    H    MET  28           H        MET  28  10.867   3.086 -15.143
  199    HA   MET  28           HA       MET  28  12.785   1.003 -15.543
  200   1HB   MET  28          1HB       MET  28  11.465   2.077 -13.039
  201   2HB   MET  28          2HB       MET  28  13.148   2.104 -13.534
  202   1HG   MET  28          1HG       MET  28  13.425  -0.312 -12.957
  203   2HG   MET  28          2HG       MET  28  11.702  -0.442 -12.566
  204   1HE   MET  28          1HE       MET  28  10.524   1.401 -10.747
  205   2HE   MET  28          2HE       MET  28  11.518   2.393  -9.639
  206   3HE   MET  28          3HE       MET  28  11.487   2.770 -11.387
  207    H    PHE  29           H        PHE  29   9.574   0.633 -14.005
  208    HA   PHE  29           HA       PHE  29   9.539  -2.282 -13.835
  209   1HB   PHE  29          1HB       PHE  29   7.004  -2.071 -13.695
  210   2HB   PHE  29          2HB       PHE  29   7.136  -0.371 -14.058
  211    HD1  PHE  29           HD1      PHE  29   5.874  -1.492 -11.532
  212    HD2  PHE  29           HD2      PHE  29   9.924  -0.238 -12.283
  213    HE1  PHE  29           HE1      PHE  29   6.178  -0.996  -9.140
  214    HE2  PHE  29           HE2      PHE  29  10.202   0.258  -9.889
  215    HZ   PHE  29           HZ       PHE  29   8.340  -0.132  -8.314
  216    H    ASP  30           H        ASP  30   8.681   0.008 -16.379
  217    HA   ASP  30           HA       ASP  30   7.363  -1.803 -18.254
  218   1HB   ASP  30          1HB       ASP  30   8.963   0.575 -19.284
  219   2HB   ASP  30          2HB       ASP  30   7.572   0.862 -18.265
  220    H    ALA  31           H        ALA  31   8.569  -1.864 -20.594
  221    HA   ALA  31           HA       ALA  31  11.420  -2.896 -20.361
  222   1HB   ALA  31          1HB       ALA  31  10.848  -5.118 -21.350
  223   2HB   ALA  31          2HB       ALA  31  10.065  -4.876 -19.776
  224   3HB   ALA  31          3HB       ALA  31   9.111  -4.736 -21.275
  225    H    ASP  32           H        ASP  32   8.549  -2.621 -22.470
  226    HA   ASP  32           HA       ASP  32  10.255  -2.160 -24.934
  227   1HB   ASP  32          1HB       ASP  32   7.995  -2.179 -26.166
  228   2HB   ASP  32          2HB       ASP  32   8.566  -3.683 -25.481
  229    H    GLY  33           H        GLY  33   7.399  -0.616 -23.404
  230   1HA   GLY  33          1HA       GLY  33   8.033   2.017 -22.917
  231   2HA   GLY  33          2HA       GLY  33   8.138   2.046 -24.663
  232    H    GLY  34           H        GLY  34   6.401   3.166 -25.300
  233   1HA   GLY  34          1HA       GLY  34   4.072   3.406 -26.025
  234   2HA   GLY  34          2HA       GLY  34   3.669   1.965 -25.081
  235    H    GLY  35           H        GLY  35   2.889   2.132 -23.070
  236   1HA   GLY  35          1HA       GLY  35   2.944   4.403 -21.211
  237   2HA   GLY  35          2HA       GLY  35   1.549   4.614 -22.278
  238    H    ASP  36           H        ASP  36   2.896   1.520 -21.234
  239    HA   ASP  36           HA       ASP  36   0.946   0.863 -19.126
  240   1HB   ASP  36          1HB       ASP  36  -0.745   0.931 -20.890
  241   2HB   ASP  36          2HB       ASP  36  -0.545  -0.697 -20.286
  242    H    ILE  37           H        ILE  37   1.190  -1.294 -18.392
  243    HA   ILE  37           HA       ILE  37   3.796  -2.659 -19.253
  244    HB   ILE  37           HB       ILE  37   2.765  -2.530 -16.386
  245   1HG1  ILE  37          1HG1      ILE  37   5.319  -1.104 -17.314
  246   2HG1  ILE  37          2HG1      ILE  37   3.767  -0.290 -17.358
  247   1HG2  ILE  37          1HG2      ILE  37   4.855  -3.662 -15.734
  248   2HG2  ILE  37          2HG2      ILE  37   4.002  -4.631 -16.944
  249   3HG2  ILE  37          3HG2      ILE  37   5.427  -3.678 -17.420
  250   1HD1  ILE  37          1HD1      ILE  37   5.088  -1.382 -14.802
  251   2HD1  ILE  37          2HD1      ILE  37   4.894   0.318 -15.282
  252   3HD1  ILE  37          3HD1      ILE  37   3.461  -0.652 -14.872
  253    H    SER  38           H        SER  38   3.732  -4.709 -19.712
  254    HA   SER  38           HA       SER  38   1.146  -6.256 -19.605
  255   1HB   SER  38          1HB       SER  38   3.161  -6.213 -21.460
  256   2HB   SER  38          2HB       SER  38   1.983  -7.517 -21.292
  257    HG   SER  38           HG       SER  38   3.770  -8.594 -21.123
  258    H    THR  39           H        THR  39   1.732  -8.744 -19.089
  259    HA   THR  39           HA       THR  39   2.339  -8.829 -16.139
  260    HB   THR  39           HB       THR  39   1.812 -11.460 -16.776
  261    HG1  THR  39           HG1      THR  39  -0.076 -11.215 -18.140
  262   1HG2  THR  39          1HG2      THR  39  -0.464 -11.130 -15.916
  263   2HG2  THR  39          2HG2      THR  39   0.654 -10.125 -14.965
  264   3HG2  THR  39          3HG2      THR  39  -0.386  -9.377 -16.206
  265    H    LYS  40           H        LYS  40   3.690  -9.906 -19.211
  266    HA   LYS  40           HA       LYS  40   5.803 -11.648 -18.171
  267   1HB   LYS  40          1HB       LYS  40   5.633 -10.139 -20.832
  268   2HB   LYS  40          2HB       LYS  40   4.985 -11.733 -20.543
  269   1HG   LYS  40          1HG       LYS  40   7.252 -12.666 -20.402
  270   2HG   LYS  40          2HG       LYS  40   7.973 -11.097 -20.157
  271   1HD   LYS  40          1HD       LYS  40   7.225 -10.551 -22.653
  272   2HD   LYS  40          2HD       LYS  40   8.624 -11.522 -22.297
  273   1HE   LYS  40          1HE       LYS  40   7.851 -13.005 -23.785
  274   2HE   LYS  40          2HE       LYS  40   6.786 -13.576 -22.507
  275   1HZ   LYS  40          1HZ       LYS  40   4.983 -12.558 -23.497
  276   2HZ   LYS  40          2HZ       LYS  40   5.881 -12.852 -24.851
  277   3HZ   LYS  40          3HZ       LYS  40   5.855 -11.338 -24.190
  278    H    GLU  41           H        GLU  41   5.757  -8.236 -19.245
  279    HA   GLU  41           HA       GLU  41   8.595  -7.638 -18.799
  280   1HB   GLU  41          1HB       GLU  41   8.179  -5.649 -19.706
  281   2HB   GLU  41          2HB       GLU  41   6.955  -5.244 -18.523
  282   1HG   GLU  41          1HG       GLU  41   6.444  -6.900 -21.075
  283   2HG   GLU  41          2HG       GLU  41   5.231  -6.510 -19.874
  284    H    LEU  42           H        LEU  42   5.666  -7.142 -16.833
  285    HA   LEU  42           HA       LEU  42   6.870  -5.638 -14.626
  286   1HB   LEU  42          1HB       LEU  42   4.520  -7.497 -14.108
  287   2HB   LEU  42          2HB       LEU  42   4.295  -6.204 -15.266
  288    HG   LEU  42           HG       LEU  42   4.506  -4.482 -13.642
  289   1HD1  LEU  42          1HD1      LEU  42   2.946  -5.111 -11.781
  290   2HD1  LEU  42          2HD1      LEU  42   2.377  -5.735 -13.336
  291   3HD1  LEU  42          3HD1      LEU  42   3.153  -6.838 -12.172
  292   1HD2  LEU  42          1HD2      LEU  42   5.779  -6.482 -11.653
  293   2HD2  LEU  42          2HD2      LEU  42   6.640  -5.201 -12.541
  294   3HD2  LEU  42          3HD2      LEU  42   5.422  -4.766 -11.328
  295    H    GLY  43           H        GLY  43   6.495  -9.074 -15.323
  296   1HA   GLY  43          1HA       GLY  43   6.989 -10.365 -12.823
  297   2HA   GLY  43          2HA       GLY  43   7.515 -11.044 -14.367
  298    H    THR  44           H        THR  44   9.246  -8.745 -14.987
  299    HA   THR  44           HA       THR  44  11.755  -9.864 -13.999
  300    HB   THR  44           HB       THR  44  11.044  -7.534 -15.747
  301    HG1  THR  44           HG1      THR  44  12.499  -9.887 -15.780
  302   1HG2  THR  44          1HG2      THR  44  13.407  -6.729 -15.889
  303   2HG2  THR  44          2HG2      THR  44  12.706  -6.382 -14.295
  304   3HG2  THR  44          3HG2      THR  44  13.849  -7.735 -14.488
  305    H    VAL  45           H        VAL  45  10.253  -6.679 -13.369
  306    HA   VAL  45           HA       VAL  45  12.176  -5.738 -11.391
  307    HB   VAL  45           HB       VAL  45   9.540  -4.796 -12.374
  308   1HG1  VAL  45          1HG1      VAL  45  11.981  -3.174 -11.416
  309   2HG1  VAL  45          2HG1      VAL  45  11.844  -3.854 -13.042
  310   3HG1  VAL  45          3HG1      VAL  45  10.670  -2.635 -12.498
  311   1HG2  VAL  45          1HG2      VAL  45   8.970  -3.274 -10.552
  312   2HG2  VAL  45          2HG2      VAL  45   9.066  -4.899  -9.835
  313   3HG2  VAL  45          3HG2      VAL  45  10.397  -3.757  -9.599
  314    H    MET  46           H        MET  46   9.264  -7.716 -11.192
  315    HA   MET  46           HA       MET  46   8.878  -7.680  -8.277
  316   1HB   MET  46          1HB       MET  46   7.853  -9.503 -10.495
  317   2HB   MET  46          2HB       MET  46   7.669  -9.999  -8.823
  318   1HG   MET  46          1HG       MET  46   6.760  -7.202  -9.109
  319   2HG   MET  46          2HG       MET  46   5.958  -8.244 -10.296
  320   1HE   MET  46          1HE       MET  46   4.045  -6.950  -8.293
  321   2HE   MET  46          2HE       MET  46   3.874  -7.691  -6.675
  322   3HE   MET  46          3HE       MET  46   5.316  -6.705  -7.054
  323    NH1  ARG  47           NH1      ARG  47  16.558 -12.281 -13.928
  324    NH2  ARG  47           NH2      ARG  47  15.054 -13.556 -15.058
  325    H    ARG  47           H        ARG  47  10.728  -9.705 -10.506
  326    HA   ARG  47           HA       ARG  47  11.483 -11.828  -8.574
  327   1HB   ARG  47          1HB       ARG  47  11.425 -12.012 -11.161
  328   2HB   ARG  47          2HB       ARG  47  12.709 -12.823 -10.275
  329   1HG   ARG  47          1HG       ARG  47  13.742 -10.194 -10.917
  330   2HG   ARG  47          2HG       ARG  47  12.939 -10.794 -12.368
  331   1HD   ARG  47          1HD       ARG  47  15.546 -11.432 -11.742
  332   2HD   ARG  47          2HD       ARG  47  14.744 -12.755 -10.909
  333    HE   ARG  47           HE       ARG  47  13.565 -13.278 -13.198
  334   1HH1  ARG  47          1HH1      ARG  47  16.774 -11.744 -13.080
  335   2HH1  ARG  47          2HH1      ARG  47  17.170 -12.420 -14.740
  336   1HH2  ARG  47          1HH2      ARG  47  14.125 -13.992 -15.076
  337   2HH2  ARG  47          2HH2      ARG  47  15.771 -13.606 -15.790
  338    H    MET  48           H        MET  48  12.855  -8.763  -9.627
  339    HA   MET  48           HA       MET  48  15.559  -8.832  -8.710
  340   1HB   MET  48          1HB       MET  48  13.583  -6.627  -9.091
  341   2HB   MET  48          2HB       MET  48  14.776  -6.281  -7.853
  342   1HG   MET  48          1HG       MET  48  16.317  -7.339 -10.032
  343   2HG   MET  48          2HG       MET  48  15.107  -6.283 -10.779
  344   1HE   MET  48          1HE       MET  48  14.508  -4.222  -8.236
  345   2HE   MET  48          2HE       MET  48  15.621  -2.894  -8.677
  346   3HE   MET  48          3HE       MET  48  14.636  -3.686  -9.941
  347    H    LEU  49           H        LEU  49  12.567  -8.597  -6.862
  348    HA   LEU  49           HA       LEU  49  13.400  -8.006  -4.199
  349   1HB   LEU  49          1HB       LEU  49  11.605  -9.794  -3.482
  350   2HB   LEU  49          2HB       LEU  49  11.303 -10.009  -5.193
  351    HG   LEU  49           HG       LEU  49  10.506  -7.720  -5.468
  352   1HD1  LEU  49          1HD1      LEU  49  11.266  -7.131  -2.538
  353   2HD1  LEU  49          2HD1      LEU  49  12.221  -6.614  -3.940
  354   3HD1  LEU  49          3HD1      LEU  49  10.568  -5.988  -3.714
  355   1HD2  LEU  49          1HD2      LEU  49   8.509  -7.694  -4.032
  356   2HD2  LEU  49          2HD2      LEU  49   8.882  -9.399  -4.384
  357   3HD2  LEU  49          3HD2      LEU  49   9.301  -8.715  -2.806
  358    H    GLY  50           H        GLY  50  12.809 -11.401  -5.076
  359   1HA   GLY  50          1HA       GLY  50  15.410 -12.585  -4.742
  360   2HA   GLY  50          2HA       GLY  50  14.782 -12.439  -3.096
  361    H    GLN  51           H        GLN  51  13.076 -13.139  -6.141
  362    HA   GLN  51           HA       GLN  51  12.695 -16.057  -5.472
  363   1HB   GLN  51          1HB       GLN  51  10.754 -14.368  -4.440
  364   2HB   GLN  51          2HB       GLN  51  10.070 -14.715  -6.017
  365   1HG   GLN  51          1HG       GLN  51   9.118 -16.433  -4.786
  366   2HG   GLN  51          2HG       GLN  51  10.516 -17.268  -5.424
  367   1HE2  GLN  51          1HE2      GLN  51  11.572 -18.159  -2.140
  368   2HE2  GLN  51          2HE2      GLN  51  11.613 -18.443  -3.952
  369    H    ASN  52           H        ASN  52  11.022 -16.873  -7.287
  370    HA   ASN  52           HA       ASN  52  11.490 -15.424  -9.910
  371   1HB   ASN  52          1HB       ASN  52  13.147 -17.481  -9.311
  372   2HB   ASN  52          2HB       ASN  52  11.839 -18.456  -9.945
  373   1HD2  ASN  52          1HD2      ASN  52  14.362 -17.332 -12.650
  374   2HD2  ASN  52          2HD2      ASN  52  14.608 -17.869 -10.913
  375    HA   PRO  53           HA       PRO  53   6.871 -16.675  -9.528
  376   1HB   PRO  53          1HB       PRO  53   5.712 -14.753 -10.218
  377   2HB   PRO  53          2HB       PRO  53   6.688 -14.606 -11.687
  378   1HG   PRO  53          1HG       PRO  53   7.716 -12.854 -10.600
  379   2HG   PRO  53          2HG       PRO  53   7.257 -13.400  -8.971
  380   1HD   PRO  53          1HD       PRO  53   9.483 -14.166  -8.819
  381   2HD   PRO  53          2HD       PRO  53   9.754 -14.057 -10.583
  382    H    THR  54           H        THR  54   5.370 -17.033 -11.576
  383    HA   THR  54           HA       THR  54   6.916 -18.405 -13.829
  384    HB   THR  54           HB       THR  54   5.863 -19.963 -11.930
  385    HG1  THR  54           HG1      THR  54   5.424 -21.438 -13.797
  386   1HG2  THR  54          1HG2      THR  54   3.675 -20.927 -12.563
  387   2HG2  THR  54          2HG2      THR  54   3.479 -19.205 -12.160
  388   3HG2  THR  54          3HG2      THR  54   3.473 -19.729 -13.864
  389    H    LYS  55           H        LYS  55   5.443 -18.857 -15.698
  390    HA   LYS  55           HA       LYS  55   4.438 -16.358 -16.746
  391   1HB   LYS  55          1HB       LYS  55   3.340 -17.927 -18.576
  392   2HB   LYS  55          2HB       LYS  55   4.107 -19.251 -17.723
  393   1HG   LYS  55          1HG       LYS  55   5.333 -18.303 -19.759
  394   2HG   LYS  55          2HG       LYS  55   5.684 -16.855 -18.833
  395   1HD   LYS  55          1HD       LYS  55   6.469 -19.506 -17.539
  396   2HD   LYS  55          2HD       LYS  55   7.345 -19.051 -18.993
  397   1HE   LYS  55          1HE       LYS  55   7.873 -16.785 -17.903
  398   2HE   LYS  55          2HE       LYS  55   7.180 -17.389 -16.401
  399   1HZ   LYS  55          1HZ       LYS  55   9.713 -17.625 -16.867
  400   2HZ   LYS  55          2HZ       LYS  55   9.299 -18.961 -17.746
  401   3HZ   LYS  55          3HZ       LYS  55   8.928 -18.882 -16.138
  402    H    GLU  56           H        GLU  56   2.584 -19.310 -15.916
  403    HA   GLU  56           HA       GLU  56  -0.072 -18.125 -16.240
  404   1HB   GLU  56          1HB       GLU  56  -0.786 -20.202 -14.787
  405   2HB   GLU  56          2HB       GLU  56   0.893 -20.692 -14.903
  406   1HG   GLU  56          1HG       GLU  56  -0.335 -19.975 -17.556
  407   2HG   GLU  56          2HG       GLU  56   0.704 -21.323 -17.129
  408    H    GLU  57           H        GLU  57   2.156 -18.450 -13.530
  409    HA   GLU  57           HA       GLU  57   0.340 -17.858 -11.306
  410   1HB   GLU  57          1HB       GLU  57   2.571 -17.077 -10.139
  411   2HB   GLU  57          2HB       GLU  57   3.359 -17.711 -11.567
  412   1HG   GLU  57          1HG       GLU  57   3.422 -19.732 -10.516
  413   2HG   GLU  57          2HG       GLU  57   2.382 -19.164  -9.216
  414    H    LEU  58           H        LEU  58   2.157 -15.858 -13.560
  415    HA   LEU  58           HA       LEU  58   1.934 -13.306 -12.076
  416   1HB   LEU  58          1HB       LEU  58   3.055 -14.228 -14.696
  417   2HB   LEU  58          2HB       LEU  58   2.454 -12.583 -14.717
  418    HG   LEU  58           HG       LEU  58   4.374 -13.530 -12.510
  419   1HD1  LEU  58          1HD1      LEU  58   6.297 -12.628 -13.875
  420   2HD1  LEU  58          2HD1      LEU  58   5.562 -14.037 -14.654
  421   3HD1  LEU  58          3HD1      LEU  58   5.213 -12.403 -15.271
  422   1HD2  LEU  58          1HD2      LEU  58   3.813 -10.730 -13.688
  423   2HD2  LEU  58          2HD2      LEU  58   3.207 -11.353 -12.133
  424   3HD2  LEU  58          3HD2      LEU  58   4.947 -11.104 -12.366
  425    H    ASP  59           H        ASP  59   0.130 -14.971 -14.609
  426    HA   ASP  59           HA       ASP  59  -1.633 -12.780 -15.440
  427   1HB   ASP  59          1HB       ASP  59  -2.039 -15.810 -15.736
  428   2HB   ASP  59          2HB       ASP  59  -1.276 -14.742 -16.891
  429    H    ALA  60           H        ALA  60  -1.799 -15.247 -12.927
  430    HA   ALA  60           HA       ALA  60  -4.542 -14.601 -11.965
  431   1HB   ALA  60          1HB       ALA  60  -3.975 -16.075 -10.040
  432   2HB   ALA  60          2HB       ALA  60  -3.568 -16.844 -11.586
  433   3HB   ALA  60          3HB       ALA  60  -2.277 -16.161 -10.564
  434    H    ILE  61           H        ILE  61  -1.254 -13.563 -11.259
  435    HA   ILE  61           HA       ILE  61  -1.686 -12.233  -8.684
  436    HB   ILE  61           HB       ILE  61   0.522 -12.290 -10.693
  437   1HG1  ILE  61          1HG1      ILE  61   0.052 -13.166  -7.951
  438   2HG1  ILE  61          2HG1      ILE  61   1.374 -13.570  -9.025
  439   1HG2  ILE  61          1HG2      ILE  61   1.770 -10.338  -9.724
  440   2HG2  ILE  61          2HG2      ILE  61   0.283  -9.799 -10.501
  441   3HG2  ILE  61          3HG2      ILE  61   0.359  -9.907  -8.727
  442   1HD1  ILE  61          1HD1      ILE  61   1.370 -11.148  -7.128
  443   2HD1  ILE  61          2HD1      ILE  61   2.314 -12.645  -6.979
  444   3HD1  ILE  61          3HD1      ILE  61   2.656 -11.515  -8.310
  445    H    ILE  62           H        ILE  62  -1.976 -11.235 -12.063
  446    HA   ILE  62           HA       ILE  62  -2.543  -8.349 -11.463
  447    HB   ILE  62           HB       ILE  62  -2.425  -9.977 -14.025
  448   1HG1  ILE  62          1HG1      ILE  62  -0.252  -9.173 -13.405
  449   2HG1  ILE  62          2HG1      ILE  62  -0.858  -7.634 -12.831
  450   1HG2  ILE  62          1HG2      ILE  62  -3.146  -7.988 -15.377
  451   2HG2  ILE  62          2HG2      ILE  62  -4.459  -8.526 -14.333
  452   3HG2  ILE  62          3HG2      ILE  62  -3.518  -7.085 -13.888
  453   1HD1  ILE  62          1HD1      ILE  62  -1.268  -6.800 -15.131
  454   2HD1  ILE  62          2HD1      ILE  62   0.403  -7.378 -14.962
  455   3HD1  ILE  62          3HD1      ILE  62  -0.795  -8.381 -15.813
  456    H    GLU  63           H        GLU  63  -4.315 -11.271 -12.458
  457    HA   GLU  63           HA       GLU  63  -6.982 -10.330 -12.754
  458   1HB   GLU  63          1HB       GLU  63  -6.059 -12.751 -12.981
  459   2HB   GLU  63          2HB       GLU  63  -6.398 -12.940 -11.272
  460   1HG   GLU  63          1HG       GLU  63  -8.815 -12.614 -11.627
  461   2HG   GLU  63          2HG       GLU  63  -8.569 -12.066 -13.277
  462    H    GLU  64           H        GLU  64  -5.105 -10.859  -9.818
  463    HA   GLU  64           HA       GLU  64  -7.197 -10.487  -7.814
  464   1HB   GLU  64          1HB       GLU  64  -4.902  -9.575  -6.532
  465   2HB   GLU  64          2HB       GLU  64  -4.211 -10.560  -7.805
  466   1HG   GLU  64          1HG       GLU  64  -5.973 -12.412  -6.958
  467   2HG   GLU  64          2HG       GLU  64  -4.437 -12.174  -6.143
  468    H    VAL  65           H        VAL  65  -4.708  -8.201  -9.005
  469    HA   VAL  65           HA       VAL  65  -6.420  -5.839  -8.077
  470    HB   VAL  65           HB       VAL  65  -4.271  -5.845  -6.963
  471   1HG1  VAL  65          1HG1      VAL  65  -2.077  -5.643  -8.146
  472   2HG1  VAL  65          2HG1      VAL  65  -2.887  -7.161  -8.576
  473   3HG1  VAL  65          3HG1      VAL  65  -2.881  -5.803  -9.727
  474   1HG2  VAL  65          1HG2      VAL  65  -4.313  -3.586  -9.082
  475   2HG2  VAL  65          2HG2      VAL  65  -5.154  -3.573  -7.513
  476   3HG2  VAL  65          3HG2      VAL  65  -3.385  -3.572  -7.562
  477    H    ASP  66           H        ASP  66  -7.614  -6.582 -10.099
  478    HA   ASP  66           HA       ASP  66  -7.117  -4.644 -12.291
  479   1HB   ASP  66          1HB       ASP  66  -6.756  -7.574 -13.128
  480   2HB   ASP  66          2HB       ASP  66  -5.411  -6.508 -12.789
  481    H    GLU  67           H        GLU  67  -9.179  -4.816 -10.689
  482    HA   GLU  67           HA       GLU  67 -11.411  -6.534 -11.760
  483   1HB   GLU  67          1HB       GLU  67 -10.903  -5.859  -9.249
  484   2HB   GLU  67          2HB       GLU  67 -11.772  -4.383  -9.629
  485   1HG   GLU  67          1HG       GLU  67 -13.747  -5.926 -10.427
  486   2HG   GLU  67          2HG       GLU  67 -13.451  -5.776  -8.703
  487    H    ASP  68           H        ASP  68 -10.136  -4.420 -13.450
  488    HA   ASP  68           HA       ASP  68 -12.456  -2.468 -13.865
  489   1HB   ASP  68          1HB       ASP  68  -9.988  -1.605 -13.400
  490   2HB   ASP  68          2HB       ASP  68 -11.051  -0.790 -14.523
  491    H    GLY  69           H        GLY  69 -10.233  -4.765 -15.387
  492   1HA   GLY  69          1HA       GLY  69 -12.195  -5.159 -17.701
  493   2HA   GLY  69          2HA       GLY  69 -10.998  -6.347 -17.165
  494    H    SER  70           H        SER  70  -9.045  -6.403 -18.047
  495    HA   SER  70           HA       SER  70  -8.411  -5.064 -20.578
  496   1HB   SER  70          1HB       SER  70  -7.817  -3.019 -19.811
  497   2HB   SER  70          2HB       SER  70  -6.298  -3.801 -19.366
  498    HG   SER  70           HG       SER  70  -7.699  -2.554 -17.767
  499    H    GLY  71           H        GLY  71  -6.090  -5.499 -17.937
  500   1HA   GLY  71          1HA       GLY  71  -5.099  -8.000 -17.707
  501   2HA   GLY  71          2HA       GLY  71  -4.798  -7.834 -19.442
  502    H    THR  72           H        THR  72  -4.193  -4.990 -19.301
  503    HA   THR  72           HA       THR  72  -1.306  -5.141 -18.379
  504    HB   THR  72           HB       THR  72  -0.981  -2.976 -19.595
  505    HG1  THR  72           HG1      THR  72  -3.385  -2.609 -19.440
  506   1HG2  THR  72          1HG2      THR  72  -1.079  -3.818 -21.905
  507   2HG2  THR  72          2HG2      THR  72  -0.491  -5.118 -20.845
  508   3HG2  THR  72          3HG2      THR  72  -2.169  -5.146 -21.448
  509    H    ILE  73           H        ILE  73  -0.691  -2.613 -17.752
  510    HA   ILE  73           HA       ILE  73  -2.571  -1.621 -15.569
  511    HB   ILE  73           HB       ILE  73   0.307  -2.512 -15.052
  512   1HG1  ILE  73          1HG1      ILE  73  -0.569  -4.329 -13.999
  513   2HG1  ILE  73          2HG1      ILE  73  -2.114  -3.923 -14.716
  514   1HG2  ILE  73          1HG2      ILE  73   0.187  -1.476 -12.789
  515   2HG2  ILE  73          2HG2      ILE  73  -0.044  -0.228 -14.022
  516   3HG2  ILE  73          3HG2      ILE  73  -1.445  -0.844 -13.112
  517   1HD1  ILE  73          1HD1      ILE  73  -2.848  -2.667 -12.707
  518   2HD1  ILE  73          2HD1      ILE  73  -2.332  -4.310 -12.273
  519   3HD1  ILE  73          3HD1      ILE  73  -1.260  -2.930 -11.934
  520    H    ASP  74           H        ASP  74  -2.886  -0.051 -17.241
  521    HA   ASP  74           HA       ASP  74  -0.824   1.650 -18.428
  522   1HB   ASP  74          1HB       ASP  74  -2.501   2.922 -19.370
  523   2HB   ASP  74          2HB       ASP  74  -3.490   2.941 -17.929
  524    H    PHE  75           H        PHE  75  -0.733   4.060 -17.941
  525    HA   PHE  75           HA       PHE  75   0.457   4.467 -15.281
  526   1HB   PHE  75          1HB       PHE  75   1.019   5.729 -17.484
  527   2HB   PHE  75          2HB       PHE  75  -0.410   6.691 -17.218
  528    HD1  PHE  75           HD1      PHE  75   1.628   8.459 -17.353
  529    HD2  PHE  75           HD2      PHE  75   0.924   5.872 -13.987
  530    HE1  PHE  75           HE1      PHE  75   2.917   9.974 -15.905
  531    HE2  PHE  75           HE2      PHE  75   2.208   7.408 -12.553
  532    HZ   PHE  75           HZ       PHE  75   3.206   9.456 -13.506
  533    H    GLU  76           H        GLU  76  -2.693   5.083 -16.723
  534    HA   GLU  76           HA       GLU  76  -3.851   6.949 -14.849
  535   1HB   GLU  76          1HB       GLU  76  -5.794   6.742 -15.964
  536   2HB   GLU  76          2HB       GLU  76  -4.758   5.967 -17.144
  537   1HG   GLU  76          1HG       GLU  76  -5.477   3.685 -16.226
  538   2HG   GLU  76          2HG       GLU  76  -6.556   4.509 -15.119
  539    H    GLU  77           H        GLU  77  -4.310   3.402 -14.942
  540    HA   GLU  77           HA       GLU  77  -5.633   3.207 -12.310
  541   1HB   GLU  77          1HB       GLU  77  -6.154   1.151 -12.953
  542   2HB   GLU  77          2HB       GLU  77  -5.370   1.494 -14.477
  543   1HG   GLU  77          1HG       GLU  77  -3.151   0.605 -13.267
  544   2HG   GLU  77          2HG       GLU  77  -4.266  -0.105 -12.106
  545    H    PHE  78           H        PHE  78  -2.308   3.095 -13.386
  546    HA   PHE  78           HA       PHE  78  -1.002   1.741 -11.169
  547   1HB   PHE  78          1HB       PHE  78   0.133   4.053 -12.863
  548   2HB   PHE  78          2HB       PHE  78   0.114   2.384 -13.370
  549    HD1  PHE  78           HD1      PHE  78   2.655   3.991 -13.172
  550    HD2  PHE  78           HD2      PHE  78   0.698   1.645 -10.142
  551    HE1  PHE  78           HE1      PHE  78   4.805   3.666 -12.019
  552    HE2  PHE  78           HE2      PHE  78   2.857   1.332  -9.003
  553    HZ   PHE  78           HZ       PHE  78   4.910   2.346  -9.931
  554    H    LEU  79           H        LEU  79  -2.225   5.009 -11.596
  555    HA   LEU  79           HA       LEU  79  -0.980   6.184  -9.157
  556   1HB   LEU  79          1HB       LEU  79  -3.250   7.206 -10.963
  557   2HB   LEU  79          2HB       LEU  79  -2.644   8.100  -9.586
  558    HG   LEU  79           HG       LEU  79  -1.283   7.553 -12.255
  559   1HD1  LEU  79          1HD1      LEU  79  -0.816  10.003 -12.153
  560   2HD1  LEU  79          2HD1      LEU  79  -2.547   9.688 -11.935
  561   3HD1  LEU  79          3HD1      LEU  79  -1.538  10.101 -10.526
  562   1HD2  LEU  79          1HD2      LEU  79   0.279   8.300  -9.690
  563   2HD2  LEU  79          2HD2      LEU  79   0.461   6.798 -10.630
  564   3HD2  LEU  79          3HD2      LEU  79   0.927   8.346 -11.349
  565    H    VAL  80           H        VAL  80  -4.032   4.651 -10.006
  566    HA   VAL  80           HA       VAL  80  -5.608   5.277  -7.642
  567    HB   VAL  80           HB       VAL  80  -5.875   2.663  -9.202
  568   1HG1  VAL  80          1HG1      VAL  80  -8.298   2.848  -8.601
  569   2HG1  VAL  80          2HG1      VAL  80  -7.295   2.778  -7.146
  570   3HG1  VAL  80          3HG1      VAL  80  -7.974   4.336  -7.673
  571   1HG2  VAL  80          1HG2      VAL  80  -7.150   5.373  -9.964
  572   2HG2  VAL  80          2HG2      VAL  80  -5.870   4.547 -10.883
  573   3HG2  VAL  80          3HG2      VAL  80  -7.469   3.801 -10.738
  574    H    MET  81           H        MET  81  -3.131   2.860  -8.306
  575    HA   MET  81           HA       MET  81  -3.363   1.109  -6.013
  576   1HB   MET  81          1HB       MET  81  -0.735   0.897  -6.288
  577   2HB   MET  81          2HB       MET  81  -0.950   1.915  -7.700
  578   1HG   MET  81          1HG       MET  81  -2.182   0.258  -8.906
  579   2HG   MET  81          2HG       MET  81  -2.660  -0.610  -7.437
  580   1HE   MET  81          1HE       MET  81  -1.761  -2.461  -9.545
  581   2HE   MET  81          2HE       MET  81  -0.384  -3.393  -8.886
  582   3HE   MET  81          3HE       MET  81  -1.812  -3.072  -7.861
  583    H    MET  82           H        MET  82  -0.929   3.706  -6.341
  584    HA   MET  82           HA       MET  82  -0.036   3.770  -3.611
  585   1HB   MET  82          1HB       MET  82   0.937   4.963  -5.739
  586   2HB   MET  82          2HB       MET  82   1.227   5.633  -4.144
  587   1HG   MET  82          1HG       MET  82  -0.942   7.137  -4.671
  588   2HG   MET  82          2HG       MET  82  -0.623   6.671  -6.347
  589   1HE   MET  82          1HE       MET  82   2.187   7.608  -3.310
  590   2HE   MET  82          2HE       MET  82   0.564   8.339  -3.137
  591   3HE   MET  82          3HE       MET  82   1.955   9.363  -3.595
  592    H    VAL  83           H        VAL  83  -2.669   5.573  -5.180
  593    HA   VAL  83           HA       VAL  83  -3.290   7.465  -3.054
  594    HB   VAL  83           HB       VAL  83  -5.039   6.397  -5.317
  595   1HG1  VAL  83          1HG1      VAL  83  -3.843   9.214  -4.953
  596   2HG1  VAL  83          2HG1      VAL  83  -3.044   7.936  -5.879
  597   3HG1  VAL  83          3HG1      VAL  83  -4.633   8.541  -6.402
  598   1HG2  VAL  83          1HG2      VAL  83  -6.751   8.076  -4.852
  599   2HG2  VAL  83          2HG2      VAL  83  -6.519   7.166  -3.341
  600   3HG2  VAL  83          3HG2      VAL  83  -5.809   8.778  -3.512
  601    NH1  ARG  84           NH1      ARG  84  -8.435  -1.218  -2.873
  602    NH2  ARG  84           NH2      ARG  84  -9.935  -1.541  -4.548
  603    H    ARG  84           H        ARG  84  -4.403   4.167  -3.744
  604    HA   ARG  84           HA       ARG  84  -6.604   3.934  -1.827
  605   1HB   ARG  84          1HB       ARG  84  -5.070   2.094  -3.557
  606   2HB   ARG  84          2HB       ARG  84  -5.383   1.365  -1.989
  607   1HG   ARG  84          1HG       ARG  84  -7.763   2.743  -3.217
  608   2HG   ARG  84          2HG       ARG  84  -7.685   1.245  -2.287
  609   1HD   ARG  84          1HD       ARG  84  -6.473   0.198  -4.385
  610   2HD   ARG  84          2HD       ARG  84  -7.007   1.626  -5.274
  611    HE   ARG  84           HE       ARG  84  -9.304   0.798  -5.163
  612   1HH1  ARG  84          1HH1      ARG  84  -7.677  -0.644  -2.487
  613   2HH1  ARG  84          2HH1      ARG  84  -8.822  -2.079  -2.470
  614   1HH2  ARG  84          1HH2      ARG  84 -10.370  -1.179  -5.404
  615   2HH2  ARG  84          2HH2      ARG  84 -10.175  -2.410  -4.057
  616    H    GLN  85           H        GLN  85  -3.102   3.593  -1.539
  617    HA   GLN  85           HA       GLN  85  -3.153   2.445   1.232
  618   1HB   GLN  85          1HB       GLN  85  -0.798   3.426  -0.485
  619   2HB   GLN  85          2HB       GLN  85  -0.642   2.681   1.095
  620   1HG   GLN  85          1HG       GLN  85  -2.275   0.878  -0.464
  621   2HG   GLN  85          2HG       GLN  85  -0.991   1.405  -1.530
  622   1HE2  GLN  85          1HE2      GLN  85   0.113  -0.710   1.898
  623   2HE2  GLN  85          2HE2      GLN  85  -1.263   0.502   1.963
  624    H    MET  86           H        MET  86  -2.843   5.584  -0.301
  625    HA   MET  86           HA       MET  86  -1.509   7.227   1.603
  626   1HB   MET  86          1HB       MET  86  -2.148   8.962   0.316
  627   2HB   MET  86          2HB       MET  86  -2.807   7.734  -0.749
  628   1HG   MET  86          1HG       MET  86  -5.072   7.997   0.027
  629   2HG   MET  86          2HG       MET  86  -4.583   8.919   1.455
  630   1HE   MET  86          1HE       MET  86  -3.733   9.072  -2.514
  631   2HE   MET  86          2HE       MET  86  -3.400  10.824  -2.640
  632   3HE   MET  86          3HE       MET  86  -2.357   9.790  -1.620
  633    H    LYS  87           H        LYS  87  -4.834   6.041   1.610
  634    HA   LYS  87           HA       LYS  87  -6.169   7.421   3.681
  635   1HB   LYS  87          1HB       LYS  87  -6.191   4.372   3.237
  636   2HB   LYS  87          2HB       LYS  87  -7.248   5.201   4.371
  637   1HG   LYS  87          1HG       LYS  87  -7.314   5.249   1.342
  638   2HG   LYS  87          2HG       LYS  87  -8.631   4.990   2.474
  639   1HD   LYS  87          1HD       LYS  87  -8.201   7.565   3.125
  640   2HD   LYS  87          2HD       LYS  87  -7.318   7.603   1.603
  641   1HE   LYS  87          1HE       LYS  87 -10.324   7.217   2.034
  642   2HE   LYS  87          2HE       LYS  87  -9.492   8.321   0.930
  643   1HZ   LYS  87          1HZ       LYS  87 -10.493   6.451  -0.238
  644   2HZ   LYS  87          2HZ       LYS  87  -9.587   5.361   0.611
  645   3HZ   LYS  87          3HZ       LYS  87  -8.852   6.414  -0.429
  646    H    GLU  88           H        GLU  88  -5.028   8.189   5.344
  647    HA   GLU  88           HA       GLU  88  -3.382   6.312   7.108
  648   1HB   GLU  88          1HB       GLU  88  -2.270   8.390   6.176
  649   2HB   GLU  88          2HB       GLU  88  -2.141   8.150   7.908
  650   1HG   GLU  88          1HG       GLU  88  -3.762  10.250   6.382
  651   2HG   GLU  88          2HG       GLU  88  -4.275   9.804   8.001
  652    H    ASP  89           H        ASP  89  -6.131   8.503   6.957
  653    HA   ASP  89           HA       ASP  89  -6.760   8.139   9.920
  654   1HB   ASP  89          1HB       ASP  89  -8.041  10.135   7.967
  655   2HB   ASP  89          2HB       ASP  89  -6.676  10.495   8.997
  656    H    ALA  90           H        ALA  90  -7.236   5.886   9.303
  657    HA   ALA  90           HA       ALA  90 -10.168   5.480   8.585
  658   1HB   ALA  90          1HB       ALA  90  -9.637   3.663   6.939
  659   2HB   ALA  90          2HB       ALA  90  -8.983   5.219   6.389
  660   3HB   ALA  90          3HB       ALA  90  -7.893   3.997   7.088
   
  Start of MODEL          10
 Raw file had  660 H/Q atoms
  Start of MODEL   10
    1   1H    ALA   1          1H        ALA   1 -23.673   6.728 -15.580
    2   2H    ALA   1          2H        ALA   1 -23.693   7.604 -14.145
    3   3H    ALA   1          3H        ALA   1 -23.068   8.297 -15.545
    4    HA   ALA   1           HA       ALA   1 -21.171   7.069 -15.551
    5   1HB   ALA   1          1HB       ALA   1 -20.652   8.562 -13.849
    6   2HB   ALA   1          2HB       ALA   1 -20.545   7.074 -12.889
    7   3HB   ALA   1          3HB       ALA   1 -22.015   8.079 -12.812
    8    H    SER   2           H        SER   2 -19.963   5.219 -14.771
    9    HA   SER   2           HA       SER   2 -21.123   3.062 -13.105
   10   1HB   SER   2          1HB       SER   2 -21.146   1.374 -15.170
   11   2HB   SER   2          2HB       SER   2 -22.570   2.324 -14.737
   12    HG   SER   2           HG       SER   2 -22.172   3.706 -16.362
   13    H    MET   3           H        MET   3 -18.932   3.815 -15.816
   14    HA   MET   3           HA       MET   3 -16.643   2.348 -14.396
   15   1HB   MET   3          1HB       MET   3 -17.556   2.105 -17.295
   16   2HB   MET   3          2HB       MET   3 -15.868   1.850 -16.894
   17   1HG   MET   3          1HG       MET   3 -16.329  -0.116 -15.597
   18   2HG   MET   3          2HG       MET   3 -18.020   0.329 -15.334
   19   1HE   MET   3          1HE       MET   3 -18.730  -2.774 -17.207
   20   2HE   MET   3          2HE       MET   3 -19.917  -1.443 -17.084
   21   3HE   MET   3          3HE       MET   3 -18.808  -1.774 -15.722
   22    H    THR   4           H        THR   4 -14.519   2.982 -15.598
   23    HA   THR   4           HA       THR   4 -12.868   4.624 -16.044
   24    HB   THR   4           HB       THR   4 -14.790   5.233 -17.819
   25    HG1  THR   4           HG1      THR   4 -13.023   5.643 -18.697
   26   1HG2  THR   4          1HG2      THR   4 -14.188   8.069 -17.030
   27   2HG2  THR   4          2HG2      THR   4 -15.473   7.285 -16.084
   28   3HG2  THR   4          3HG2      THR   4 -15.610   7.397 -17.858
   29    H    ASP   5           H        ASP   5 -14.929   4.631 -13.584
   30    HA   ASP   5           HA       ASP   5 -14.267   7.289 -12.325
   31   1HB   ASP   5          1HB       ASP   5 -16.394   6.716 -11.618
   32   2HB   ASP   5          2HB       ASP   5 -15.434   6.179 -10.258
   33    H    GLN   6           H        GLN   6 -12.044   5.667 -13.089
   34    HA   GLN   6           HA       GLN   6 -10.963   4.243 -10.644
   35   1HB   GLN   6          1HB       GLN   6 -10.152   4.418 -13.558
   36   2HB   GLN   6          2HB       GLN   6  -8.881   4.131 -12.384
   37   1HG   GLN   6          1HG       GLN   6 -10.390   2.151 -13.564
   38   2HG   GLN   6          2HG       GLN   6 -11.336   2.378 -12.109
   39   1HE2  GLN   6          1HE2      GLN   6  -7.935   0.195 -11.887
   40   2HE2  GLN   6          2HE2      GLN   6  -8.616   0.862 -13.455
   41    H    GLN   7           H        GLN   7 -10.061   6.950 -12.799
   42    HA   GLN   7           HA       GLN   7  -7.940   7.941 -10.854
   43   1HB   GLN   7          1HB       GLN   7  -7.044   9.255 -12.608
   44   2HB   GLN   7          2HB       GLN   7  -7.525   7.749 -13.384
   45   1HG   GLN   7          1HG       GLN   7  -9.711   9.760 -13.498
   46   2HG   GLN   7          2HG       GLN   7  -8.232  10.370 -14.225
   47   1HE2  GLN   7          1HE2      GLN   7 -10.363   8.277 -16.695
   48   2HE2  GLN   7          2HE2      GLN   7 -10.776   9.599 -15.491
   49    H    ALA   8           H        ALA   8 -10.974   8.154 -10.487
   50    HA   ALA   8           HA       ALA   8 -11.713  11.018 -10.675
   51   1HB   ALA   8          1HB       ALA   8 -13.727  10.362  -9.367
   52   2HB   ALA   8          2HB       ALA   8 -13.440   9.246 -10.716
   53   3HB   ALA   8          3HB       ALA   8 -13.038   8.751  -9.052
   54    H    GLU   9           H        GLU   9 -10.776   8.850  -7.992
   55    HA   GLU   9           HA       GLU   9 -10.703  11.046  -5.948
   56   1HB   GLU   9          1HB       GLU   9  -9.465   8.354  -5.311
   57   2HB   GLU   9          2HB       GLU   9 -10.398   9.444  -4.296
   58   1HG   GLU   9          1HG       GLU   9 -11.520   7.518  -6.417
   59   2HG   GLU   9          2HG       GLU   9 -11.756   7.460  -4.674
   60    H    ALA  10           H        ALA  10  -8.417   9.131  -7.848
   61    HA   ALA  10           HA       ALA  10  -5.947   9.999  -6.464
   62   1HB   ALA  10          1HB       ALA  10  -4.759   8.889  -8.349
   63   2HB   ALA  10          2HB       ALA  10  -6.046   7.855  -7.702
   64   3HB   ALA  10          3HB       ALA  10  -6.285   8.708  -9.248
   65    NH1  ARG  11           NH1      ARG  11  -9.197  15.786 -15.510
   66    NH2  ARG  11           NH2      ARG  11  -7.243  16.926 -15.711
   67    H    ARG  11           H        ARG  11  -7.901  11.232  -9.095
   68    HA   ARG  11           HA       ARG  11  -5.924  12.970 -10.440
   69   1HB   ARG  11          1HB       ARG  11  -8.625  12.205 -10.926
   70   2HB   ARG  11          2HB       ARG  11  -8.720  13.932 -10.611
   71   1HG   ARG  11          1HG       ARG  11  -6.454  13.549 -12.381
   72   2HG   ARG  11          2HG       ARG  11  -7.794  12.602 -13.033
   73   1HD   ARG  11          1HD       ARG  11  -9.233  14.511 -13.262
   74   2HD   ARG  11          2HD       ARG  11  -8.303  15.497 -12.133
   75    HE   ARG  11           HE       ARG  11  -6.418  15.141 -14.146
   76   1HH1  ARG  11          1HH1      ARG  11  -6.297  17.097 -15.351
   77   2HH1  ARG  11          2HH1      ARG  11  -7.690  17.390 -16.510
   78   1HH2  ARG  11          1HH2      ARG  11  -9.742  15.082 -15.001
   79   2HH2  ARG  11          2HH2      ARG  11  -9.507  16.336 -16.319
   80    H    ALA  12           H        ALA  12  -8.393  13.500  -7.931
   81    HA   ALA  12           HA       ALA  12  -7.976  16.427  -7.647
   82   1HB   ALA  12          1HB       ALA  12  -9.438  16.238  -5.645
   83   2HB   ALA  12          2HB       ALA  12 -10.138  15.385  -7.035
   84   3HB   ALA  12          3HB       ALA  12  -9.367  14.461  -5.722
   85    H    PHE  13           H        PHE  13  -6.589  13.525  -6.232
   86    HA   PHE  13           HA       PHE  13  -5.315  14.769  -3.888
   87   1HB   PHE  13          1HB       PHE  13  -5.242  12.064  -5.222
   88   2HB   PHE  13          2HB       PHE  13  -5.690  12.491  -3.591
   89    HD1  PHE  13           HD1      PHE  13  -3.094  14.117  -2.884
   90    HD2  PHE  13           HD2      PHE  13  -3.647  10.320  -4.835
   91    HE1  PHE  13           HE1      PHE  13  -0.882  13.377  -2.097
   92    HE2  PHE  13           HE2      PHE  13  -1.435   9.598  -4.036
   93    HZ   PHE  13           HZ       PHE  13  -0.051  11.120  -2.667
   94    H    LEU  14           H        LEU  14  -4.247  13.916  -7.167
   95    HA   LEU  14           HA       LEU  14  -1.473  15.136  -6.676
   96   1HB   LEU  14          1HB       LEU  14  -2.097  13.424  -9.113
   97   2HB   LEU  14          2HB       LEU  14  -0.557  13.729  -8.339
   98    HG   LEU  14           HG       LEU  14  -2.775  12.002  -7.077
   99   1HD1  LEU  14          1HD1      LEU  14   0.196  12.223  -6.285
  100   2HD1  LEU  14          2HD1      LEU  14  -1.125  13.057  -5.447
  101   3HD1  LEU  14          3HD1      LEU  14  -1.066  11.277  -5.456
  102   1HD2  LEU  14          1HD2      LEU  14  -1.527  10.002  -7.784
  103   2HD2  LEU  14          2HD2      LEU  14  -1.805  10.992  -9.238
  104   3HD2  LEU  14          3HD2      LEU  14  -0.211  10.990  -8.468
  105    H    SER  15           H        SER  15  -0.576  15.977  -8.868
  106    HA   SER  15           HA       SER  15  -2.677  17.675 -10.327
  107   1HB   SER  15          1HB       SER  15  -1.407  19.626 -10.164
  108   2HB   SER  15          2HB       SER  15   0.118  18.777  -9.898
  109    HG   SER  15           HG       SER  15  -0.593  19.658  -8.002
  110    H    GLU  16           H        GLU  16  -0.746  18.852 -12.053
  111    HA   GLU  16           HA       GLU  16  -0.455  16.657 -14.088
  112   1HB   GLU  16          1HB       GLU  16  -0.076  19.687 -14.255
  113   2HB   GLU  16          2HB       GLU  16  -1.423  18.740 -14.856
  114   1HG   GLU  16          1HG       GLU  16   1.446  18.441 -15.954
  115   2HG   GLU  16          2HG       GLU  16   0.297  19.603 -16.595
  116    H    GLU  17           H        GLU  17   1.556  18.843 -12.176
  117    HA   GLU  17           HA       GLU  17   4.143  17.976 -13.448
  118   1HB   GLU  17          1HB       GLU  17   3.517  19.958 -11.211
  119   2HB   GLU  17          2HB       GLU  17   5.164  19.478 -11.572
  120   1HG   GLU  17          1HG       GLU  17   3.677  20.333 -14.025
  121   2HG   GLU  17          2HG       GLU  17   5.273  20.799 -13.462
  122    H    MET  18           H        MET  18   2.329  17.496 -10.449
  123    HA   MET  18           HA       MET  18   4.376  16.105  -8.857
  124   1HB   MET  18          1HB       MET  18   2.607  15.418  -7.347
  125   2HB   MET  18          2HB       MET  18   1.366  15.634  -8.567
  126   1HG   MET  18          1HG       MET  18   1.400  18.030  -8.401
  127   2HG   MET  18          2HG       MET  18   3.005  18.057  -7.652
  128   1HE   MET  18          1HE       MET  18   1.612  19.834  -5.947
  129   2HE   MET  18          2HE       MET  18   1.561  19.092  -4.320
  130   3HE   MET  18          3HE       MET  18   3.041  18.956  -5.315
  131    H    ILE  19           H        ILE  19   1.987  15.101 -11.251
  132    HA   ILE  19           HA       ILE  19   2.013  12.222 -10.843
  133    HB   ILE  19           HB       ILE  19   0.859  14.030 -12.786
  134   1HG1  ILE  19          1HG1      ILE  19   0.276  11.231 -11.718
  135   2HG1  ILE  19          2HG1      ILE  19  -0.548  11.731 -13.180
  136   1HG2  ILE  19          1HG2      ILE  19   0.894  12.631 -14.866
  137   2HG2  ILE  19          2HG2      ILE  19   2.526  13.160 -14.462
  138   3HG2  ILE  19          3HG2      ILE  19   2.030  11.489 -14.107
  139   1HD1  ILE  19          1HD1      ILE  19  -1.609  13.673 -12.062
  140   2HD1  ILE  19          2HD1      ILE  19  -1.930  12.179 -11.158
  141   3HD1  ILE  19          3HD1      ILE  19  -0.712  13.329 -10.558
  142    H    ALA  20           H        ALA  20   4.105  14.427 -12.647
  143    HA   ALA  20           HA       ALA  20   5.639  12.759 -14.333
  144   1HB   ALA  20          1HB       ALA  20   7.495  14.406 -14.113
  145   2HB   ALA  20          2HB       ALA  20   5.923  15.217 -14.255
  146   3HB   ALA  20          3HB       ALA  20   6.733  15.118 -12.671
  147    H    GLU  21           H        GLU  21   6.045  13.239 -10.833
  148    HA   GLU  21           HA       GLU  21   8.611  12.039 -10.364
  149   1HB   GLU  21          1HB       GLU  21   6.366  11.613  -8.358
  150   2HB   GLU  21          2HB       GLU  21   6.893  13.244  -8.724
  151   1HG   GLU  21          1HG       GLU  21   8.237  12.763  -6.870
  152   2HG   GLU  21          2HG       GLU  21   8.323  11.045  -7.219
  153    H    PHE  22           H        PHE  22   5.383  10.522 -10.397
  154    HA   PHE  22           HA       PHE  22   6.410   7.747  -9.991
  155   1HB   PHE  22          1HB       PHE  22   3.575   8.757 -10.654
  156   2HB   PHE  22          2HB       PHE  22   3.978   7.086 -10.369
  157    HD1  PHE  22           HD1      PHE  22   4.114   6.178  -8.142
  158    HD2  PHE  22           HD2      PHE  22   3.997  10.448  -8.667
  159    HE1  PHE  22           HE1      PHE  22   3.952   6.483  -5.707
  160    HE2  PHE  22           HE2      PHE  22   3.832  10.732  -6.228
  161    HZ   PHE  22           HZ       PHE  22   3.793   8.755  -4.746
  162    H    LYS  23           H        LYS  23   5.674   9.818 -12.692
  163    HA   LYS  23           HA       LYS  23   5.021   7.822 -14.769
  164   1HB   LYS  23          1HB       LYS  23   4.341   9.999 -15.358
  165   2HB   LYS  23          2HB       LYS  23   5.816  10.756 -14.796
  166   1HG   LYS  23          1HG       LYS  23   6.123   8.918 -17.185
  167   2HG   LYS  23          2HG       LYS  23   6.961  10.407 -16.781
  168   1HD   LYS  23          1HD       LYS  23   5.687  11.345 -18.434
  169   2HD   LYS  23          2HD       LYS  23   4.500  10.035 -18.413
  170   1HE   LYS  23          1HE       LYS  23   4.562  12.193 -16.209
  171   2HE   LYS  23          2HE       LYS  23   3.264  11.037 -16.538
  172   1HZ   LYS  23          1HZ       LYS  23   3.355  12.245 -18.888
  173   2HZ   LYS  23          2HZ       LYS  23   3.960  13.487 -17.983
  174   3HZ   LYS  23          3HZ       LYS  23   2.475  12.856 -17.630
  175    H    ALA  24           H        ALA  24   8.001   9.225 -13.506
  176    HA   ALA  24           HA       ALA  24   9.855   8.464 -15.643
  177   1HB   ALA  24          1HB       ALA  24  11.653   8.887 -13.977
  178   2HB   ALA  24          2HB       ALA  24  10.439  10.179 -13.954
  179   3HB   ALA  24          3HB       ALA  24  10.460   8.955 -12.659
  180    H    ALA  25           H        ALA  25   8.971   6.901 -12.554
  181    HA   ALA  25           HA       ALA  25  10.757   4.547 -12.880
  182   1HB   ALA  25          1HB       ALA  25   9.649   3.694 -10.823
  183   2HB   ALA  25          2HB       ALA  25  10.153   5.383 -10.627
  184   3HB   ALA  25          3HB       ALA  25   8.435   4.994 -10.898
  185    H    PHE  26           H        PHE  26   7.423   5.336 -13.634
  186    HA   PHE  26           HA       PHE  26   6.163   2.766 -13.888
  187   1HB   PHE  26          1HB       PHE  26   4.669   4.558 -14.137
  188   2HB   PHE  26          2HB       PHE  26   5.660   5.418 -15.285
  189    HD1  PHE  26           HD1      PHE  26   3.681   2.185 -14.967
  190    HD2  PHE  26           HD2      PHE  26   5.099   5.255 -17.626
  191    HE1  PHE  26           HE1      PHE  26   2.238   1.314 -16.760
  192    HE2  PHE  26           HE2      PHE  26   3.658   4.362 -19.411
  193    HZ   PHE  26           HZ       PHE  26   2.229   2.392 -18.984
  194    H    ASP  27           H        ASP  27   8.176   4.565 -16.194
  195    HA   ASP  27           HA       ASP  27   7.972   2.702 -18.463
  196   1HB   ASP  27          1HB       ASP  27  10.284   4.658 -17.962
  197   2HB   ASP  27          2HB       ASP  27   9.871   3.885 -19.475
  198    H    MET  28           H        MET  28  10.162   3.024 -15.710
  199    HA   MET  28           HA       MET  28  12.225   1.112 -16.375
  200   1HB   MET  28          1HB       MET  28  11.284   1.160 -13.492
  201   2HB   MET  28          2HB       MET  28  11.857   2.666 -14.186
  202   1HG   MET  28          1HG       MET  28  13.960   1.090 -14.962
  203   2HG   MET  28          2HG       MET  28  13.425   0.150 -13.560
  204   1HE   MET  28          1HE       MET  28  12.303   2.012 -11.392
  205   2HE   MET  28          2HE       MET  28  13.071   3.611 -11.161
  206   3HE   MET  28          3HE       MET  28  11.985   3.338 -12.555
  207    H    PHE  29           H        PHE  29   9.005   0.662 -14.958
  208    HA   PHE  29           HA       PHE  29   9.261  -2.250 -14.432
  209   1HB   PHE  29          1HB       PHE  29   6.681  -2.140 -14.210
  210   2HB   PHE  29          2HB       PHE  29   6.784  -0.433 -14.547
  211    HD1  PHE  29           HD1      PHE  29   9.630  -0.239 -12.939
  212    HD2  PHE  29           HD2      PHE  29   5.684  -1.658 -11.964
  213    HE1  PHE  29           HE1      PHE  29  10.048   0.201 -10.554
  214    HE2  PHE  29           HE2      PHE  29   6.127  -1.217  -9.584
  215    HZ   PHE  29           HZ       PHE  29   8.310  -0.309  -8.873
  216    H    ASP  30           H        ASP  30   8.037  -0.206 -17.042
  217    HA   ASP  30           HA       ASP  30   6.846  -2.329 -18.714
  218   1HB   ASP  30          1HB       ASP  30   7.887   0.261 -19.937
  219   2HB   ASP  30          2HB       ASP  30   6.534   0.318 -18.831
  220    H    ALA  31           H        ALA  31   7.684  -3.199 -20.648
  221    HA   ALA  31           HA       ALA  31  10.708  -3.623 -20.641
  222   1HB   ALA  31          1HB       ALA  31  10.222  -5.725 -21.900
  223   2HB   ALA  31          2HB       ALA  31   9.345  -5.663 -20.359
  224   3HB   ALA  31          3HB       ALA  31   8.479  -5.362 -21.889
  225    H    ASP  32           H        ASP  32   7.981  -2.587 -22.603
  226    HA   ASP  32           HA       ASP  32   9.560  -2.352 -25.169
  227   1HB   ASP  32          1HB       ASP  32   7.007  -2.997 -24.988
  228   2HB   ASP  32          2HB       ASP  32   7.605  -2.042 -26.326
  229    H    GLY  33           H        GLY  33   8.175  -0.316 -22.624
  230   1HA   GLY  33          1HA       GLY  33   9.556   1.671 -21.798
  231   2HA   GLY  33          2HA       GLY  33  10.073   1.918 -23.450
  232    H    GLY  34           H        GLY  34   7.373   2.162 -21.195
  233   1HA   GLY  34          1HA       GLY  34   6.412   4.734 -22.339
  234   2HA   GLY  34          2HA       GLY  34   5.685   3.878 -20.973
  235    H    GLY  35           H        GLY  35   3.603   3.870 -21.511
  236   1HA   GLY  35          1HA       GLY  35   1.961   3.970 -23.634
  237   2HA   GLY  35          2HA       GLY  35   2.719   2.433 -24.070
  238    H    ASP  36           H        ASP  36   2.921   1.012 -21.862
  239    HA   ASP  36           HA       ASP  36   0.859   0.740 -19.921
  240   1HB   ASP  36          1HB       ASP  36  -0.793  -0.862 -21.100
  241   2HB   ASP  36          2HB       ASP  36  -0.979   0.859 -21.348
  242    H    ILE  37           H        ILE  37   1.295  -0.986 -18.734
  243    HA   ILE  37           HA       ILE  37   3.537  -2.806 -19.619
  244    HB   ILE  37           HB       ILE  37   2.334  -2.780 -16.826
  245   1HG1  ILE  37          1HG1      ILE  37   4.698  -1.014 -17.721
  246   2HG1  ILE  37          2HG1      ILE  37   3.085  -0.425 -17.372
  247   1HG2  ILE  37          1HG2      ILE  37   4.460  -3.805 -16.115
  248   2HG2  ILE  37          2HG2      ILE  37   3.749  -4.753 -17.429
  249   3HG2  ILE  37          3HG2      ILE  37   5.126  -3.676 -17.761
  250   1HD1  ILE  37          1HD1      ILE  37   4.954  -1.713 -15.294
  251   2HD1  ILE  37          2HD1      ILE  37   4.494  -0.002 -15.426
  252   3HD1  ILE  37          3HD1      ILE  37   3.272  -1.213 -14.973
  253    H    SER  38           H        SER  38   3.473  -5.101 -19.046
  254    HA   SER  38           HA       SER  38   0.682  -6.368 -19.238
  255   1HB   SER  38          1HB       SER  38   1.165  -7.560 -21.099
  256   2HB   SER  38          2HB       SER  38   2.381  -6.312 -21.383
  257    HG   SER  38           HG       SER  38   2.798  -8.818 -21.157
  258    H    THR  39           H        THR  39   1.467  -8.978 -19.119
  259    HA   THR  39           HA       THR  39   2.216  -9.312 -16.228
  260    HB   THR  39           HB       THR  39   1.935 -11.905 -17.170
  261    HG1  THR  39           HG1      THR  39   1.240 -11.475 -19.122
  262   1HG2  THR  39          1HG2      THR  39  -0.301 -11.926 -16.157
  263   2HG2  THR  39          2HG2      THR  39   0.775 -10.940 -15.139
  264   3HG2  THR  39          3HG2      THR  39  -0.412 -10.151 -16.213
  265    H    LYS  40           H        LYS  40   3.497 -10.154 -19.435
  266    HA   LYS  40           HA       LYS  40   5.888 -11.599 -18.439
  267   1HB   LYS  40          1HB       LYS  40   5.627 -10.404 -21.232
  268   2HB   LYS  40          2HB       LYS  40   4.668 -11.792 -20.790
  269   1HG   LYS  40          1HG       LYS  40   6.748 -13.118 -20.445
  270   2HG   LYS  40          2HG       LYS  40   7.742 -11.688 -20.519
  271   1HD   LYS  40          1HD       LYS  40   8.166 -12.261 -22.704
  272   2HD   LYS  40          2HD       LYS  40   6.922 -13.475 -22.631
  273   1HE   LYS  40          1HE       LYS  40   5.261 -11.350 -22.960
  274   2HE   LYS  40          2HE       LYS  40   6.676 -10.685 -23.765
  275   1HZ   LYS  40          1HZ       LYS  40   4.882 -12.270 -24.944
  276   2HZ   LYS  40          2HZ       LYS  40   5.972 -13.429 -24.501
  277   3HZ   LYS  40          3HZ       LYS  40   6.448 -12.171 -25.461
  278    H    GLU  41           H        GLU  41   5.095  -8.315 -19.497
  279    HA   GLU  41           HA       GLU  41   7.845  -7.243 -19.668
  280   1HB   GLU  41          1HB       GLU  41   6.963  -5.233 -20.283
  281   2HB   GLU  41          2HB       GLU  41   5.645  -5.296 -19.133
  282   1HG   GLU  41          1HG       GLU  41   5.511  -7.221 -21.490
  283   2HG   GLU  41          2HG       GLU  41   4.213  -6.469 -20.588
  284    H    LEU  42           H        LEU  42   5.262  -7.080 -17.215
  285    HA   LEU  42           HA       LEU  42   6.799  -5.453 -15.248
  286   1HB   LEU  42          1HB       LEU  42   4.403  -7.204 -14.513
  287   2HB   LEU  42          2HB       LEU  42   4.168  -5.779 -15.501
  288    HG   LEU  42           HG       LEU  42   4.576  -4.280 -13.757
  289   1HD1  LEU  42          1HD1      LEU  42   6.230  -6.349 -12.181
  290   2HD1  LEU  42          2HD1      LEU  42   6.936  -5.170 -13.297
  291   3HD1  LEU  42          3HD1      LEU  42   6.076  -4.605 -11.843
  292   1HD2  LEU  42          1HD2      LEU  42   3.412  -5.024 -11.709
  293   2HD2  LEU  42          2HD2      LEU  42   2.615  -5.791 -13.105
  294   3HD2  LEU  42          3HD2      LEU  42   3.721  -6.737 -12.093
  295    H    GLY  43           H        GLY  43   6.177  -8.868 -15.857
  296   1HA   GLY  43          1HA       GLY  43   6.909 -10.200 -13.452
  297   2HA   GLY  43          2HA       GLY  43   7.258 -10.875 -15.048
  298    H    THR  44           H        THR  44   8.980  -8.613 -15.817
  299    HA   THR  44           HA       THR  44  11.545  -9.809 -15.092
  300    HB   THR  44           HB       THR  44  10.766  -7.368 -16.689
  301    HG1  THR  44           HG1      THR  44  11.381  -9.851 -17.120
  302   1HG2  THR  44          1HG2      THR  44  13.159  -6.812 -17.156
  303   2HG2  THR  44          2HG2      THR  44  12.739  -6.473 -15.463
  304   3HG2  THR  44          3HG2      THR  44  13.683  -7.929 -15.871
  305    H    VAL  45           H        VAL  45  10.141  -6.627 -14.262
  306    HA   VAL  45           HA       VAL  45  12.285  -5.717 -12.499
  307    HB   VAL  45           HB       VAL  45   9.563  -4.745 -13.178
  308   1HG1  VAL  45          1HG1      VAL  45  12.110  -3.151 -12.488
  309   2HG1  VAL  45          2HG1      VAL  45  11.786  -3.815 -14.094
  310   3HG1  VAL  45          3HG1      VAL  45  10.691  -2.592 -13.411
  311   1HG2  VAL  45          1HG2      VAL  45   9.215  -3.236 -11.292
  312   2HG2  VAL  45          2HG2      VAL  45   9.377  -4.868 -10.603
  313   3HG2  VAL  45          3HG2      VAL  45  10.736  -3.738 -10.509
  314    H    MET  46           H        MET  46   9.361  -7.633 -12.004
  315    HA   MET  46           HA       MET  46   9.306  -7.791  -9.094
  316   1HB   MET  46          1HB       MET  46   8.263  -9.702 -11.246
  317   2HB   MET  46          2HB       MET  46   8.187 -10.127  -9.546
  318   1HG   MET  46          1HG       MET  46   7.055  -7.406 -10.293
  319   2HG   MET  46          2HG       MET  46   6.156  -8.840 -10.815
  320   1HE   MET  46          1HE       MET  46   6.610 -11.084  -8.660
  321   2HE   MET  46          2HE       MET  46   5.337 -10.724  -7.457
  322   3HE   MET  46          3HE       MET  46   4.969 -10.612  -9.202
  323    NH1  ARG  47           NH1      ARG  47  16.701 -14.660 -13.820
  324    NH2  ARG  47           NH2      ARG  47  17.776 -12.723 -13.313
  325    H    ARG  47           H        ARG  47  10.959  -9.737 -11.567
  326    HA   ARG  47           HA       ARG  47  12.034 -11.886  -9.941
  327   1HB   ARG  47          1HB       ARG  47  12.153 -11.273 -12.636
  328   2HB   ARG  47          2HB       ARG  47  13.803 -10.900 -12.154
  329   1HG   ARG  47          1HG       ARG  47  13.830 -13.264 -10.983
  330   2HG   ARG  47          2HG       ARG  47  12.367 -13.596 -11.912
  331   1HD   ARG  47          1HD       ARG  47  14.202 -14.457 -13.259
  332   2HD   ARG  47          2HD       ARG  47  13.641 -12.995 -14.057
  333    HE   ARG  47           HE       ARG  47  15.634 -11.782 -12.786
  334   1HH1  ARG  47          1HH1      ARG  47  15.809 -15.162 -13.887
  335   2HH1  ARG  47          2HH1      ARG  47  17.633 -15.030 -14.037
  336   1HH2  ARG  47          1HH2      ARG  47  17.708 -11.750 -12.995
  337   2HH2  ARG  47          2HH2      ARG  47  18.632 -13.229 -13.566
  338    H    MET  48           H        MET  48  13.168  -8.600 -10.573
  339    HA   MET  48           HA       MET  48  15.686  -8.897  -8.918
  340   1HB   MET  48          1HB       MET  48  15.620  -6.219  -9.381
  341   2HB   MET  48          2HB       MET  48  14.551  -6.712 -10.680
  342   1HG   MET  48          1HG       MET  48  17.006  -8.397 -10.633
  343   2HG   MET  48          2HG       MET  48  16.273  -7.496 -11.970
  344   1HE   MET  48          1HE       MET  48  16.077  -4.464 -11.011
  345   2HE   MET  48          2HE       MET  48  17.672  -3.839 -11.523
  346   3HE   MET  48          3HE       MET  48  16.767  -4.951 -12.590
  347    H    LEU  49           H        LEU  49  14.358  -9.603  -7.083
  348    HA   LEU  49           HA       LEU  49  13.920  -7.298  -5.183
  349   1HB   LEU  49          1HB       LEU  49  11.643  -9.136  -6.057
  350   2HB   LEU  49          2HB       LEU  49  11.661  -7.389  -5.960
  351    HG   LEU  49           HG       LEU  49  12.075  -8.711  -3.301
  352   1HD1  LEU  49          1HD1      LEU  49   9.331  -9.049  -4.667
  353   2HD1  LEU  49          2HD1      LEU  49  10.496 -10.364  -4.429
  354   3HD1  LEU  49          3HD1      LEU  49   9.775  -9.553  -3.016
  355   1HD2  LEU  49          1HD2      LEU  49  10.487  -7.005  -2.514
  356   2HD2  LEU  49          2HD2      LEU  49  11.595  -6.205  -3.656
  357   3HD2  LEU  49          3HD2      LEU  49   9.961  -6.639  -4.177
  358    H    GLY  50           H        GLY  50  13.457 -10.815  -5.646
  359   1HA   GLY  50          1HA       GLY  50  14.326 -11.590  -2.905
  360   2HA   GLY  50          2HA       GLY  50  15.662 -11.771  -4.051
  361    H    GLN  51           H        GLN  51  12.153 -12.322  -4.379
  362    HA   GLN  51           HA       GLN  51  12.451 -15.303  -4.773
  363   1HB   GLN  51          1HB       GLN  51  10.400 -13.751  -3.739
  364   2HB   GLN  51          2HB       GLN  51   9.822 -13.994  -5.377
  365   1HG   GLN  51          1HG       GLN  51   9.906 -16.458  -5.125
  366   2HG   GLN  51          2HG       GLN  51   8.900 -15.725  -3.896
  367   1HE2  GLN  51          1HE2      GLN  51  10.888 -16.987  -1.183
  368   2HE2  GLN  51          2HE2      GLN  51   9.550 -15.845  -1.704
  369    H    ASN  52           H        ASN  52  10.682 -15.841  -6.746
  370    HA   ASN  52           HA       ASN  52  11.357 -14.235  -9.207
  371   1HB   ASN  52          1HB       ASN  52  11.813 -17.265  -9.289
  372   2HB   ASN  52          2HB       ASN  52  13.099 -16.172  -8.828
  373   1HD2  ASN  52          1HD2      ASN  52  13.857 -16.085 -12.352
  374   2HD2  ASN  52          2HD2      ASN  52  14.392 -16.451 -10.636
  375    HA   PRO  53           HA       PRO  53   6.691 -15.395  -9.136
  376   1HB   PRO  53          1HB       PRO  53   5.664 -13.519 -10.189
  377   2HB   PRO  53          2HB       PRO  53   6.940 -13.405 -11.409
  378   1HG   PRO  53          1HG       PRO  53   7.657 -11.642 -10.062
  379   2HG   PRO  53          2HG       PRO  53   7.012 -12.327  -8.553
  380   1HD   PRO  53          1HD       PRO  53   9.261 -13.034  -8.218
  381   2HD   PRO  53          2HD       PRO  53   9.671 -12.859  -9.949
  382    H    THR  54           H        THR  54   5.384 -16.334 -10.865
  383    HA   THR  54           HA       THR  54   7.001 -17.709 -13.075
  384    HB   THR  54           HB       THR  54   5.842 -19.052 -11.021
  385    HG1  THR  54           HG1      THR  54   7.105 -20.081 -12.375
  386   1HG2  THR  54          1HG2      THR  54   3.796 -20.224 -11.766
  387   2HG2  THR  54          2HG2      THR  54   3.472 -18.481 -11.625
  388   3HG2  THR  54          3HG2      THR  54   3.700 -19.218 -13.231
  389    H    LYS  55           H        LYS  55   5.673 -18.316 -14.962
  390    HA   LYS  55           HA       LYS  55   4.546 -15.942 -16.192
  391   1HB   LYS  55          1HB       LYS  55   5.646 -17.834 -17.459
  392   2HB   LYS  55          2HB       LYS  55   4.269 -18.868 -17.134
  393   1HG   LYS  55          1HG       LYS  55   2.971 -16.759 -18.340
  394   2HG   LYS  55          2HG       LYS  55   4.539 -16.607 -19.114
  395   1HD   LYS  55          1HD       LYS  55   4.362 -19.096 -19.816
  396   2HD   LYS  55          2HD       LYS  55   3.202 -18.004 -20.555
  397   1HE   LYS  55          1HE       LYS  55   2.713 -20.332 -18.799
  398   2HE   LYS  55          2HE       LYS  55   1.839 -18.917 -18.218
  399   1HZ   LYS  55          1HZ       LYS  55   1.536 -20.373 -20.757
  400   2HZ   LYS  55          2HZ       LYS  55   1.192 -18.758 -20.769
  401   3HZ   LYS  55          3HZ       LYS  55   0.375 -19.768 -19.749
  402    H    GLU  56           H        GLU  56   2.906 -19.019 -15.358
  403    HA   GLU  56           HA       GLU  56   0.191 -18.181 -15.965
  404   1HB   GLU  56          1HB       GLU  56   1.358 -20.452 -14.330
  405   2HB   GLU  56          2HB       GLU  56  -0.359 -20.128 -14.197
  406   1HG   GLU  56          1HG       GLU  56  -0.481 -20.320 -16.797
  407   2HG   GLU  56          2HG       GLU  56   1.188 -20.863 -16.760
  408    H    GLU  57           H        GLU  57   2.099 -18.099 -12.970
  409    HA   GLU  57           HA       GLU  57  -0.013 -17.314 -11.100
  410   1HB   GLU  57          1HB       GLU  57   2.820 -16.413 -10.572
  411   2HB   GLU  57          2HB       GLU  57   2.516 -18.132 -10.712
  412   1HG   GLU  57          1HG       GLU  57   0.477 -17.200  -8.908
  413   2HG   GLU  57          2HG       GLU  57   1.881 -18.186  -8.521
  414    H    LEU  58           H        LEU  58   2.075 -15.517 -13.289
  415    HA   LEU  58           HA       LEU  58   1.829 -12.842 -12.213
  416   1HB   LEU  58          1HB       LEU  58   2.524 -13.973 -14.949
  417   2HB   LEU  58          2HB       LEU  58   2.218 -12.253 -14.812
  418    HG   LEU  58           HG       LEU  58   4.232 -13.670 -12.966
  419   1HD1  LEU  58          1HD1      LEU  58   6.071 -12.948 -14.539
  420   2HD1  LEU  58          2HD1      LEU  58   5.014 -14.149 -15.296
  421   3HD1  LEU  58          3HD1      LEU  58   4.856 -12.431 -15.737
  422   1HD2  LEU  58          1HD2      LEU  58   3.982 -10.719 -13.847
  423   2HD2  LEU  58          2HD2      LEU  58   3.502 -11.385 -12.266
  424   3HD2  LEU  58          3HD2      LEU  58   5.211 -11.383 -12.741
  425    H    ASP  59           H        ASP  59  -0.236 -14.759 -14.323
  426    HA   ASP  59           HA       ASP  59  -2.011 -12.734 -15.388
  427   1HB   ASP  59          1HB       ASP  59  -2.721 -15.665 -14.798
  428   2HB   ASP  59          2HB       ASP  59  -1.927 -15.084 -16.243
  429    H    ALA  60           H        ALA  60  -2.025 -14.499 -12.326
  430    HA   ALA  60           HA       ALA  60  -4.691 -13.500 -11.421
  431   1HB   ALA  60          1HB       ALA  60  -4.189 -14.732  -9.316
  432   2HB   ALA  60          2HB       ALA  60  -3.905 -15.746 -10.744
  433   3HB   ALA  60          3HB       ALA  60  -2.524 -15.047  -9.861
  434    H    ILE  61           H        ILE  61  -1.284 -12.765 -10.814
  435    HA   ILE  61           HA       ILE  61  -1.522 -10.914  -8.573
  436    HB   ILE  61           HB       ILE  61   0.601 -11.620 -10.511
  437   1HG1  ILE  61          1HG1      ILE  61   0.169 -11.721  -7.666
  438   2HG1  ILE  61          2HG1      ILE  61   1.523 -12.355  -8.577
  439   1HG2  ILE  61          1HG2      ILE  61   2.021  -9.575 -10.184
  440   2HG2  ILE  61          2HG2      ILE  61   0.548  -9.172 -11.063
  441   3HG2  ILE  61          3HG2      ILE  61   0.683  -8.758  -9.339
  442   1HD1  ILE  61          1HD1      ILE  61   1.440  -9.537  -7.346
  443   2HD1  ILE  61          2HD1      ILE  61   2.399 -10.932  -6.807
  444   3HD1  ILE  61          3HD1      ILE  61   2.761 -10.164  -8.370
  445    H    ILE  62           H        ILE  62  -1.898 -10.565 -12.066
  446    HA   ILE  62           HA       ILE  62  -2.166  -7.599 -12.071
  447    HB   ILE  62           HB       ILE  62  -2.553  -9.723 -14.218
  448   1HG1  ILE  62          1HG1      ILE  62  -0.400  -7.746 -13.480
  449   2HG1  ILE  62          2HG1      ILE  62  -0.269  -9.332 -14.212
  450   1HG2  ILE  62          1HG2      ILE  62  -3.063  -7.935 -15.905
  451   2HG2  ILE  62          2HG2      ILE  62  -4.329  -7.999 -14.680
  452   3HG2  ILE  62          3HG2      ILE  62  -3.110  -6.705 -14.617
  453   1HD1  ILE  62          1HD1      ILE  62  -0.992  -6.772 -15.757
  454   2HD1  ILE  62          2HD1      ILE  62   0.527  -7.689 -15.820
  455   3HD1  ILE  62          3HD1      ILE  62  -0.968  -8.413 -16.459
  456    H    GLU  63           H        GLU  63  -4.389 -10.372 -12.469
  457    HA   GLU  63           HA       GLU  63  -6.919  -9.125 -12.692
  458   1HB   GLU  63          1HB       GLU  63  -6.666 -11.510 -10.822
  459   2HB   GLU  63          2HB       GLU  63  -6.243 -11.691 -12.513
  460   1HG   GLU  63          1HG       GLU  63  -8.982 -11.052 -11.290
  461   2HG   GLU  63          2HG       GLU  63  -8.668 -10.629 -12.965
  462    H    GLU  64           H        GLU  64  -4.872  -9.450  -9.844
  463    HA   GLU  64           HA       GLU  64  -6.744  -8.718  -7.724
  464   1HB   GLU  64          1HB       GLU  64  -4.315  -7.738  -6.796
  465   2HB   GLU  64          2HB       GLU  64  -3.773  -8.907  -7.984
  466   1HG   GLU  64          1HG       GLU  64  -3.901  -9.963  -5.761
  467   2HG   GLU  64          2HG       GLU  64  -5.563  -9.447  -5.535
  468    H    VAL  65           H        VAL  65  -4.394  -6.749  -9.571
  469    HA   VAL  65           HA       VAL  65  -5.927  -4.200  -8.832
  470    HB   VAL  65           HB       VAL  65  -3.698  -4.143  -7.909
  471   1HG1  VAL  65          1HG1      VAL  65  -1.602  -4.244  -9.270
  472   2HG1  VAL  65          2HG1      VAL  65  -2.509  -5.763  -9.396
  473   3HG1  VAL  65          3HG1      VAL  65  -2.541  -4.599 -10.742
  474   1HG2  VAL  65          1HG2      VAL  65  -3.819  -2.235 -10.345
  475   2HG2  VAL  65          2HG2      VAL  65  -4.525  -1.936  -8.739
  476   3HG2  VAL  65          3HG2      VAL  65  -2.768  -2.040  -8.921
  477    H    ASP  66           H        ASP  66  -6.972  -5.777 -10.795
  478    HA   ASP  66           HA       ASP  66  -6.666  -4.063 -13.269
  479   1HB   ASP  66          1HB       ASP  66  -5.058  -5.893 -13.720
  480   2HB   ASP  66          2HB       ASP  66  -6.283  -7.104 -13.417
  481    H    GLU  67           H        GLU  67  -8.623  -3.847 -11.544
  482    HA   GLU  67           HA       GLU  67 -11.020  -5.545 -12.228
  483   1HB   GLU  67          1HB       GLU  67 -12.102  -3.666 -10.625
  484   2HB   GLU  67          2HB       GLU  67 -11.286  -5.099 -10.029
  485   1HG   GLU  67          1HG       GLU  67  -9.638  -2.553 -10.445
  486   2HG   GLU  67          2HG       GLU  67  -9.348  -3.880  -9.333
  487    H    ASP  68           H        ASP  68  -9.890  -4.185 -14.428
  488    HA   ASP  68           HA       ASP  68 -11.938  -2.007 -15.086
  489   1HB   ASP  68          1HB       ASP  68 -10.189  -0.627 -15.416
  490   2HB   ASP  68          2HB       ASP  68  -9.018  -1.921 -15.319
  491    H    GLY  69           H        GLY  69  -9.835  -4.545 -16.485
  492   1HA   GLY  69          1HA       GLY  69 -11.950  -5.094 -18.649
  493   2HA   GLY  69          2HA       GLY  69 -11.258  -6.427 -17.719
  494    H    SER  70           H        SER  70  -9.535  -3.556 -18.858
  495    HA   SER  70           HA       SER  70  -8.495  -4.294 -21.377
  496   1HB   SER  70          1HB       SER  70  -6.924  -2.584 -21.165
  497   2HB   SER  70          2HB       SER  70  -8.144  -2.104 -19.981
  498    HG   SER  70           HG       SER  70  -6.854  -3.163 -18.385
  499    H    GLY  71           H        GLY  71  -7.038  -5.043 -18.191
  500   1HA   GLY  71          1HA       GLY  71  -6.033  -7.307 -17.668
  501   2HA   GLY  71          2HA       GLY  71  -5.659  -7.494 -19.387
  502    H    THR  72           H        THR  72  -4.677  -4.782 -19.721
  503    HA   THR  72           HA       THR  72  -1.883  -5.077 -18.563
  504    HB   THR  72           HB       THR  72  -1.407  -3.017 -20.100
  505    HG1  THR  72           HG1      THR  72  -3.890  -3.098 -20.467
  506   1HG2  THR  72          1HG2      THR  72  -0.976  -4.395 -22.095
  507   2HG2  THR  72          2HG2      THR  72  -0.503  -5.314 -20.649
  508   3HG2  THR  72          3HG2      THR  72  -2.021  -5.704 -21.500
  509    H    ILE  73           H        ILE  73  -0.904  -3.397 -17.407
  510    HA   ILE  73           HA       ILE  73  -2.813  -1.675 -15.775
  511    HB   ILE  73           HB       ILE  73   0.065  -2.558 -15.255
  512   1HG1  ILE  73          1HG1      ILE  73  -1.339  -4.345 -14.566
  513   2HG1  ILE  73          2HG1      ILE  73  -2.654  -3.293 -14.087
  514   1HG2  ILE  73          1HG2      ILE  73   0.071  -1.240 -13.141
  515   2HG2  ILE  73          2HG2      ILE  73  -0.176  -0.152 -14.514
  516   3HG2  ILE  73          3HG2      ILE  73  -1.553  -0.599 -13.479
  517   1HD1  ILE  73          1HD1      ILE  73  -1.488  -2.583 -12.016
  518   2HD1  ILE  73          2HD1      ILE  73  -1.588  -4.354 -12.111
  519   3HD1  ILE  73          3HD1      ILE  73  -0.049  -3.536 -12.472
  520    H    ASP  74           H        ASP  74  -3.252  -0.041 -17.173
  521    HA   ASP  74           HA       ASP  74  -1.183   1.452 -18.735
  522   1HB   ASP  74          1HB       ASP  74  -2.883   2.676 -19.725
  523   2HB   ASP  74          2HB       ASP  74  -3.872   2.731 -18.284
  524    H    PHE  75           H        PHE  75  -0.938   3.825 -18.421
  525    HA   PHE  75           HA       PHE  75   0.232   4.448 -15.854
  526   1HB   PHE  75          1HB       PHE  75   0.759   5.607 -18.066
  527   2HB   PHE  75          2HB       PHE  75  -0.738   6.492 -17.943
  528    HD1  PHE  75           HD1      PHE  75   1.542   5.726 -15.025
  529    HD2  PHE  75           HD2      PHE  75   0.134   8.739 -17.757
  530    HE1  PHE  75           HE1      PHE  75   2.682   7.466 -13.711
  531    HE2  PHE  75           HE2      PHE  75   1.289  10.464 -16.431
  532    HZ   PHE  75           HZ       PHE  75   2.560   9.834 -14.411
  533    H    GLU  76           H        GLU  76  -3.000   4.962 -17.144
  534    HA   GLU  76           HA       GLU  76  -4.064   6.910 -15.288
  535   1HB   GLU  76          1HB       GLU  76  -6.066   6.653 -16.286
  536   2HB   GLU  76          2HB       GLU  76  -6.072   4.909 -16.129
  537   1HG   GLU  76          1HG       GLU  76  -4.250   5.041 -18.140
  538   2HG   GLU  76          2HG       GLU  76  -5.978   5.014 -18.419
  539    H    GLU  77           H        GLU  77  -4.589   3.372 -15.237
  540    HA   GLU  77           HA       GLU  77  -5.728   3.287 -12.516
  541   1HB   GLU  77          1HB       GLU  77  -6.225   1.140 -12.920
  542   2HB   GLU  77          2HB       GLU  77  -5.847   1.552 -14.576
  543   1HG   GLU  77          1HG       GLU  77  -3.360   0.735 -13.924
  544   2HG   GLU  77          2HG       GLU  77  -4.182  -0.094 -12.607
  545    H    PHE  78           H        PHE  78  -2.481   3.266 -13.738
  546    HA   PHE  78           HA       PHE  78  -1.071   1.912 -11.585
  547   1HB   PHE  78          1HB       PHE  78   0.031   4.243 -13.273
  548   2HB   PHE  78          2HB       PHE  78  -0.110   2.613 -13.879
  549    HD1  PHE  78           HD1      PHE  78   0.679   1.474 -10.873
  550    HD2  PHE  78           HD2      PHE  78   2.494   4.156 -13.706
  551    HE1  PHE  78           HE1      PHE  78   2.905   0.951  -9.959
  552    HE2  PHE  78           HE2      PHE  78   4.711   3.620 -12.779
  553    HZ   PHE  78           HZ       PHE  78   4.922   2.012 -10.916
  554    H    LEU  79           H        LEU  79  -2.193   5.238 -11.989
  555    HA   LEU  79           HA       LEU  79  -0.819   6.377  -9.619
  556   1HB   LEU  79          1HB       LEU  79  -3.017   7.392 -11.482
  557   2HB   LEU  79          2HB       LEU  79  -2.685   8.252  -9.995
  558    HG   LEU  79           HG       LEU  79  -0.559   7.704 -12.158
  559   1HD1  LEU  79          1HD1      LEU  79  -0.426   9.642  -9.763
  560   2HD1  LEU  79          2HD1      LEU  79   0.338   8.042  -9.797
  561   3HD1  LEU  79          3HD1      LEU  79   0.870   9.301 -10.939
  562   1HD2  LEU  79          1HD2      LEU  79  -0.820  10.033 -12.902
  563   2HD2  LEU  79          2HD2      LEU  79  -2.438   9.290 -12.933
  564   3HD2  LEU  79          3HD2      LEU  79  -1.997  10.380 -11.611
  565    H    VAL  80           H        VAL  80  -3.998   4.992 -10.283
  566    HA   VAL  80           HA       VAL  80  -5.282   5.671  -7.709
  567    HB   VAL  80           HB       VAL  80  -6.102   3.372  -9.550
  568   1HG1  VAL  80          1HG1      VAL  80  -7.123   6.271  -9.775
  569   2HG1  VAL  80          2HG1      VAL  80  -5.867   5.607 -10.827
  570   3HG1  VAL  80          3HG1      VAL  80  -7.496   4.893 -10.843
  571   1HG2  VAL  80          1HG2      VAL  80  -8.369   3.670  -8.664
  572   2HG2  VAL  80          2HG2      VAL  80  -7.282   3.502  -7.266
  573   3HG2  VAL  80          3HG2      VAL  80  -7.886   5.102  -7.721
  574    H    MET  81           H        MET  81  -3.259   3.060  -8.914
  575    HA   MET  81           HA       MET  81  -3.646   1.029  -6.829
  576   1HB   MET  81          1HB       MET  81  -1.088   1.531  -8.462
  577   2HB   MET  81          2HB       MET  81  -2.476   0.626  -9.038
  578   1HG   MET  81          1HG       MET  81  -1.978  -1.265  -7.772
  579   2HG   MET  81          2HG       MET  81  -1.355  -0.333  -6.399
  580   1HE   MET  81          1HE       MET  81  -0.583  -2.427  -9.459
  581   2HE   MET  81          2HE       MET  81   1.179  -2.621  -9.212
  582   3HE   MET  81          3HE       MET  81   0.044  -3.051  -7.901
  583    H    MET  82           H        MET  82  -1.054   3.465  -7.242
  584    HA   MET  82           HA       MET  82   0.225   2.947  -4.637
  585   1HB   MET  82          1HB       MET  82   1.281   5.354  -5.205
  586   2HB   MET  82          2HB       MET  82   0.566   5.075  -6.781
  587   1HG   MET  82          1HG       MET  82   1.880   2.618  -6.296
  588   2HG   MET  82          2HG       MET  82   2.472   3.943  -7.305
  589   1HE   MET  82          1HE       MET  82   5.713   2.884  -5.266
  590   2HE   MET  82          2HE       MET  82   5.167   3.474  -6.864
  591   3HE   MET  82          3HE       MET  82   4.475   1.971  -6.187
  592    H    VAL  83           H        VAL  83  -2.296   5.122  -5.755
  593    HA   VAL  83           HA       VAL  83  -2.251   7.072  -3.563
  594    HB   VAL  83           HB       VAL  83  -4.229   6.445  -5.758
  595   1HG1  VAL  83          1HG1      VAL  83  -5.852   8.151  -4.916
  596   2HG1  VAL  83          2HG1      VAL  83  -5.751   6.782  -3.799
  597   3HG1  VAL  83          3HG1      VAL  83  -4.932   8.310  -3.398
  598   1HG2  VAL  83          1HG2      VAL  83  -2.871   9.086  -4.899
  599   2HG2  VAL  83          2HG2      VAL  83  -2.367   8.052  -6.257
  600   3HG2  VAL  83          3HG2      VAL  83  -3.937   8.868  -6.311
  601    NH1  ARG  84           NH1      ARG  84  -7.523  -1.535  -3.544
  602    NH2  ARG  84           NH2      ARG  84  -5.471  -2.049  -2.718
  603    H    ARG  84           H        ARG  84  -3.858   3.978  -4.097
  604    HA   ARG  84           HA       ARG  84  -5.922   3.943  -2.086
  605   1HB   ARG  84          1HB       ARG  84  -4.294   1.786  -3.460
  606   2HB   ARG  84          2HB       ARG  84  -5.128   1.332  -1.981
  607   1HG   ARG  84          1HG       ARG  84  -7.260   1.557  -2.877
  608   2HG   ARG  84          2HG       ARG  84  -6.810   2.860  -3.980
  609   1HD   ARG  84          1HD       ARG  84  -7.362   0.620  -5.113
  610   2HD   ARG  84          2HD       ARG  84  -5.823   1.335  -5.598
  611    HE   ARG  84           HE       ARG  84  -4.688  -0.552  -4.583
  612   1HH1  ARG  84          1HH1      ARG  84  -8.083  -0.941  -4.166
  613   2HH1  ARG  84          2HH1      ARG  84  -7.870  -2.277  -2.926
  614   1HH2  ARG  84          1HH2      ARG  84  -4.469  -1.829  -2.688
  615   2HH2  ARG  84          2HH2      ARG  84  -5.958  -2.769  -2.172
  616    H    GLN  85           H        GLN  85  -2.450   3.195  -1.805
  617    HA   GLN  85           HA       GLN  85  -2.492   2.172   0.960
  618   1HB   GLN  85          1HB       GLN  85  -0.641   1.981  -0.959
  619   2HB   GLN  85          2HB       GLN  85  -0.257   1.835   0.746
  620   1HG   GLN  85          1HG       GLN  85   0.376   4.123  -1.159
  621   2HG   GLN  85          2HG       GLN  85   0.198   4.511   0.537
  622   1HE2  GLN  85          1HE2      GLN  85   3.248   1.779  -0.255
  623   2HE2  GLN  85          2HE2      GLN  85   1.561   1.523  -0.928
  624    H    MET  86           H        MET  86  -2.057   5.356  -0.507
  625    HA   MET  86           HA       MET  86  -0.977   6.928   1.617
  626   1HB   MET  86          1HB       MET  86  -2.295   7.520  -0.889
  627   2HB   MET  86          2HB       MET  86  -3.063   8.511   0.339
  628   1HG   MET  86          1HG       MET  86  -0.211   8.727   0.820
  629   2HG   MET  86          2HG       MET  86  -0.462   8.892  -0.926
  630   1HE   MET  86          1HE       MET  86  -3.713   9.900  -0.657
  631   2HE   MET  86          2HE       MET  86  -3.473  11.661  -0.848
  632   3HE   MET  86          3HE       MET  86  -2.610  10.523  -1.923
  633    H    LYS  87           H        LYS  87  -4.272   5.772   1.125
  634    HA   LYS  87           HA       LYS  87  -5.813   7.359   2.963
  635   1HB   LYS  87          1HB       LYS  87  -6.587   5.337   1.386
  636   2HB   LYS  87          2HB       LYS  87  -7.517   5.836   2.792
  637   1HG   LYS  87          1HG       LYS  87  -6.351   4.015   4.165
  638   2HG   LYS  87          2HG       LYS  87  -5.600   3.429   2.690
  639   1HD   LYS  87          1HD       LYS  87  -7.969   2.476   3.695
  640   2HD   LYS  87          2HD       LYS  87  -8.613   3.776   2.698
  641   1HE   LYS  87          1HE       LYS  87  -7.341   2.784   0.671
  642   2HE   LYS  87          2HE       LYS  87  -6.905   1.404   1.688
  643   1HZ   LYS  87          1HZ       LYS  87  -8.864   0.549   1.114
  644   2HZ   LYS  87          2HZ       LYS  87  -9.381   1.945   0.397
  645   3HZ   LYS  87          3HZ       LYS  87  -9.634   1.703   2.011
  646    H    GLU  88           H        GLU  88  -6.054   7.432   5.104
  647    HA   GLU  88           HA       GLU  88  -4.394   5.556   6.873
  648   1HB   GLU  88          1HB       GLU  88  -5.018   8.496   7.468
  649   2HB   GLU  88          2HB       GLU  88  -4.042   7.416   8.445
  650   1HG   GLU  88          1HG       GLU  88  -2.740   9.081   6.998
  651   2HG   GLU  88          2HG       GLU  88  -3.320   8.254   5.562
  652    H    ASP  89           H        ASP  89  -7.067   5.115   5.950
  653    HA   ASP  89           HA       ASP  89  -8.925   5.813   8.256
  654   1HB   ASP  89          1HB       ASP  89 -10.500   4.389   6.432
  655   2HB   ASP  89          2HB       ASP  89  -9.360   5.184   5.372
  656    H    ALA  90           H        ALA  90  -7.145   4.258   9.251
  657    HA   ALA  90           HA       ALA  90  -6.783   2.226  10.500
  658   1HB   ALA  90          1HB       ALA  90  -8.800   0.851  11.079
  659   2HB   ALA  90          2HB       ALA  90  -9.131   2.580  11.308
  660   3HB   ALA  90          3HB       ALA  90  -9.782   1.734   9.883
   
  Start of MODEL          11
 Raw file had  660 H/Q atoms
  Start of MODEL   11
    1   1H    ALA   1          1H        ALA   1 -23.402   4.298 -18.547
    2   2H    ALA   1          2H        ALA   1 -24.555   4.409 -17.328
    3   3H    ALA   1          3H        ALA   1 -24.390   5.655 -18.445
    4    HA   ALA   1           HA       ALA   1 -21.969   5.742 -17.619
    5   1HB   ALA   1          1HB       ALA   1 -23.892   7.506 -17.460
    6   2HB   ALA   1          2HB       ALA   1 -22.572   7.647 -16.282
    7   3HB   ALA   1          3HB       ALA   1 -24.135   6.947 -15.787
    8    H    SER   2           H        SER   2 -21.556   3.473 -16.984
    9    HA   SER   2           HA       SER   2 -21.951   2.957 -13.982
   10   1HB   SER   2          1HB       SER   2 -21.719   0.744 -16.088
   11   2HB   SER   2          2HB       SER   2 -22.112   0.574 -14.375
   12    HG   SER   2           HG       SER   2 -23.892   0.576 -15.884
   13    H    MET   3           H        MET   3 -19.945   4.308 -13.995
   14    HA   MET   3           HA       MET   3 -17.450   2.558 -14.249
   15   1HB   MET   3          1HB       MET   3 -16.870   5.402 -14.820
   16   2HB   MET   3          2HB       MET   3 -16.324   3.949 -15.639
   17   1HG   MET   3          1HG       MET   3 -18.235   3.912 -17.119
   18   2HG   MET   3          2HG       MET   3 -19.181   4.983 -16.076
   19   1HE   MET   3          1HE       MET   3 -15.863   4.942 -18.548
   20   2HE   MET   3          2HE       MET   3 -15.367   5.281 -16.864
   21   3HE   MET   3          3HE       MET   3 -15.267   6.571 -18.097
   22    H    THR   4           H        THR   4 -17.071   2.241 -12.155
   23    HA   THR   4           HA       THR   4 -17.503   4.016  -9.904
   24    HB   THR   4           HB       THR   4 -15.550   1.706 -10.168
   25    HG1  THR   4           HG1      THR   4 -17.926   1.740  -8.719
   26   1HG2  THR   4          1HG2      THR   4 -16.024   1.632  -7.529
   27   2HG2  THR   4          2HG2      THR   4 -16.170   3.395  -7.706
   28   3HG2  THR   4          3HG2      THR   4 -14.658   2.571  -8.169
   29    H    ASP   5           H        ASP   5 -16.357   5.630  -9.032
   30    HA   ASP   5           HA       ASP   5 -13.995   6.806 -10.498
   31   1HB   ASP   5          1HB       ASP   5 -14.488   8.814  -9.562
   32   2HB   ASP   5          2HB       ASP   5 -14.718   8.154  -7.960
   33    H    GLN   6           H        GLN   6 -12.777   4.820 -10.023
   34    HA   GLN   6           HA       GLN   6 -11.656   4.449  -7.233
   35   1HB   GLN   6          1HB       GLN   6 -11.872   2.354  -8.211
   36   2HB   GLN   6          2HB       GLN   6 -11.512   2.926  -9.830
   37   1HG   GLN   6          1HG       GLN   6  -9.164   2.809  -9.533
   38   2HG   GLN   6          2HG       GLN   6  -9.247   2.962  -7.792
   39   1HE2  GLN   6          1HE2      GLN   6  -8.876  -0.726  -9.300
   40   2HE2  GLN   6          2HE2      GLN   6  -8.466   0.854 -10.136
   41    H    GLN   7           H        GLN   7 -10.465   5.252 -10.509
   42    HA   GLN   7           HA       GLN   7  -7.717   6.040  -9.635
   43   1HB   GLN   7          1HB       GLN   7  -8.402   5.182 -12.014
   44   2HB   GLN   7          2HB       GLN   7  -7.219   6.475 -11.870
   45   1HG   GLN   7          1HG       GLN   7  -9.270   8.126 -12.205
   46   2HG   GLN   7          2HG       GLN   7  -8.520   7.347 -13.589
   47   1HE2  GLN   7          1HE2      GLN   7 -12.463   6.758 -12.913
   48   2HE2  GLN   7          2HE2      GLN   7 -11.423   8.071 -12.163
   49    H    ALA   8           H        ALA   8 -10.804   7.631 -10.243
   50    HA   ALA   8           HA       ALA   8  -9.973  10.419 -10.306
   51   1HB   ALA   8          1HB       ALA   8 -12.346  10.951  -9.769
   52   2HB   ALA   8          2HB       ALA   8 -12.231   9.694 -11.016
   53   3HB   ALA   8          3HB       ALA   8 -12.664   9.252  -9.345
   54    H    GLU   9           H        GLU   9 -10.635   8.184  -7.657
   55    HA   GLU   9           HA       GLU   9 -10.833  10.090  -5.440
   56   1HB   GLU   9          1HB       GLU   9 -11.141   8.305  -4.063
   57   2HB   GLU   9          2HB       GLU   9 -11.379   7.451  -5.581
   58   1HG   GLU   9          1HG       GLU   9  -8.714   6.993  -5.428
   59   2HG   GLU   9          2HG       GLU   9  -9.892   5.964  -4.623
   60    H    ALA  10           H        ALA  10  -8.109   8.276  -6.827
   61    HA   ALA  10           HA       ALA  10  -6.103   9.220  -4.823
   62   1HB   ALA  10          1HB       ALA  10  -4.457   7.979  -6.219
   63   2HB   ALA  10          2HB       ALA  10  -5.878   6.981  -5.858
   64   3HB   ALA  10          3HB       ALA  10  -5.685   7.701  -7.477
   65    NH1  ARG  11           NH1      ARG  11  -7.554  15.528 -11.931
   66    NH2  ARG  11           NH2      ARG  11  -6.046  16.040 -13.551
   67    H    ARG  11           H        ARG  11  -7.240  10.174  -7.999
   68    HA   ARG  11           HA       ARG  11  -4.932  11.835  -8.874
   69   1HB   ARG  11          1HB       ARG  11  -6.724  10.818 -10.421
   70   2HB   ARG  11          2HB       ARG  11  -7.847  12.027  -9.817
   71   1HG   ARG  11          1HG       ARG  11  -6.470  13.888 -10.683
   72   2HG   ARG  11          2HG       ARG  11  -5.192  12.778 -11.186
   73   1HD   ARG  11          1HD       ARG  11  -6.580  11.762 -12.912
   74   2HD   ARG  11          2HD       ARG  11  -8.061  12.492 -12.287
   75    HE   ARG  11           HE       ARG  11  -6.611  13.708 -14.327
   76   1HH1  ARG  11          1HH1      ARG  11  -5.474  15.712 -14.337
   77   2HH1  ARG  11          2HH1      ARG  11  -6.116  17.001 -13.199
   78   1HH2  ARG  11          1HH2      ARG  11  -8.081  14.801 -11.435
   79   2HH2  ARG  11          2HH2      ARG  11  -7.572  16.537 -11.742
   80    H    ALA  12           H        ALA  12  -7.965  12.375  -7.139
   81    HA   ALA  12           HA       ALA  12  -7.867  15.349  -7.111
   82   1HB   ALA  12          1HB       ALA  12  -9.751  15.191  -5.497
   83   2HB   ALA  12          2HB       ALA  12 -10.026  14.154  -6.911
   84   3HB   ALA  12          3HB       ALA  12  -9.529  13.429  -5.361
   85    H    PHE  13           H        PHE  13  -6.724  12.728  -5.053
   86    HA   PHE  13           HA       PHE  13  -6.099  14.299  -2.654
   87   1HB   PHE  13          1HB       PHE  13  -4.960  11.586  -3.537
   88   2HB   PHE  13          2HB       PHE  13  -6.474  11.807  -2.699
   89    HD1  PHE  13           HD1      PHE  13  -6.390  11.438  -0.344
   90    HD2  PHE  13           HD2      PHE  13  -2.841  12.911  -2.285
   91    HE1  PHE  13           HE1      PHE  13  -5.151  11.282   1.777
   92    HE2  PHE  13           HE2      PHE  13  -1.621  12.747  -0.156
   93    HZ   PHE  13           HZ       PHE  13  -2.768  11.934   1.876
   94    H    LEU  14           H        LEU  14  -4.185  13.143  -5.428
   95    HA   LEU  14           HA       LEU  14  -1.684  14.616  -4.481
   96   1HB   LEU  14          1HB       LEU  14  -0.398  13.266  -5.953
   97   2HB   LEU  14          2HB       LEU  14  -1.764  12.852  -6.966
   98    HG   LEU  14           HG       LEU  14  -2.687  11.340  -5.199
   99   1HD1  LEU  14          1HD1      LEU  14  -0.949   9.555  -5.355
  100   2HD1  LEU  14          2HD1      LEU  14  -1.124  10.397  -6.906
  101   3HD1  LEU  14          3HD1      LEU  14   0.273  10.751  -5.859
  102   1HD2  LEU  14          1HD2      LEU  14  -0.171  12.060  -3.547
  103   2HD2  LEU  14          2HD2      LEU  14  -1.854  12.460  -3.123
  104   3HD2  LEU  14          3HD2      LEU  14  -1.335  10.768  -3.158
  105    H    SER  15           H        SER  15  -0.438  15.670  -6.282
  106    HA   SER  15           HA       SER  15  -2.284  17.333  -8.077
  107   1HB   SER  15          1HB       SER  15   0.501  18.265  -7.285
  108   2HB   SER  15          2HB       SER  15  -0.911  19.212  -7.758
  109    HG   SER  15           HG       SER  15  -1.873  18.739  -5.824
  110    H    GLU  16           H        GLU  16  -0.601  18.406  -9.819
  111    HA   GLU  16           HA       GLU  16   0.135  16.130 -11.632
  112   1HB   GLU  16          1HB       GLU  16  -1.165  18.135 -12.423
  113   2HB   GLU  16          2HB       GLU  16   0.246  19.146 -12.183
  114   1HG   GLU  16          1HG       GLU  16   1.465  17.469 -13.859
  115   2HG   GLU  16          2HG       GLU  16   0.388  18.707 -14.482
  116    H    GLU  17           H        GLU  17   1.681  18.716  -9.813
  117    HA   GLU  17           HA       GLU  17   4.432  18.246 -10.947
  118   1HB   GLU  17          1HB       GLU  17   4.475  20.441 -10.482
  119   2HB   GLU  17          2HB       GLU  17   4.967  19.922  -8.882
  120   1HG   GLU  17          1HG       GLU  17   2.270  21.022  -9.800
  121   2HG   GLU  17          2HG       GLU  17   2.288  19.948  -8.412
  122    H    MET  18           H        MET  18   2.540  17.506  -8.066
  123    HA   MET  18           HA       MET  18   4.675  16.183  -6.486
  124   1HB   MET  18          1HB       MET  18   2.529  15.028  -5.379
  125   2HB   MET  18          2HB       MET  18   1.638  16.230  -6.295
  126   1HG   MET  18          1HG       MET  18   3.923  17.050  -4.401
  127   2HG   MET  18          2HG       MET  18   2.676  18.089  -5.111
  128   1HE   MET  18          1HE       MET  18   3.766  16.436  -1.975
  129   2HE   MET  18          2HE       MET  18   2.367  15.540  -1.313
  130   3HE   MET  18          3HE       MET  18   3.243  14.900  -2.734
  131    H    ILE  19           H        ILE  19   2.380  15.221  -8.976
  132    HA   ILE  19           HA       ILE  19   2.580  12.319  -8.773
  133    HB   ILE  19           HB       ILE  19   1.496  14.228 -10.764
  134   1HG1  ILE  19          1HG1      ILE  19   0.379  11.427 -10.417
  135   2HG1  ILE  19          2HG1      ILE  19  -0.460  12.955 -10.576
  136   1HG2  ILE  19          1HG2      ILE  19   1.396  12.636 -12.699
  137   2HG2  ILE  19          2HG2      ILE  19   3.071  13.042 -12.332
  138   3HG2  ILE  19          3HG2      ILE  19   2.416  11.470 -11.822
  139   1HD1  ILE  19          1HD1      ILE  19  -0.017  13.583  -8.219
  140   2HD1  ILE  19          2HD1      ILE  19  -0.772  11.978  -8.308
  141   3HD1  ILE  19          3HD1      ILE  19   0.973  12.116  -7.989
  142    H    ALA  20           H        ALA  20   4.547  14.792 -10.354
  143    HA   ALA  20           HA       ALA  20   6.231  13.347 -12.117
  144   1HB   ALA  20          1HB       ALA  20   7.966  15.093 -11.731
  145   2HB   ALA  20          2HB       ALA  20   6.348  15.806 -11.879
  146   3HB   ALA  20          3HB       ALA  20   7.113  15.661 -10.276
  147    H    GLU  21           H        GLU  21   6.305  13.447  -8.599
  148    HA   GLU  21           HA       GLU  21   8.882  12.241  -8.048
  149   1HB   GLU  21          1HB       GLU  21   7.784  11.474  -5.843
  150   2HB   GLU  21          2HB       GLU  21   6.292  12.193  -6.416
  151   1HG   GLU  21          1HG       GLU  21   7.857  13.592  -4.831
  152   2HG   GLU  21          2HG       GLU  21   7.095  14.408  -6.185
  153    H    PHE  22           H        PHE  22   5.646  10.725  -8.237
  154    HA   PHE  22           HA       PHE  22   6.781   7.942  -8.376
  155   1HB   PHE  22          1HB       PHE  22   3.815   8.528  -8.797
  156   2HB   PHE  22          2HB       PHE  22   4.581   7.128  -8.098
  157    HD1  PHE  22           HD1      PHE  22   4.853   6.903  -5.725
  158    HD2  PHE  22           HD2      PHE  22   3.972  10.787  -7.360
  159    HE1  PHE  22           HE1      PHE  22   4.353   7.750  -3.471
  160    HE2  PHE  22           HE2      PHE  22   3.480  11.615  -5.095
  161    HZ   PHE  22           HZ       PHE  22   3.671  10.104  -3.149
  162    H    LYS  23           H        LYS  23   6.819  10.231 -10.607
  163    HA   LYS  23           HA       LYS  23   5.624   8.765 -12.984
  164   1HB   LYS  23          1HB       LYS  23   5.898  11.469 -12.501
  165   2HB   LYS  23          2HB       LYS  23   7.371  11.193 -13.404
  166   1HG   LYS  23          1HG       LYS  23   6.250  11.219 -15.370
  167   2HG   LYS  23          2HG       LYS  23   5.237   9.881 -14.855
  168   1HD   LYS  23          1HD       LYS  23   3.747  11.596 -13.600
  169   2HD   LYS  23          2HD       LYS  23   3.671  11.607 -15.366
  170   1HE   LYS  23          1HE       LYS  23   5.740  13.448 -14.920
  171   2HE   LYS  23          2HE       LYS  23   4.725  13.726 -13.498
  172   1HZ   LYS  23          1HZ       LYS  23   2.842  13.695 -15.349
  173   2HZ   LYS  23          2HZ       LYS  23   4.092  14.154 -16.326
  174   3HZ   LYS  23          3HZ       LYS  23   3.697  15.066 -15.007
  175    H    ALA  24           H        ALA  24   8.726   9.572 -11.500
  176    HA   ALA  24           HA       ALA  24  10.494   8.624 -13.651
  177   1HB   ALA  24          1HB       ALA  24  12.304   8.755 -11.951
  178   2HB   ALA  24          2HB       ALA  24  11.288  10.208 -11.922
  179   3HB   ALA  24          3HB       ALA  24  11.109   8.973 -10.649
  180    H    ALA  25           H        ALA  25   9.584   7.175 -10.502
  181    HA   ALA  25           HA       ALA  25  11.017   4.639 -10.819
  182   1HB   ALA  25          1HB       ALA  25   9.691   3.866  -8.861
  183   2HB   ALA  25          2HB       ALA  25  10.345   5.493  -8.594
  184   3HB   ALA  25          3HB       ALA  25   8.620   5.283  -8.988
  185    H    PHE  26           H        PHE  26   7.796   5.745 -11.698
  186    HA   PHE  26           HA       PHE  26   6.369   3.242 -12.053
  187   1HB   PHE  26          1HB       PHE  26   5.014   5.186 -12.154
  188   2HB   PHE  26          2HB       PHE  26   6.002   5.981 -13.350
  189    HD1  PHE  26           HD1      PHE  26   4.295   2.566 -13.186
  190    HD2  PHE  26           HD2      PHE  26   4.846   6.203 -15.417
  191    HE1  PHE  26           HE1      PHE  26   2.696   1.779 -14.884
  192    HE2  PHE  26           HE2      PHE  26   3.245   5.399 -17.105
  193    HZ   PHE  26           HZ       PHE  26   2.178   3.185 -16.849
  194    H    ASP  27           H        ASP  27   8.393   5.122 -14.301
  195    HA   ASP  27           HA       ASP  27   8.177   3.294 -16.611
  196   1HB   ASP  27          1HB       ASP  27   8.791   5.609 -17.039
  197   2HB   ASP  27          2HB       ASP  27  10.189   5.517 -15.992
  198    H    MET  28           H        MET  28  10.361   3.613 -13.859
  199    HA   MET  28           HA       MET  28  12.523   1.853 -14.493
  200   1HB   MET  28          1HB       MET  28  12.069   3.178 -12.251
  201   2HB   MET  28          2HB       MET  28  11.254   1.718 -11.720
  202   1HG   MET  28          1HG       MET  28  14.097   1.450 -12.814
  203   2HG   MET  28          2HG       MET  28  13.849   2.098 -11.184
  204   1HE   MET  28          1HE       MET  28  11.607   0.762  -9.703
  205   2HE   MET  28          2HE       MET  28  12.314  -0.778  -9.129
  206   3HE   MET  28          3HE       MET  28  13.291   0.720  -9.092
  207    H    PHE  29           H        PHE  29   9.258   1.071 -13.335
  208    HA   PHE  29           HA       PHE  29   9.625  -1.877 -13.191
  209   1HB   PHE  29          1HB       PHE  29   6.968  -0.338 -13.408
  210   2HB   PHE  29          2HB       PHE  29   7.155  -2.009 -12.950
  211    HD1  PHE  29           HD1      PHE  29   9.942  -0.398 -11.474
  212    HD2  PHE  29           HD2      PHE  29   5.674  -0.722 -11.008
  213    HE1  PHE  29           HE1      PHE  29  10.136   0.278  -9.116
  214    HE2  PHE  29           HE2      PHE  29   5.893  -0.050  -8.651
  215    HZ   PHE  29           HZ       PHE  29   8.115   0.466  -7.706
  216    H    ASP  30           H        ASP  30   8.322   0.448 -15.541
  217    HA   ASP  30           HA       ASP  30   7.322  -1.393 -17.562
  218   1HB   ASP  30          1HB       ASP  30   6.700   0.980 -17.638
  219   2HB   ASP  30          2HB       ASP  30   8.358   1.473 -17.892
  220    H    ALA  31           H        ALA  31   8.251  -2.243 -19.392
  221    HA   ALA  31           HA       ALA  31  11.261  -2.091 -19.794
  222   1HB   ALA  31          1HB       ALA  31  11.543  -4.569 -19.722
  223   2HB   ALA  31          2HB       ALA  31  11.003  -3.924 -18.160
  224   3HB   ALA  31          3HB       ALA  31   9.850  -4.778 -19.217
  225    H    ASP  32           H        ASP  32   8.723  -1.334 -21.201
  226    HA   ASP  32           HA       ASP  32   9.175  -2.801 -23.850
  227   1HB   ASP  32          1HB       ASP  32   7.025  -3.486 -23.726
  228   2HB   ASP  32          2HB       ASP  32   6.650  -1.863 -24.257
  229    H    GLY  33           H        GLY  33   7.647   0.186 -22.579
  230   1HA   GLY  33          1HA       GLY  33   9.546   2.026 -24.014
  231   2HA   GLY  33          2HA       GLY  33   7.981   1.922 -24.787
  232    H    GLY  34           H        GLY  34   6.074   2.211 -23.208
  233   1HA   GLY  34          1HA       GLY  34   6.457   4.724 -21.577
  234   2HA   GLY  34          2HA       GLY  34   5.980   3.317 -20.617
  235    H    GLY  35           H        GLY  35   3.957   3.841 -20.088
  236   1HA   GLY  35          1HA       GLY  35   1.750   5.108 -21.193
  237   2HA   GLY  35          2HA       GLY  35   1.842   3.705 -22.266
  238    H    ASP  36           H        ASP  36   2.533   1.652 -20.701
  239    HA   ASP  36           HA       ASP  36   0.888   1.493 -18.185
  240   1HB   ASP  36          1HB       ASP  36  -0.980   1.042 -19.533
  241   2HB   ASP  36          2HB       ASP  36  -0.431  -0.539 -19.027
  242    H    ILE  37           H        ILE  37   0.871  -1.043 -17.619
  243    HA   ILE  37           HA       ILE  37   3.635  -2.243 -18.140
  244    HB   ILE  37           HB       ILE  37   2.641  -2.850 -15.438
  245   1HG1  ILE  37          1HG1      ILE  37   2.859   0.052 -16.126
  246   2HG1  ILE  37          2HG1      ILE  37   2.054  -0.738 -14.784
  247   1HG2  ILE  37          1HG2      ILE  37   5.025  -2.657 -14.845
  248   2HG2  ILE  37          2HG2      ILE  37   4.855  -3.578 -16.346
  249   3HG2  ILE  37          3HG2      ILE  37   5.398  -1.884 -16.404
  250   1HD1  ILE  37          1HD1      ILE  37   5.065  -0.105 -14.881
  251   2HD1  ILE  37          2HD1      ILE  37   3.821   0.687 -13.890
  252   3HD1  ILE  37          3HD1      ILE  37   4.259  -1.007 -13.569
  253    H    SER  38           H        SER  38   3.266  -4.502 -16.533
  254    HA   SER  38           HA       SER  38   0.771  -5.948 -17.443
  255   1HB   SER  38          1HB       SER  38   1.696  -7.387 -19.027
  256   2HB   SER  38          2HB       SER  38   2.502  -5.864 -19.409
  257    HG   SER  38           HG       SER  38   4.167  -6.679 -17.854
  258    H    THR  39           H        THR  39   1.493  -8.490 -17.085
  259    HA   THR  39           HA       THR  39   1.964  -8.712 -14.123
  260    HB   THR  39           HB       THR  39   1.699 -11.335 -14.958
  261    HG1  THR  39           HG1      THR  39   1.306 -10.727 -17.054
  262   1HG2  THR  39          1HG2      THR  39  -0.630 -11.253 -14.182
  263   2HG2  THR  39          2HG2      THR  39   0.362 -10.234 -13.113
  264   3HG2  THR  39          3HG2      THR  39  -0.687  -9.483 -14.344
  265    H    LYS  40           H        LYS  40   3.538  -9.561 -17.172
  266    HA   LYS  40           HA       LYS  40   5.757 -11.126 -16.075
  267   1HB   LYS  40          1HB       LYS  40   4.862 -10.963 -18.514
  268   2HB   LYS  40          2HB       LYS  40   5.886  -9.567 -18.723
  269   1HG   LYS  40          1HG       LYS  40   7.410 -11.809 -17.540
  270   2HG   LYS  40          2HG       LYS  40   6.472 -12.411 -18.881
  271   1HD   LYS  40          1HD       LYS  40   8.369 -10.004 -19.245
  272   2HD   LYS  40          2HD       LYS  40   8.924 -11.653 -19.246
  273   1HE   LYS  40          1HE       LYS  40   8.687 -11.389 -21.506
  274   2HE   LYS  40          2HE       LYS  40   7.123 -12.107 -21.148
  275   1HZ   LYS  40          1HZ       LYS  40   7.176 -10.046 -22.608
  276   2HZ   LYS  40          2HZ       LYS  40   7.501  -9.156 -21.255
  277   3HZ   LYS  40          3HZ       LYS  40   6.086 -10.000 -21.369
  278    H    GLU  41           H        GLU  41   5.635  -7.768 -17.328
  279    HA   GLU  41           HA       GLU  41   8.253  -6.843 -16.625
  280   1HB   GLU  41          1HB       GLU  41   7.565  -4.640 -16.964
  281   2HB   GLU  41          2HB       GLU  41   5.954  -4.907 -16.335
  282   1HG   GLU  41          1HG       GLU  41   7.015  -5.761 -19.094
  283   2HG   GLU  41          2HG       GLU  41   5.500  -6.358 -18.451
  284    H    LEU  42           H        LEU  42   5.263  -6.765 -14.684
  285    HA   LEU  42           HA       LEU  42   6.332  -5.384 -12.331
  286   1HB   LEU  42          1HB       LEU  42   4.082  -7.419 -12.058
  287   2HB   LEU  42          2HB       LEU  42   3.812  -6.014 -13.066
  288    HG   LEU  42           HG       LEU  42   3.878  -4.486 -11.256
  289   1HD1  LEU  42          1HD1      LEU  42   5.217  -6.566  -9.417
  290   2HD1  LEU  42          2HD1      LEU  42   6.109  -5.330 -10.317
  291   3HD1  LEU  42          3HD1      LEU  42   4.935  -4.841  -9.070
  292   1HD2  LEU  42          1HD2      LEU  42   2.321  -5.332  -9.535
  293   2HD2  LEU  42          2HD2      LEU  42   1.874  -6.070 -11.093
  294   3HD2  LEU  42          3HD2      LEU  42   2.763  -7.022  -9.891
  295    H    GLY  43           H        GLY  43   6.178  -8.764 -13.323
  296   1HA   GLY  43          1HA       GLY  43   7.105 -10.806 -12.396
  297   2HA   GLY  43          2HA       GLY  43   6.957 -10.039 -10.809
  298    H    THR  44           H        THR  44   8.785  -8.595 -13.431
  299    HA   THR  44           HA       THR  44  11.412  -9.758 -12.813
  300    HB   THR  44           HB       THR  44  10.800  -7.209 -14.397
  301    HG1  THR  44           HG1      THR  44  10.824  -8.506 -16.115
  302   1HG2  THR  44          1HG2      THR  44  13.013  -7.570 -15.504
  303   2HG2  THR  44          2HG2      THR  44  13.210  -7.221 -13.774
  304   3HG2  THR  44          3HG2      THR  44  13.380  -8.893 -14.368
  305    H    VAL  45           H        VAL  45   9.995  -6.542 -12.180
  306    HA   VAL  45           HA       VAL  45  12.231  -5.424 -10.637
  307    HB   VAL  45           HB       VAL  45   9.511  -4.549 -11.340
  308   1HG1  VAL  45          1HG1      VAL  45  11.974  -2.851 -10.595
  309   2HG1  VAL  45          2HG1      VAL  45  11.736  -3.567 -12.194
  310   3HG1  VAL  45          3HG1      VAL  45  10.574  -2.365 -11.587
  311   1HG2  VAL  45          1HG2      VAL  45   9.038  -3.005  -9.510
  312   2HG2  VAL  45          2HG2      VAL  45   9.228  -4.612  -8.771
  313   3HG2  VAL  45          3HG2      VAL  45  10.543  -3.435  -8.655
  314    H    MET  46           H        MET  46   9.388  -7.366  -9.856
  315    HA   MET  46           HA       MET  46   9.464  -7.187  -6.932
  316   1HB   MET  46          1HB       MET  46   8.101  -9.029  -8.903
  317   2HB   MET  46          2HB       MET  46   8.328  -9.652  -7.279
  318   1HG   MET  46          1HG       MET  46   7.248  -6.897  -7.147
  319   2HG   MET  46          2HG       MET  46   6.237  -7.931  -8.171
  320   1HE   MET  46          1HE       MET  46   4.987  -6.748  -5.543
  321   2HE   MET  46          2HE       MET  46   5.249  -7.662  -4.028
  322   3HE   MET  46          3HE       MET  46   6.564  -6.653  -4.698
  323    NH1  ARG  47           NH1      ARG  47  17.774 -11.313 -11.446
  324    NH2  ARG  47           NH2      ARG  47  17.210 -13.387 -12.184
  325    H    ARG  47           H        ARG  47  11.049  -9.256  -9.308
  326    HA   ARG  47           HA       ARG  47  12.138 -11.330  -7.561
  327   1HB   ARG  47          1HB       ARG  47  12.943 -12.209  -9.470
  328   2HB   ARG  47          2HB       ARG  47  12.134 -10.885 -10.298
  329   1HG   ARG  47          1HG       ARG  47  14.395  -9.527  -9.850
  330   2HG   ARG  47          2HG       ARG  47  14.245 -10.639 -11.211
  331   1HD   ARG  47          1HD       ARG  47  16.323 -10.731  -9.351
  332   2HD   ARG  47          2HD       ARG  47  15.217 -11.895  -8.640
  333    HE   ARG  47           HE       ARG  47  15.376 -13.334 -10.640
  334   1HH1  ARG  47          1HH1      ARG  47  17.560 -10.530 -10.817
  335   2HH1  ARG  47          2HH1      ARG  47  18.549 -11.368 -12.116
  336   1HH2  ARG  47          1HH2      ARG  47  16.570 -14.186 -12.122
  337   2HH2  ARG  47          2HH2      ARG  47  18.024 -13.297 -12.803
  338    H    MET  48           H        MET  48  13.256  -8.119  -8.491
  339    HA   MET  48           HA       MET  48  16.034  -8.229  -7.540
  340   1HB   MET  48          1HB       MET  48  16.208  -6.048  -8.132
  341   2HB   MET  48          2HB       MET  48  14.657  -6.318  -8.905
  342   1HG   MET  48          1HG       MET  48  13.867  -4.542  -7.714
  343   2HG   MET  48          2HG       MET  48  13.898  -5.576  -6.275
  344   1HE   MET  48          1HE       MET  48  14.827  -2.210  -7.457
  345   2HE   MET  48          2HE       MET  48  16.573  -1.974  -7.153
  346   3HE   MET  48          3HE       MET  48  16.037  -3.011  -8.507
  347    H    LEU  49           H        LEU  49  12.932  -7.679  -5.971
  348    HA   LEU  49           HA       LEU  49  13.605  -6.459  -3.484
  349   1HB   LEU  49          1HB       LEU  49  11.618  -8.780  -3.524
  350   2HB   LEU  49          2HB       LEU  49  11.269  -7.332  -4.442
  351    HG   LEU  49           HG       LEU  49  10.124  -7.185  -2.301
  352   1HD1  LEU  49          1HD1      LEU  49  11.291  -7.254  -0.095
  353   2HD1  LEU  49          2HD1      LEU  49  11.530  -8.773  -0.977
  354   3HD1  LEU  49          3HD1      LEU  49  12.848  -7.578  -0.898
  355   1HD2  LEU  49          1HD2      LEU  49  12.549  -5.263  -2.241
  356   2HD2  LEU  49          2HD2      LEU  49  11.012  -4.986  -3.097
  357   3HD2  LEU  49          3HD2      LEU  49  11.033  -5.051  -1.329
  358    H    GLY  50           H        GLY  50  13.562  -9.959  -4.222
  359   1HA   GLY  50          1HA       GLY  50  16.010 -10.699  -2.788
  360   2HA   GLY  50          2HA       GLY  50  14.662 -10.863  -1.654
  361    H    GLN  51           H        GLN  51  12.657 -11.949  -2.709
  362    HA   GLN  51           HA       GLN  51  13.461 -14.726  -3.568
  363   1HB   GLN  51          1HB       GLN  51  11.291 -13.643  -2.078
  364   2HB   GLN  51          2HB       GLN  51  10.561 -14.190  -3.576
  365   1HG   GLN  51          1HG       GLN  51  12.439 -16.058  -2.041
  366   2HG   GLN  51          2HG       GLN  51  11.232 -16.483  -3.235
  367   1HE2  GLN  51          1HE2      GLN  51   8.668 -15.461  -0.458
  368   2HE2  GLN  51          2HE2      GLN  51   9.189 -14.627  -2.007
  369    H    ASN  52           H        ASN  52  11.344 -15.408  -5.193
  370    HA   ASN  52           HA       ASN  52  11.245 -13.508  -7.530
  371   1HB   ASN  52          1HB       ASN  52  13.261 -15.279  -7.640
  372   2HB   ASN  52          2HB       ASN  52  12.027 -16.384  -8.205
  373   1HD2  ASN  52          1HD2      ASN  52  13.687 -14.509 -11.109
  374   2HD2  ASN  52          2HD2      ASN  52  14.242 -15.581  -9.727
  375    HA   PRO  53           HA       PRO  53   6.911 -15.413  -6.681
  376   1HB   PRO  53          1HB       PRO  53   6.316 -13.253  -8.751
  377   2HB   PRO  53          2HB       PRO  53   5.476 -13.704  -7.260
  378   1HG   PRO  53          1HG       PRO  53   7.110 -11.510  -7.360
  379   2HG   PRO  53          2HG       PRO  53   6.887 -12.429  -5.853
  380   1HD   PRO  53          1HD       PRO  53   9.245 -12.762  -6.025
  381   2HD   PRO  53          2HD       PRO  53   9.259 -12.380  -7.773
  382    H    THR  54           H        THR  54   5.435 -16.450  -8.202
  383    HA   THR  54           HA       THR  54   6.861 -17.603 -10.650
  384    HB   THR  54           HB       THR  54   5.874 -19.058  -8.569
  385    HG1  THR  54           HG1      THR  54   7.023 -19.505 -10.693
  386   1HG2  THR  54          1HG2      THR  54   3.824 -20.266  -9.245
  387   2HG2  THR  54          2HG2      THR  54   3.456 -18.541  -9.016
  388   3HG2  THR  54          3HG2      THR  54   3.614 -19.208 -10.661
  389    H    LYS  55           H        LYS  55   5.460 -18.107 -12.481
  390    HA   LYS  55           HA       LYS  55   4.179 -15.735 -13.508
  391   1HB   LYS  55          1HB       LYS  55   5.196 -17.676 -14.864
  392   2HB   LYS  55          2HB       LYS  55   3.757 -16.922 -15.516
  393   1HG   LYS  55          1HG       LYS  55   3.828 -19.414 -15.758
  394   2HG   LYS  55          2HG       LYS  55   3.787 -19.610 -14.015
  395   1HD   LYS  55          1HD       LYS  55   1.518 -17.901 -14.784
  396   2HD   LYS  55          2HD       LYS  55   1.576 -19.266 -15.888
  397   1HE   LYS  55          1HE       LYS  55   1.458 -19.470 -12.823
  398   2HE   LYS  55          2HE       LYS  55   0.112 -19.761 -13.922
  399   1HZ   LYS  55          1HZ       LYS  55   1.509 -21.614 -14.884
  400   2HZ   LYS  55          2HZ       LYS  55   1.054 -21.848 -13.313
  401   3HZ   LYS  55          3HZ       LYS  55   2.599 -21.383 -13.665
  402    H    GLU  56           H        GLU  56   2.898 -18.535 -11.807
  403    HA   GLU  56           HA       GLU  56   0.034 -18.070 -12.372
  404   1HB   GLU  56          1HB       GLU  56   1.454 -20.216 -11.417
  405   2HB   GLU  56          2HB       GLU  56   0.771 -19.634  -9.911
  406   1HG   GLU  56          1HG       GLU  56  -0.600 -20.900 -12.291
  407   2HG   GLU  56          2HG       GLU  56  -1.507 -19.614 -11.514
  408    H    GLU  57           H        GLU  57   2.262 -17.272  -9.729
  409    HA   GLU  57           HA       GLU  57   0.289 -16.233  -7.806
  410   1HB   GLU  57          1HB       GLU  57   3.247 -15.477  -7.902
  411   2HB   GLU  57          2HB       GLU  57   2.657 -16.998  -7.270
  412   1HG   GLU  57          1HG       GLU  57   2.890 -15.756  -5.293
  413   2HG   GLU  57          2HG       GLU  57   2.486 -14.220  -6.051
  414    H    LEU  58           H        LEU  58   2.104 -14.836 -10.480
  415    HA   LEU  58           HA       LEU  58   1.735 -11.995  -9.834
  416   1HB   LEU  58          1HB       LEU  58   2.679 -13.564 -12.249
  417   2HB   LEU  58          2HB       LEU  58   2.186 -11.904 -12.512
  418    HG   LEU  58           HG       LEU  58   4.274 -12.731 -10.396
  419   1HD1  LEU  58          1HD1      LEU  58   6.034 -11.913 -12.011
  420   2HD1  LEU  58          2HD1      LEU  58   5.190 -13.332 -12.647
  421   3HD1  LEU  58          3HD1      LEU  58   4.795 -11.714 -13.276
  422   1HD2  LEU  58          1HD2      LEU  58   3.619  -9.962 -11.598
  423   2HD2  LEU  58          2HD2      LEU  58   3.194 -10.520  -9.961
  424   3HD2  LEU  58          3HD2      LEU  58   4.897 -10.313 -10.408
  425    H    ASP  59           H        ASP  59  -0.046 -14.375 -11.750
  426    HA   ASP  59           HA       ASP  59  -2.053 -12.608 -12.970
  427   1HB   ASP  59          1HB       ASP  59  -2.276 -15.614 -12.368
  428   2HB   ASP  59          2HB       ASP  59  -1.612 -14.907 -13.823
  429    H    ALA  60           H        ALA  60  -1.761 -14.246  -9.869
  430    HA   ALA  60           HA       ALA  60  -4.494 -13.704  -8.868
  431   1HB   ALA  60          1HB       ALA  60  -3.603 -14.449  -6.666
  432   2HB   ALA  60          2HB       ALA  60  -3.141 -15.568  -7.963
  433   3HB   ALA  60          3HB       ALA  60  -1.939 -14.433  -7.297
  434    H    ILE  61           H        ILE  61  -1.412 -12.013  -8.823
  435    HA   ILE  61           HA       ILE  61  -2.008 -10.059  -6.693
  436    HB   ILE  61           HB       ILE  61   0.208 -10.450  -8.665
  437   1HG1  ILE  61          1HG1      ILE  61   1.279 -11.034  -6.749
  438   2HG1  ILE  61          2HG1      ILE  61  -0.160 -10.674  -5.821
  439   1HG2  ILE  61          1HG2      ILE  61   1.215  -8.176  -8.313
  440   2HG2  ILE  61          2HG2      ILE  61  -0.321  -8.048  -9.168
  441   3HG2  ILE  61          3HG2      ILE  61  -0.243  -7.646  -7.437
  442   1HD1  ILE  61          1HD1      ILE  61   0.549  -8.334  -5.404
  443   2HD1  ILE  61          2HD1      ILE  61   1.823  -9.473  -4.921
  444   3HD1  ILE  61          3HD1      ILE  61   1.985  -8.561  -6.440
  445    H    ILE  62           H        ILE  62  -2.222 -10.060 -10.243
  446    HA   ILE  62           HA       ILE  62  -3.142  -7.237 -10.491
  447    HB   ILE  62           HB       ILE  62  -2.951  -9.523 -12.501
  448   1HG1  ILE  62          1HG1      ILE  62  -0.766  -8.597 -12.086
  449   2HG1  ILE  62          2HG1      ILE  62  -1.361  -6.953 -11.991
  450   1HG2  ILE  62          1HG2      ILE  62  -3.653  -7.948 -14.326
  451   2HG2  ILE  62          2HG2      ILE  62  -4.969  -8.177 -13.176
  452   3HG2  ILE  62          3HG2      ILE  62  -4.007  -6.682 -13.124
  453   1HD1  ILE  62          1HD1      ILE  62  -1.744  -6.821 -14.438
  454   2HD1  ILE  62          2HD1      ILE  62  -0.081  -7.338 -14.091
  455   3HD1  ILE  62          3HD1      ILE  62  -1.283  -8.536 -14.626
  456    H    GLU  63           H        GLU  63  -4.587 -10.458 -10.338
  457    HA   GLU  63           HA       GLU  63  -7.373  -9.794 -10.967
  458   1HB   GLU  63          1HB       GLU  63  -6.429 -12.127 -10.906
  459   2HB   GLU  63          2HB       GLU  63  -6.372 -12.058  -9.156
  460   1HG   GLU  63          1HG       GLU  63  -8.431 -13.071  -9.287
  461   2HG   GLU  63          2HG       GLU  63  -9.039 -11.441  -9.521
  462    H    GLU  64           H        GLU  64  -5.390  -9.601  -8.061
  463    HA   GLU  64           HA       GLU  64  -7.449  -9.302  -6.021
  464   1HB   GLU  64          1HB       GLU  64  -4.675  -9.467  -6.004
  465   2HB   GLU  64          2HB       GLU  64  -5.721  -9.277  -4.610
  466   1HG   GLU  64          1HG       GLU  64  -5.456  -6.649  -5.087
  467   2HG   GLU  64          2HG       GLU  64  -4.088  -7.135  -6.073
  468    H    VAL  65           H        VAL  65  -5.650  -6.926  -7.975
  469    HA   VAL  65           HA       VAL  65  -7.613  -4.716  -7.145
  470    HB   VAL  65           HB       VAL  65  -5.539  -4.162  -6.114
  471   1HG1  VAL  65          1HG1      VAL  65  -5.634  -2.397  -8.644
  472   2HG1  VAL  65          2HG1      VAL  65  -6.798  -2.271  -7.312
  473   3HG1  VAL  65          3HG1      VAL  65  -5.076  -1.935  -7.017
  474   1HG2  VAL  65          1HG2      VAL  65  -3.333  -4.014  -7.160
  475   2HG2  VAL  65          2HG2      VAL  65  -3.987  -5.612  -7.592
  476   3HG2  VAL  65          3HG2      VAL  65  -3.998  -4.307  -8.786
  477    H    ASP  66           H        ASP  66  -8.993  -4.927  -8.831
  478    HA   ASP  66           HA       ASP  66  -8.251  -3.829 -11.472
  479   1HB   ASP  66          1HB       ASP  66  -8.092  -6.760 -11.232
  480   2HB   ASP  66          2HB       ASP  66  -9.327  -6.309 -12.385
  481    H    GLU  67           H        GLU  67  -9.896  -2.627 -10.148
  482    HA   GLU  67           HA       GLU  67 -12.751  -3.553 -10.182
  483   1HB   GLU  67          1HB       GLU  67 -11.428  -0.905  -9.438
  484   2HB   GLU  67          2HB       GLU  67 -13.169  -1.031  -9.598
  485   1HG   GLU  67          1HG       GLU  67 -12.604  -3.208  -7.903
  486   2HG   GLU  67          2HG       GLU  67 -11.355  -2.066  -7.438
  487    H    ASP  68           H        ASP  68 -10.547  -1.639 -12.147
  488    HA   ASP  68           HA       ASP  68 -12.631  -0.714 -14.097
  489   1HB   ASP  68          1HB       ASP  68 -10.498  -0.041 -15.496
  490   2HB   ASP  68          2HB       ASP  68 -10.988   0.886 -14.097
  491    H    GLY  69           H        GLY  69 -10.252  -3.295 -13.794
  492   1HA   GLY  69          1HA       GLY  69 -11.693  -5.155 -15.588
  493   2HA   GLY  69          2HA       GLY  69 -10.080  -5.427 -14.915
  494    H    SER  70           H        SER  70  -8.366  -5.252 -16.159
  495    HA   SER  70           HA       SER  70  -8.626  -4.506 -19.086
  496   1HB   SER  70          1HB       SER  70  -8.194  -2.314 -18.292
  497   2HB   SER  70          2HB       SER  70  -6.642  -2.892 -18.904
  498    HG   SER  70           HG       SER  70  -7.513  -2.484 -16.282
  499    H    GLY  71           H        GLY  71  -6.441  -5.361 -16.389
  500   1HA   GLY  71          1HA       GLY  71  -5.259  -7.637 -16.416
  501   2HA   GLY  71          2HA       GLY  71  -5.074  -7.450 -18.166
  502    H    THR  72           H        THR  72  -4.396  -4.623 -18.025
  503    HA   THR  72           HA       THR  72  -1.473  -4.840 -17.199
  504    HB   THR  72           HB       THR  72  -1.138  -2.716 -18.529
  505    HG1  THR  72           HG1      THR  72  -3.592  -3.275 -19.751
  506   1HG2  THR  72          1HG2      THR  72  -1.182  -3.723 -20.775
  507   2HG2  THR  72          2HG2      THR  72  -0.589  -4.932 -19.614
  508   3HG2  THR  72          3HG2      THR  72  -2.255  -5.036 -20.240
  509    H    ILE  73           H        ILE  73  -0.516  -3.232 -15.929
  510    HA   ILE  73           HA       ILE  73  -2.391  -1.781 -14.002
  511    HB   ILE  73           HB       ILE  73   0.567  -2.476 -13.627
  512   1HG1  ILE  73          1HG1      ILE  73  -1.976  -3.985 -12.902
  513   2HG1  ILE  73          2HG1      ILE  73  -0.438  -4.600 -13.467
  514   1HG2  ILE  73          1HG2      ILE  73   0.288  -1.764 -11.256
  515   2HG2  ILE  73          2HG2      ILE  73  -0.138  -0.423 -12.329
  516   3HG2  ILE  73          3HG2      ILE  73  -1.423  -1.360 -11.528
  517   1HD1  ILE  73          1HD1      ILE  73  -0.953  -3.621 -10.598
  518   2HD1  ILE  73          2HD1      ILE  73  -0.739  -5.295 -11.152
  519   3HD1  ILE  73          3HD1      ILE  73   0.629  -4.160 -11.224
  520    H    ASP  74           H        ASP  74  -2.818  -0.180 -15.607
  521    HA   ASP  74           HA       ASP  74  -0.820   1.551 -16.851
  522   1HB   ASP  74          1HB       ASP  74  -2.708   2.035 -17.985
  523   2HB   ASP  74          2HB       ASP  74  -2.965   3.246 -16.751
  524    H    PHE  75           H        PHE  75  -1.115   4.076 -16.314
  525    HA   PHE  75           HA       PHE  75   0.179   4.554 -13.692
  526   1HB   PHE  75          1HB       PHE  75   0.547   5.876 -15.910
  527   2HB   PHE  75          2HB       PHE  75  -0.942   6.715 -15.566
  528    HD1  PHE  75           HD1      PHE  75   0.767   5.868 -12.475
  529    HD2  PHE  75           HD2      PHE  75   0.738   8.743 -15.677
  530    HE1  PHE  75           HE1      PHE  75   1.930   7.494 -11.040
  531    HE2  PHE  75           HE2      PHE  75   1.907  10.354 -14.226
  532    HZ   PHE  75           HZ       PHE  75   2.475   9.746 -11.902
  533    H    GLU  76           H        GLU  76  -3.061   4.843 -15.024
  534    HA   GLU  76           HA       GLU  76  -4.285   6.569 -13.007
  535   1HB   GLU  76          1HB       GLU  76  -6.488   5.358 -13.844
  536   2HB   GLU  76          2HB       GLU  76  -5.440   4.662 -15.061
  537   1HG   GLU  76          1HG       GLU  76  -6.462   7.477 -14.809
  538   2HG   GLU  76          2HG       GLU  76  -4.782   7.366 -15.291
  539    H    GLU  77           H        GLU  77  -4.015   3.042 -13.310
  540    HA   GLU  77           HA       GLU  77  -5.513   2.497 -10.755
  541   1HB   GLU  77          1HB       GLU  77  -6.020   0.818 -12.231
  542   2HB   GLU  77          2HB       GLU  77  -4.445   0.811 -12.991
  543   1HG   GLU  77          1HG       GLU  77  -3.457  -0.458 -11.078
  544   2HG   GLU  77          2HG       GLU  77  -4.967  -0.351 -10.180
  545    H    PHE  78           H        PHE  78  -2.201   2.668 -11.892
  546    HA   PHE  78           HA       PHE  78  -0.804   1.306  -9.745
  547   1HB   PHE  78          1HB       PHE  78   0.195   3.714 -11.391
  548   2HB   PHE  78          2HB       PHE  78   0.263   2.053 -11.924
  549    HD1  PHE  78           HD1      PHE  78   1.734   4.588  -9.630
  550    HD2  PHE  78           HD2      PHE  78   1.916   0.465 -10.845
  551    HE1  PHE  78           HE1      PHE  78   3.978   4.382  -8.637
  552    HE2  PHE  78           HE2      PHE  78   4.153   0.275  -9.837
  553    HZ   PHE  78           HZ       PHE  78   5.186   2.228  -8.730
  554    H    LEU  79           H        LEU  79  -1.556   4.776 -10.157
  555    HA   LEU  79           HA       LEU  79  -0.451   5.751  -7.652
  556   1HB   LEU  79          1HB       LEU  79  -2.740   6.913  -9.346
  557   2HB   LEU  79          2HB       LEU  79  -2.053   7.734  -7.961
  558    HG   LEU  79           HG       LEU  79  -0.254   6.890 -10.298
  559   1HD1  LEU  79          1HD1      LEU  79   0.023   9.218  -8.295
  560   2HD1  LEU  79          2HD1      LEU  79   0.807   7.638  -8.104
  561   3HD1  LEU  79          3HD1      LEU  79   1.235   8.678  -9.485
  562   1HD2  LEU  79          1HD2      LEU  79  -0.602   9.051 -11.416
  563   2HD2  LEU  79          2HD2      LEU  79  -2.207   8.311 -11.197
  564   3HD2  LEU  79          3HD2      LEU  79  -1.688   9.617 -10.122
  565    H    VAL  80           H        VAL  80  -3.583   4.365  -8.483
  566    HA   VAL  80           HA       VAL  80  -5.031   4.949  -6.000
  567    HB   VAL  80           HB       VAL  80  -5.604   2.498  -7.723
  568   1HG1  VAL  80          1HG1      VAL  80  -6.672   5.321  -8.346
  569   2HG1  VAL  80          2HG1      VAL  80  -5.311   4.592  -9.210
  570   3HG1  VAL  80          3HG1      VAL  80  -6.914   3.826  -9.287
  571   1HG2  VAL  80          1HG2      VAL  80  -7.946   2.811  -7.071
  572   2HG2  VAL  80          2HG2      VAL  80  -6.983   2.829  -5.575
  573   3HG2  VAL  80          3HG2      VAL  80  -7.584   4.350  -6.251
  574    H    MET  81           H        MET  81  -2.928   2.305  -7.076
  575    HA   MET  81           HA       MET  81  -3.205   0.426  -4.862
  576   1HB   MET  81          1HB       MET  81  -0.482   0.790  -6.161
  577   2HB   MET  81          2HB       MET  81  -1.823   0.286  -7.174
  578   1HG   MET  81          1HG       MET  81  -2.019  -1.830  -6.159
  579   2HG   MET  81          2HG       MET  81  -1.415  -1.268  -4.591
  580   1HE   MET  81          1HE       MET  81  -0.424  -3.969  -5.671
  581   2HE   MET  81          2HE       MET  81   1.361  -3.883  -5.590
  582   3HE   MET  81          3HE       MET  81   0.378  -3.259  -4.234
  583    H    MET  82           H        MET  82  -0.486   2.684  -5.397
  584    HA   MET  82           HA       MET  82   0.710   2.491  -2.794
  585   1HB   MET  82          1HB       MET  82   0.803   5.022  -4.529
  586   2HB   MET  82          2HB       MET  82   1.964   4.523  -3.313
  587   1HG   MET  82          1HG       MET  82   1.684   3.622  -6.171
  588   2HG   MET  82          2HG       MET  82   3.133   3.861  -5.187
  589   1HE   MET  82          1HE       MET  82   4.055   2.403  -3.465
  590   2HE   MET  82          2HE       MET  82   3.884   0.622  -3.442
  591   3HE   MET  82          3HE       MET  82   2.739   1.639  -2.518
  592    H    VAL  83           H        VAL  83  -2.015   4.404  -3.899
  593    HA   VAL  83           HA       VAL  83  -2.095   6.418  -1.769
  594    HB   VAL  83           HB       VAL  83  -3.772   5.729  -4.070
  595   1HG1  VAL  83          1HG1      VAL  83  -3.605   8.395  -2.532
  596   2HG1  VAL  83          2HG1      VAL  83  -2.386   7.877  -3.706
  597   3HG1  VAL  83          3HG1      VAL  83  -4.063   8.143  -4.237
  598   1HG2  VAL  83          1HG2      VAL  83  -5.965   6.509  -3.331
  599   2HG2  VAL  83          2HG2      VAL  83  -5.504   5.193  -2.226
  600   3HG2  VAL  83          3HG2      VAL  83  -5.368   6.875  -1.691
  601    NH1  ARG  84           NH1      ARG  84  -9.107  -0.590  -3.555
  602    NH2  ARG  84           NH2      ARG  84  -8.270  -2.668  -3.181
  603    H    ARG  84           H        ARG  84  -3.616   3.237  -2.216
  604    HA   ARG  84           HA       ARG  84  -5.421   3.223   0.094
  605   1HB   ARG  84          1HB       ARG  84  -4.216   1.041  -1.661
  606   2HB   ARG  84          2HB       ARG  84  -4.975   0.583  -0.144
  607   1HG   ARG  84          1HG       ARG  84  -6.602   2.466  -1.850
  608   2HG   ARG  84          2HG       ARG  84  -7.133   1.122  -0.836
  609   1HD   ARG  84          1HD       ARG  84  -5.463   0.363  -3.248
  610   2HD   ARG  84          2HD       ARG  84  -7.067   1.006  -3.604
  611    HE   ARG  84           HE       ARG  84  -6.666  -1.385  -1.721
  612   1HH1  ARG  84          1HH1      ARG  84  -7.496  -3.239  -2.824
  613   2HH1  ARG  84          2HH1      ARG  84  -9.144  -3.007  -3.599
  614   1HH2  ARG  84          1HH2      ARG  84  -8.951   0.424  -3.531
  615   2HH2  ARG  84          2HH2      ARG  84  -9.940  -1.076  -3.906
  616    H    GLN  85           H        GLN  85  -2.020   2.323  -0.339
  617    HA   GLN  85           HA       GLN  85  -1.566   1.269   2.399
  618   1HB   GLN  85          1HB       GLN  85   0.929   1.630   1.757
  619   2HB   GLN  85          2HB       GLN  85   0.352   2.168   0.191
  620   1HG   GLN  85          1HG       GLN  85  -1.009  -0.279   0.494
  621   2HG   GLN  85          2HG       GLN  85   0.405   0.013  -0.495
  622   1HE2  GLN  85          1HE2      GLN  85   2.598  -1.295   2.320
  623   2HE2  GLN  85          2HE2      GLN  85   2.445   0.274   1.381
  624    H    MET  86           H        MET  86  -1.346   4.400   0.803
  625    HA   MET  86           HA       MET  86   0.248   5.932   2.654
  626   1HB   MET  86          1HB       MET  86  -1.832   7.696   1.704
  627   2HB   MET  86          2HB       MET  86  -1.519   6.549   0.414
  628   1HG   MET  86          1HG       MET  86   1.005   7.645   1.610
  629   2HG   MET  86          2HG       MET  86   0.546   7.432  -0.088
  630   1HE   MET  86          1HE       MET  86  -2.269   8.910  -0.399
  631   2HE   MET  86          2HE       MET  86  -1.756  10.572  -0.814
  632   3HE   MET  86          3HE       MET  86  -0.916   9.173  -1.544
  633    H    LYS  87           H        LYS  87  -3.212   5.154   2.659
  634    HA   LYS  87           HA       LYS  87  -3.712   6.464   5.352
  635   1HB   LYS  87          1HB       LYS  87  -5.511   5.075   3.311
  636   2HB   LYS  87          2HB       LYS  87  -6.025   5.165   4.990
  637   1HG   LYS  87          1HG       LYS  87  -5.809   7.363   2.955
  638   2HG   LYS  87          2HG       LYS  87  -5.299   7.822   4.571
  639   1HD   LYS  87          1HD       LYS  87  -8.020   7.349   3.490
  640   2HD   LYS  87          2HD       LYS  87  -7.745   6.383   4.935
  641   1HE   LYS  87          1HE       LYS  87  -8.526   8.325   5.985
  642   2HE   LYS  87          2HE       LYS  87  -6.808   8.745   5.941
  643   1HZ   LYS  87          1HZ       LYS  87  -8.954   9.696   4.141
  644   2HZ   LYS  87          2HZ       LYS  87  -7.370   9.796   3.681
  645   3HZ   LYS  87          3HZ       LYS  87  -7.887  10.580   5.040
  646    H    GLU  88           H        GLU  88  -4.708   5.157   7.058
  647    HA   GLU  88           HA       GLU  88  -3.864   2.227   7.149
  648   1HB   GLU  88          1HB       GLU  88  -1.985   3.474   8.122
  649   2HB   GLU  88          2HB       GLU  88  -3.043   4.317   9.236
  650   1HG   GLU  88          1HG       GLU  88  -3.278   2.448  10.664
  651   2HG   GLU  88          2HG       GLU  88  -3.067   1.278   9.373
  652    H    ASP  89           H        ASP  89  -6.348   2.851   6.640
  653    HA   ASP  89           HA       ASP  89  -7.988   3.046   9.193
  654   1HB   ASP  89          1HB       ASP  89  -8.779   3.271   6.245
  655   2HB   ASP  89          2HB       ASP  89  -8.810   4.512   7.476
  656    H    ALA  90           H        ALA  90  -8.778   1.199   6.286
  657    HA   ALA  90           HA       ALA  90  -9.628  -1.214   7.785
  658   1HB   ALA  90          1HB       ALA  90  -9.998  -2.249   5.530
  659   2HB   ALA  90          2HB       ALA  90 -10.705  -0.623   5.598
  660   3HB   ALA  90          3HB       ALA  90  -9.170  -0.886   4.736
   
  Start of MODEL          12
 Raw file had  660 H/Q atoms
  Start of MODEL   12
    1   1H    ALA   1          1H        ALA   1 -22.471   7.082 -17.175
    2   2H    ALA   1          2H        ALA   1 -22.376   6.922 -18.846
    3   3H    ALA   1          3H        ALA   1 -23.797   6.517 -18.041
    4    HA   ALA   1           HA       ALA   1 -23.028   4.587 -17.210
    5   1HB   ALA   1          1HB       ALA   1 -21.582   3.533 -19.160
    6   2HB   ALA   1          2HB       ALA   1 -21.790   5.097 -19.971
    7   3HB   ALA   1          3HB       ALA   1 -23.217   4.115 -19.552
    8    H    SER   2           H        SER   2 -21.098   3.163 -16.813
    9    HA   SER   2           HA       SER   2 -19.065   2.734 -15.597
   10   1HB   SER   2          1HB       SER   2 -17.136   3.551 -16.518
   11   2HB   SER   2          2HB       SER   2 -18.240   4.026 -17.811
   12    HG   SER   2           HG       SER   2 -17.194   5.592 -15.704
   13    H    MET   3           H        MET   3 -17.488   3.946 -14.039
   14    HA   MET   3           HA       MET   3 -18.844   6.200 -12.487
   15   1HB   MET   3          1HB       MET   3 -18.239   3.404 -11.450
   16   2HB   MET   3          2HB       MET   3 -18.123   4.761 -10.345
   17   1HG   MET   3          1HG       MET   3 -20.665   4.335 -12.023
   18   2HG   MET   3          2HG       MET   3 -20.393   3.444 -10.520
   19   1HE   MET   3          1HE       MET   3 -22.673   6.183 -11.463
   20   2HE   MET   3          2HE       MET   3 -23.008   6.413  -9.721
   21   3HE   MET   3          3HE       MET   3 -22.876   4.761 -10.391
   22    H    THR   4           H        THR   4 -16.021   4.025 -12.725
   23    HA   THR   4           HA       THR   4 -13.691   4.347 -12.420
   24    HB   THR   4           HB       THR   4 -12.662   6.189 -13.529
   25    HG1  THR   4           HG1      THR   4 -14.637   7.644 -14.371
   26   1HG2  THR   4          1HG2      THR   4 -14.142   6.380 -15.739
   27   2HG2  THR   4          2HG2      THR   4 -15.088   5.065 -15.007
   28   3HG2  THR   4          3HG2      THR   4 -13.352   4.839 -15.343
   29    H    ASP   5           H        ASP   5 -14.986   4.484 -10.089
   30    HA   ASP   5           HA       ASP   5 -14.588   6.893  -8.463
   31   1HB   ASP   5          1HB       ASP   5 -14.569   4.195  -7.088
   32   2HB   ASP   5          2HB       ASP   5 -15.992   4.609  -8.016
   33    H    GLN   6           H        GLN   6 -12.594   4.112  -9.260
   34    HA   GLN   6           HA       GLN   6 -10.497   4.197  -7.305
   35   1HB   GLN   6          1HB       GLN   6  -8.989   3.398  -9.356
   36   2HB   GLN   6          2HB       GLN   6 -10.206   2.365  -8.629
   37   1HG   GLN   6          1HG       GLN   6 -11.527   2.315 -10.511
   38   2HG   GLN   6          2HG       GLN   6 -11.298   4.011 -10.877
   39   1HE2  GLN   6          1HE2      GLN   6  -8.298   1.465 -12.279
   40   2HE2  GLN   6          2HE2      GLN   6  -8.999   1.237 -10.599
   41    H    GLN   7           H        GLN   7  -9.878   5.395 -10.591
   42    HA   GLN   7           HA       GLN   7  -7.644   7.140  -9.837
   43   1HB   GLN   7          1HB       GLN   7  -8.462   6.158 -12.253
   44   2HB   GLN   7          2HB       GLN   7  -7.349   7.504 -12.052
   45   1HG   GLN   7          1HG       GLN   7 -10.210   8.375 -12.117
   46   2HG   GLN   7          2HG       GLN   7  -8.802   9.083 -12.896
   47   1HE2  GLN   7          1HE2      GLN   7 -10.454   5.793 -14.885
   48   2HE2  GLN   7          2HE2      GLN   7 -10.162   5.743 -13.075
   49    H    ALA   8           H        ALA   8 -11.116   7.634 -10.090
   50    HA   ALA   8           HA       ALA   8 -11.395  10.478 -10.223
   51   1HB   ALA   8          1HB       ALA   8 -13.592  10.182  -9.090
   52   2HB   ALA   8          2HB       ALA   8 -13.328   8.934 -10.324
   53   3HB   ALA   8          3HB       ALA   8 -13.152   8.529  -8.598
   54    H    GLU   9           H        GLU   9 -10.782   8.411  -7.393
   55    HA   GLU   9           HA       GLU   9 -10.829  10.661  -5.415
   56   1HB   GLU   9          1HB       GLU   9 -10.345   7.654  -5.177
   57   2HB   GLU   9          2HB       GLU   9  -9.812   8.713  -3.880
   58   1HG   GLU   9          1HG       GLU   9 -12.525   9.538  -4.428
   59   2HG   GLU   9          2HG       GLU   9 -12.541   7.779  -4.460
   60    H    ALA  10           H        ALA  10  -8.307   8.282  -6.322
   61    HA   ALA  10           HA       ALA  10  -6.058   9.421  -4.959
   62   1HB   ALA  10          1HB       ALA  10  -4.628   8.147  -6.548
   63   2HB   ALA  10          2HB       ALA  10  -6.006   7.173  -6.002
   64   3HB   ALA  10          3HB       ALA  10  -6.011   7.883  -7.636
   65    NH1  ARG  11           NH1      ARG  11  -6.443  12.694 -14.739
   66    NH2  ARG  11           NH2      ARG  11  -4.475  13.793 -15.027
   67    H    ARG  11           H        ARG  11  -7.664  10.493  -7.862
   68    HA   ARG  11           HA       ARG  11  -5.446  12.119  -9.032
   69   1HB   ARG  11          1HB       ARG  11  -8.127  11.294  -9.849
   70   2HB   ARG  11          2HB       ARG  11  -8.026  13.044  -9.962
   71   1HG   ARG  11          1HG       ARG  11  -5.717  11.451 -11.134
   72   2HG   ARG  11          2HG       ARG  11  -7.252  11.449 -12.005
   73   1HD   ARG  11          1HD       ARG  11  -7.221  13.815 -12.385
   74   2HD   ARG  11          2HD       ARG  11  -6.074  14.132 -11.082
   75    HE   ARG  11           HE       ARG  11  -4.233  13.349 -12.564
   76   1HH1  ARG  11          1HH1      ARG  11  -7.130  12.305 -14.084
   77   2HH1  ARG  11          2HH1      ARG  11  -6.495  12.683 -15.763
   78   1HH2  ARG  11          1HH2      ARG  11  -3.650  14.222 -14.593
   79   2HH2  ARG  11          2HH2      ARG  11  -4.677  13.725 -16.031
   80    H    ALA  12           H        ALA  12  -8.452  12.804  -7.238
   81    HA   ALA  12           HA       ALA  12  -8.303  15.722  -7.245
   82   1HB   ALA  12          1HB       ALA  12  -9.972  15.660  -5.405
   83   2HB   ALA  12          2HB       ALA  12 -10.401  14.526  -6.702
   84   3HB   ALA  12          3HB       ALA  12  -9.706  13.914  -5.180
   85    H    PHE  13           H        PHE  13  -6.866  13.257  -5.180
   86    HA   PHE  13           HA       PHE  13  -5.972  15.118  -3.018
   87   1HB   PHE  13          1HB       PHE  13  -5.237  12.178  -3.526
   88   2HB   PHE  13          2HB       PHE  13  -6.602  12.721  -2.586
   89    HD1  PHE  13           HD1      PHE  13  -6.100  12.107  -0.327
   90    HD2  PHE  13           HD2      PHE  13  -3.019  14.023  -2.642
   91    HE1  PHE  13           HE1      PHE  13  -4.620  12.127   1.639
   92    HE2  PHE  13           HE2      PHE  13  -1.554  14.031  -0.667
   93    HZ   PHE  13           HZ       PHE  13  -2.347  13.085   1.473
   94    H    LEU  14           H        LEU  14  -4.430  13.199  -5.608
   95    HA   LEU  14           HA       LEU  14  -1.736  14.553  -5.192
   96   1HB   LEU  14          1HB       LEU  14  -2.285  12.372  -7.261
   97   2HB   LEU  14          2HB       LEU  14  -0.756  12.837  -6.548
   98    HG   LEU  14           HG       LEU  14  -2.774  11.787  -4.570
   99   1HD1  LEU  14          1HD1      LEU  14  -2.462   9.398  -5.227
  100   2HD1  LEU  14          2HD1      LEU  14  -3.281  10.301  -6.515
  101   3HD1  LEU  14          3HD1      LEU  14  -1.556   9.888  -6.682
  102   1HD2  LEU  14          1HD2      LEU  14   0.209  11.127  -5.067
  103   2HD2  LEU  14          2HD2      LEU  14  -0.426  12.260  -3.849
  104   3HD2  LEU  14          3HD2      LEU  14  -0.774  10.531  -3.706
  105    H    SER  15           H        SER  15  -1.624  16.450  -6.124
  106    HA   SER  15           HA       SER  15  -3.145  17.430  -8.418
  107   1HB   SER  15          1HB       SER  15  -2.041  18.849  -6.614
  108   2HB   SER  15          2HB       SER  15  -1.861  19.437  -8.269
  109    HG   SER  15           HG       SER  15   0.028  19.206  -6.707
  110    H    GLU  16           H        GLU  16  -1.255  18.643 -10.047
  111    HA   GLU  16           HA       GLU  16  -0.587  16.421 -11.938
  112   1HB   GLU  16          1HB       GLU  16  -0.122  19.436 -12.245
  113   2HB   GLU  16          2HB       GLU  16  -1.588  18.592 -12.704
  114   1HG   GLU  16          1HG       GLU  16   1.168  17.911 -13.913
  115   2HG   GLU  16          2HG       GLU  16   0.115  19.145 -14.583
  116    H    GLU  17           H        GLU  17   1.063  18.644  -9.776
  117    HA   GLU  17           HA       GLU  17   3.828  18.075 -10.785
  118   1HB   GLU  17          1HB       GLU  17   2.665  19.886  -8.698
  119   2HB   GLU  17          2HB       GLU  17   3.817  20.221  -9.976
  120   1HG   GLU  17          1HG       GLU  17   4.339  19.072  -7.185
  121   2HG   GLU  17          2HG       GLU  17   5.495  18.747  -8.465
  122    H    MET  18           H        MET  18   1.713  17.046  -8.158
  123    HA   MET  18           HA       MET  18   3.647  15.421  -6.603
  124   1HB   MET  18          1HB       MET  18   1.233  14.189  -6.063
  125   2HB   MET  18          2HB       MET  18   0.659  15.750  -6.619
  126   1HG   MET  18          1HG       MET  18   1.492  16.907  -4.764
  127   2HG   MET  18          2HG       MET  18   2.895  15.842  -4.575
  128   1HE   MET  18          1HE       MET  18  -1.129  15.843  -4.381
  129   2HE   MET  18          2HE       MET  18  -1.269  15.374  -2.661
  130   3HE   MET  18          3HE       MET  18  -0.406  16.875  -3.108
  131    H    ILE  19           H        ILE  19   1.527  14.906  -9.377
  132    HA   ILE  19           HA       ILE  19   1.693  11.984  -9.568
  133    HB   ILE  19           HB       ILE  19   0.844  14.167 -11.472
  134   1HG1  ILE  19          1HG1      ILE  19  -0.742  11.613 -11.081
  135   2HG1  ILE  19          2HG1      ILE  19  -1.300  13.263 -11.262
  136   1HG2  ILE  19          1HG2      ILE  19   0.493  12.560 -13.364
  137   2HG2  ILE  19          2HG2      ILE  19   2.210  12.687 -12.985
  138   3HG2  ILE  19          3HG2      ILE  19   1.293  11.263 -12.442
  139   1HD1  ILE  19          1HD1      ILE  19  -0.763  13.831  -8.909
  140   2HD1  ILE  19          2HD1      ILE  19  -1.787  12.382  -8.985
  141   3HD1  ILE  19          3HD1      ILE  19  -0.046  12.216  -8.657
  142    H    ALA  20           H        ALA  20   3.684  14.667 -10.724
  143    HA   ALA  20           HA       ALA  20   5.442  13.261 -12.560
  144   1HB   ALA  20          1HB       ALA  20   6.973  15.211 -12.303
  145   2HB   ALA  20          2HB       ALA  20   5.288  15.730 -12.504
  146   3HB   ALA  20          3HB       ALA  20   6.051  15.787 -10.895
  147    H    GLU  21           H        GLU  21   5.554  13.725  -9.055
  148    HA   GLU  21           HA       GLU  21   8.274  12.901  -8.438
  149   1HB   GLU  21          1HB       GLU  21   5.716  12.666  -6.773
  150   2HB   GLU  21          2HB       GLU  21   6.870  13.984  -6.760
  151   1HG   GLU  21          1HG       GLU  21   7.034  11.261  -5.445
  152   2HG   GLU  21          2HG       GLU  21   8.553  11.890  -6.059
  153    H    PHE  22           H        PHE  22   5.320  11.115  -9.132
  154    HA   PHE  22           HA       PHE  22   6.539   8.417  -8.514
  155   1HB   PHE  22          1HB       PHE  22   3.699   9.083  -9.509
  156   2HB   PHE  22          2HB       PHE  22   4.268   7.510  -9.020
  157    HD1  PHE  22           HD1      PHE  22   5.766   7.905  -6.517
  158    HD2  PHE  22           HD2      PHE  22   2.158   9.842  -7.843
  159    HE1  PHE  22           HE1      PHE  22   5.222   8.504  -4.195
  160    HE2  PHE  22           HE2      PHE  22   1.628  10.425  -5.511
  161    HZ   PHE  22           HZ       PHE  22   3.181   9.805  -3.691
  162    H    LYS  23           H        LYS  23   5.880  10.495 -11.229
  163    HA   LYS  23           HA       LYS  23   5.476   8.823 -13.486
  164   1HB   LYS  23          1HB       LYS  23   6.402  11.540 -13.092
  165   2HB   LYS  23          2HB       LYS  23   7.521  10.794 -14.211
  166   1HG   LYS  23          1HG       LYS  23   4.908  10.058 -15.170
  167   2HG   LYS  23          2HG       LYS  23   4.772  11.726 -14.642
  168   1HD   LYS  23          1HD       LYS  23   7.105  10.899 -16.449
  169   2HD   LYS  23          2HD       LYS  23   6.452  12.519 -16.181
  170   1HE   LYS  23          1HE       LYS  23   5.831  11.010 -18.399
  171   2HE   LYS  23          2HE       LYS  23   4.515  10.479 -17.343
  172   1HZ   LYS  23          1HZ       LYS  23   3.688  12.646 -17.195
  173   2HZ   LYS  23          2HZ       LYS  23   4.177  12.564 -18.771
  174   3HZ   LYS  23          3HZ       LYS  23   5.100  13.367 -17.661
  175    H    ALA  24           H        ALA  24   8.559   9.576 -11.871
  176    HA   ALA  24           HA       ALA  24  10.379   8.258 -13.715
  177   1HB   ALA  24          1HB       ALA  24  12.040   8.338 -11.866
  178   2HB   ALA  24          2HB       ALA  24  11.165   9.874 -12.009
  179   3HB   ALA  24          3HB       ALA  24  10.763   8.741 -10.693
  180    H    ALA  25           H        ALA  25   9.665   7.077 -10.421
  181    HA   ALA  25           HA       ALA  25  10.737   4.445 -10.619
  182   1HB   ALA  25          1HB       ALA  25   9.314   3.848  -8.669
  183   2HB   ALA  25          2HB       ALA  25  10.034   5.456  -8.468
  184   3HB   ALA  25          3HB       ALA  25   8.315   5.301  -8.910
  185    H    PHE  26           H        PHE  26   7.690   5.674 -11.823
  186    HA   PHE  26           HA       PHE  26   6.154   3.180 -12.052
  187   1HB   PHE  26          1HB       PHE  26   4.871   5.184 -12.197
  188   2HB   PHE  26          2HB       PHE  26   5.875   5.893 -13.434
  189    HD1  PHE  26           HD1      PHE  26   4.299   6.255 -15.228
  190    HD2  PHE  26           HD2      PHE  26   4.447   2.377 -13.372
  191    HE1  PHE  26           HE1      PHE  26   2.635   5.411 -16.834
  192    HE2  PHE  26           HE2      PHE  26   2.779   1.551 -14.985
  193    HZ   PHE  26           HZ       PHE  26   1.871   3.063 -16.715
  194    H    ASP  27           H        ASP  27   8.042   5.038 -14.465
  195    HA   ASP  27           HA       ASP  27   7.838   3.098 -16.669
  196   1HB   ASP  27          1HB       ASP  27   9.752   5.429 -16.176
  197   2HB   ASP  27          2HB       ASP  27   8.408   5.336 -17.290
  198    H    MET  28           H        MET  28  10.096   3.585 -13.997
  199    HA   MET  28           HA       MET  28  12.230   1.770 -14.576
  200   1HB   MET  28          1HB       MET  28  11.059   1.808 -11.753
  201   2HB   MET  28          2HB       MET  28  11.820   3.243 -12.418
  202   1HG   MET  28          1HG       MET  28  13.261   0.520 -12.254
  203   2HG   MET  28          2HG       MET  28  13.984   2.075 -12.701
  204   1HE   MET  28          1HE       MET  28  12.870  -0.307  -9.846
  205   2HE   MET  28          2HE       MET  28  12.613   0.774  -8.444
  206   3HE   MET  28          3HE       MET  28  11.456   0.793  -9.808
  207    H    PHE  29           H        PHE  29   8.988   1.096 -13.300
  208    HA   PHE  29           HA       PHE  29   9.288  -1.821 -12.914
  209   1HB   PHE  29          1HB       PHE  29   6.870   0.032 -13.105
  210   2HB   PHE  29          2HB       PHE  29   6.622  -1.688 -13.230
  211    HD1  PHE  29           HD1      PHE  29   7.983   0.985 -10.959
  212    HD2  PHE  29           HD2      PHE  29   6.712  -3.118 -11.243
  213    HE1  PHE  29           HE1      PHE  29   7.935   0.817  -8.504
  214    HE2  PHE  29           HE2      PHE  29   6.679  -3.265  -8.787
  215    HZ   PHE  29           HZ       PHE  29   7.279  -1.302  -7.415
  216    H    ASP  30           H        ASP  30   7.985   0.235 -15.525
  217    HA   ASP  30           HA       ASP  30   7.180  -1.738 -17.448
  218   1HB   ASP  30          1HB       ASP  30   8.544   0.798 -18.442
  219   2HB   ASP  30          2HB       ASP  30   7.057   0.929 -17.531
  220    H    ALA  31           H        ALA  31   8.273  -2.466 -19.382
  221    HA   ALA  31           HA       ALA  31  11.312  -2.814 -19.114
  222   1HB   ALA  31          1HB       ALA  31  11.059  -5.198 -19.816
  223   2HB   ALA  31          2HB       ALA  31  10.204  -4.864 -18.297
  224   3HB   ALA  31          3HB       ALA  31   9.286  -5.040 -19.815
  225    H    ASP  32           H        ASP  32   8.452  -2.906 -21.221
  226    HA   ASP  32           HA       ASP  32  10.102  -2.866 -23.762
  227   1HB   ASP  32          1HB       ASP  32   8.359  -4.289 -24.228
  228   2HB   ASP  32          2HB       ASP  32   7.693  -2.794 -24.844
  229    H    GLY  33           H        GLY  33   7.914  -0.838 -21.857
  230   1HA   GLY  33          1HA       GLY  33   7.830   1.597 -21.693
  231   2HA   GLY  33          2HA       GLY  33   9.152   1.654 -22.836
  232    H    GLY  34           H        GLY  34   5.653   1.268 -22.489
  233   1HA   GLY  34          1HA       GLY  34   4.263   1.047 -24.797
  234   2HA   GLY  34          2HA       GLY  34   5.212   2.461 -25.272
  235    H    GLY  35           H        GLY  35   3.825   1.689 -22.092
  236   1HA   GLY  35          1HA       GLY  35   1.628   3.722 -22.163
  237   2HA   GLY  35          2HA       GLY  35   3.064   4.342 -21.337
  238    H    ASP  36           H        ASP  36   1.655   1.071 -21.427
  239    HA   ASP  36           HA       ASP  36   0.971   1.235 -18.455
  240   1HB   ASP  36          1HB       ASP  36  -0.503  -0.756 -18.833
  241   2HB   ASP  36          2HB       ASP  36  -0.987   0.676 -19.712
  242    H    ILE  37           H        ILE  37   0.943  -1.369 -17.765
  243    HA   ILE  37           HA       ILE  37   3.720  -2.521 -18.287
  244    HB   ILE  37           HB       ILE  37   2.652  -2.331 -15.447
  245   1HG1  ILE  37          1HG1      ILE  37   4.845  -0.461 -16.527
  246   2HG1  ILE  37          2HG1      ILE  37   3.164   0.023 -16.414
  247   1HG2  ILE  37          1HG2      ILE  37   4.914  -3.029 -14.763
  248   2HG2  ILE  37          2HG2      ILE  37   4.260  -4.185 -15.932
  249   3HG2  ILE  37          3HG2      ILE  37   5.484  -3.000 -16.449
  250   1HD1  ILE  37          1HD1      ILE  37   4.915  -0.761 -14.007
  251   2HD1  ILE  37          2HD1      ILE  37   4.339   0.861 -14.447
  252   3HD1  ILE  37          3HD1      ILE  37   3.176  -0.374 -13.914
  253    H    SER  38           H        SER  38   3.683  -4.568 -18.720
  254    HA   SER  38           HA       SER  38   1.180  -6.230 -18.420
  255   1HB   SER  38          1HB       SER  38   2.221  -7.850 -19.827
  256   2HB   SER  38          2HB       SER  38   2.639  -6.276 -20.509
  257    HG   SER  38           HG       SER  38   4.517  -7.226 -20.428
  258    H    THR  39           H        THR  39   1.617  -8.546 -17.657
  259    HA   THR  39           HA       THR  39   2.470  -8.480 -14.805
  260    HB   THR  39           HB       THR  39   2.034 -11.150 -15.211
  261    HG1  THR  39           HG1      THR  39   0.096 -11.068 -16.581
  262   1HG2  THR  39          1HG2      THR  39  -0.257 -10.850 -14.380
  263   2HG2  THR  39          2HG2      THR  39   0.809  -9.705 -13.533
  264   3HG2  THR  39          3HG2      THR  39  -0.264  -9.131 -14.837
  265    H    LYS  40           H        LYS  40   3.789  -9.596 -17.863
  266    HA   LYS  40           HA       LYS  40   5.929 -11.311 -16.992
  267   1HB   LYS  40          1HB       LYS  40   6.015  -9.405 -19.389
  268   2HB   LYS  40          2HB       LYS  40   5.144 -10.916 -19.406
  269   1HG   LYS  40          1HG       LYS  40   8.069 -10.275 -19.640
  270   2HG   LYS  40          2HG       LYS  40   7.779 -11.640 -18.594
  271   1HD   LYS  40          1HD       LYS  40   7.190 -11.441 -21.605
  272   2HD   LYS  40          2HD       LYS  40   8.287 -12.483 -20.748
  273   1HE   LYS  40          1HE       LYS  40   6.770 -14.113 -20.902
  274   2HE   LYS  40          2HE       LYS  40   5.902 -13.331 -19.587
  275   1HZ   LYS  40          1HZ       LYS  40   4.263 -13.415 -21.147
  276   2HZ   LYS  40          2HZ       LYS  40   5.286 -13.405 -22.445
  277   3HZ   LYS  40          3HZ       LYS  40   4.911 -11.991 -21.677
  278    H    GLU  41           H        GLU  41   5.758  -7.774 -17.327
  279    HA   GLU  41           HA       GLU  41   8.611  -7.285 -16.587
  280   1HB   GLU  41          1HB       GLU  41   8.271  -5.008 -16.993
  281   2HB   GLU  41          2HB       GLU  41   6.564  -5.060 -16.607
  282   1HG   GLU  41          1HG       GLU  41   7.951  -5.651 -19.221
  283   2HG   GLU  41          2HG       GLU  41   6.597  -6.695 -18.847
  284    H    LEU  42           H        LEU  42   5.432  -6.756 -15.054
  285    HA   LEU  42           HA       LEU  42   6.213  -5.377 -12.646
  286   1HB   LEU  42          1HB       LEU  42   3.876  -7.210 -13.316
  287   2HB   LEU  42          2HB       LEU  42   4.137  -6.788 -11.638
  288    HG   LEU  42           HG       LEU  42   3.827  -4.662 -13.844
  289   1HD1  LEU  42          1HD1      LEU  42   1.440  -4.431 -13.105
  290   2HD1  LEU  42          2HD1      LEU  42   1.751  -6.034 -13.788
  291   3HD1  LEU  42          3HD1      LEU  42   1.624  -5.834 -12.023
  292   1HD2  LEU  42          1HD2      LEU  42   3.553  -4.421 -10.770
  293   2HD2  LEU  42          2HD2      LEU  42   4.904  -3.798 -11.751
  294   3HD2  LEU  42          3HD2      LEU  42   3.281  -3.114 -11.952
  295    H    GLY  43           H        GLY  43   6.074  -8.852 -13.364
  296   1HA   GLY  43          1HA       GLY  43   6.917 -10.807 -12.212
  297   2HA   GLY  43          2HA       GLY  43   6.565  -9.933 -10.717
  298    H    THR  44           H        THR  44   8.814  -8.911 -13.256
  299    HA   THR  44           HA       THR  44  11.259 -10.021 -12.127
  300    HB   THR  44           HB       THR  44  10.675  -8.009 -14.275
  301    HG1  THR  44           HG1      THR  44  11.369 -10.499 -14.044
  302   1HG2  THR  44          1HG2      THR  44  13.093  -7.490 -14.645
  303   2HG2  THR  44          2HG2      THR  44  12.508  -6.777 -13.127
  304   3HG2  THR  44          3HG2      THR  44  13.509  -8.252 -13.089
  305    H    VAL  45           H        VAL  45   9.829  -6.768 -11.896
  306    HA   VAL  45           HA       VAL  45  11.940  -5.433 -10.430
  307    HB   VAL  45           HB       VAL  45   9.150  -4.794 -11.121
  308   1HG1  VAL  45          1HG1      VAL  45   8.759  -3.034  -9.393
  309   2HG1  VAL  45          2HG1      VAL  45   8.806  -4.634  -8.643
  310   3HG1  VAL  45          3HG1      VAL  45  10.210  -3.553  -8.497
  311   1HG2  VAL  45          1HG2      VAL  45  11.614  -2.977 -10.685
  312   2HG2  VAL  45          2HG2      VAL  45  11.097  -3.674 -12.238
  313   3HG2  VAL  45          3HG2      VAL  45  10.069  -2.485 -11.427
  314    H    MET  46           H        MET  46   8.810  -6.517  -9.049
  315    HA   MET  46           HA       MET  46   9.565  -6.201  -6.251
  316   1HB   MET  46          1HB       MET  46   7.570  -7.818  -5.800
  317   2HB   MET  46          2HB       MET  46   7.339  -7.863  -7.539
  318   1HG   MET  46          1HG       MET  46   5.879  -6.122  -7.086
  319   2HG   MET  46          2HG       MET  46   7.345  -5.140  -7.245
  320   1HE   MET  46          1HE       MET  46   4.518  -4.537  -5.511
  321   2HE   MET  46          2HE       MET  46   5.215  -3.702  -4.093
  322   3HE   MET  46          3HE       MET  46   5.793  -3.299  -5.736
  323    NH1  ARG  47           NH1      ARG  47   7.445 -11.816  -4.120
  324    NH2  ARG  47           NH2      ARG  47   5.884 -10.245  -4.628
  325    H    ARG  47           H        ARG  47   9.196  -9.208  -8.156
  326    HA   ARG  47           HA       ARG  47  10.137 -11.084  -6.148
  327   1HB   ARG  47          1HB       ARG  47  10.373 -11.514  -9.183
  328   2HB   ARG  47          2HB       ARG  47  10.329 -12.737  -7.919
  329   1HG   ARG  47          1HG       ARG  47   8.122 -12.451  -9.150
  330   2HG   ARG  47          2HG       ARG  47   7.991 -10.818  -8.493
  331   1HD   ARG  47          1HD       ARG  47   7.218 -13.325  -7.210
  332   2HD   ARG  47          2HD       ARG  47   8.533 -12.637  -6.270
  333    HE   ARG  47           HE       ARG  47   6.215 -10.799  -6.938
  334   1HH1  ARG  47          1HH1      ARG  47   8.100 -12.527  -4.463
  335   2HH1  ARG  47          2HH1      ARG  47   7.279 -11.555  -3.142
  336   1HH2  ARG  47          1HH2      ARG  47   5.348  -9.756  -5.354
  337   2HH2  ARG  47          2HH2      ARG  47   5.827 -10.093  -3.615
  338    H    MET  48           H        MET  48  11.918  -8.880  -8.144
  339    HA   MET  48           HA       MET  48  14.479  -9.996  -8.581
  340   1HB   MET  48          1HB       MET  48  15.340  -7.882  -8.833
  341   2HB   MET  48          2HB       MET  48  13.631  -7.502  -8.928
  342   1HG   MET  48          1HG       MET  48  13.918  -5.970  -7.265
  343   2HG   MET  48          2HG       MET  48  14.242  -7.292  -6.131
  344   1HE   MET  48          1HE       MET  48  15.548  -4.469  -5.569
  345   2HE   MET  48          2HE       MET  48  17.089  -4.110  -6.402
  346   3HE   MET  48          3HE       MET  48  15.549  -4.038  -7.307
  347    H    LEU  49           H        LEU  49  12.979  -9.186  -5.518
  348    HA   LEU  49           HA       LEU  49  15.086  -8.866  -3.665
  349   1HB   LEU  49          1HB       LEU  49  12.600  -8.844  -3.133
  350   2HB   LEU  49          2HB       LEU  49  13.644  -9.544  -1.914
  351    HG   LEU  49           HG       LEU  49  12.990 -11.884  -2.784
  352   1HD1  LEU  49          1HD1      LEU  49  10.772 -10.365  -4.297
  353   2HD1  LEU  49          2HD1      LEU  49  12.184 -11.103  -5.075
  354   3HD1  LEU  49          3HD1      LEU  49  11.003 -12.130  -4.225
  355   1HD2  LEU  49          1HD2      LEU  49  10.869 -11.960  -1.541
  356   2HD2  LEU  49          2HD2      LEU  49  11.915 -10.773  -0.725
  357   3HD2  LEU  49          3HD2      LEU  49  10.601 -10.213  -1.769
  358    H    GLY  50           H        GLY  50  13.712 -12.010  -4.701
  359   1HA   GLY  50          1HA       GLY  50  15.135 -13.916  -3.215
  360   2HA   GLY  50          2HA       GLY  50  16.386 -13.387  -4.340
  361    H    GLN  51           H        GLN  51  13.154 -14.802  -4.173
  362    HA   GLN  51           HA       GLN  51  13.807 -16.718  -6.407
  363   1HB   GLN  51          1HB       GLN  51  11.158 -16.617  -4.878
  364   2HB   GLN  51          2HB       GLN  51  11.867 -17.961  -5.754
  365   1HG   GLN  51          1HG       GLN  51  13.566 -16.938  -3.491
  366   2HG   GLN  51          2HG       GLN  51  13.275 -18.582  -4.013
  367   1HE2  GLN  51          1HE2      GLN  51  11.534 -17.814  -0.658
  368   2HE2  GLN  51          2HE2      GLN  51  13.174 -17.315  -1.313
  369    H    ASN  52           H        ASN  52  11.707 -17.196  -7.809
  370    HA   ASN  52           HA       ASN  52  10.381 -14.663  -8.776
  371   1HB   ASN  52          1HB       ASN  52  12.692 -15.294 -10.016
  372   2HB   ASN  52          2HB       ASN  52  11.677 -16.376 -10.944
  373   1HD2  ASN  52          1HD2      ASN  52  11.892 -12.935 -12.593
  374   2HD2  ASN  52          2HD2      ASN  52  13.138 -14.080 -11.884
  375    HA   PRO  53           HA       PRO  53   7.217 -18.281  -8.618
  376   1HB   PRO  53          1HB       PRO  53   5.201 -17.199  -7.968
  377   2HB   PRO  53          2HB       PRO  53   5.494 -15.832  -9.052
  378   1HG   PRO  53          1HG       PRO  53   6.104 -14.764  -7.077
  379   2HG   PRO  53          2HG       PRO  53   6.633 -16.249  -6.253
  380   1HD   PRO  53          1HD       PRO  53   8.807 -15.523  -6.881
  381   2HD   PRO  53          2HD       PRO  53   8.181 -14.426  -8.147
  382    H    THR  54           H        THR  54   5.518 -18.805 -10.260
  383    HA   THR  54           HA       THR  54   6.613 -18.622 -13.027
  384    HB   THR  54           HB       THR  54   5.301 -20.626 -11.902
  385    HG1  THR  54           HG1      THR  54   5.810 -21.214 -13.780
  386   1HG2  THR  54          1HG2      THR  54   2.951 -20.855 -12.639
  387   2HG2  THR  54          2HG2      THR  54   3.102 -19.467 -11.537
  388   3HG2  THR  54          3HG2      THR  54   2.949 -19.199 -13.292
  389    H    LYS  55           H        LYS  55   4.487 -18.369 -14.658
  390    HA   LYS  55           HA       LYS  55   3.706 -15.460 -14.459
  391   1HB   LYS  55          1HB       LYS  55   2.695 -15.849 -16.773
  392   2HB   LYS  55          2HB       LYS  55   3.193 -17.526 -16.692
  393   1HG   LYS  55          1HG       LYS  55   4.670 -15.304 -17.673
  394   2HG   LYS  55          2HG       LYS  55   5.502 -15.743 -16.191
  395   1HD   LYS  55          1HD       LYS  55   6.297 -16.890 -18.421
  396   2HD   LYS  55          2HD       LYS  55   4.794 -17.799 -18.377
  397   1HE   LYS  55          1HE       LYS  55   5.641 -18.396 -15.858
  398   2HE   LYS  55          2HE       LYS  55   6.072 -19.368 -17.263
  399   1HZ   LYS  55          1HZ       LYS  55   8.024 -17.476 -17.242
  400   2HZ   LYS  55          2HZ       LYS  55   8.159 -18.967 -16.543
  401   3HZ   LYS  55          3HZ       LYS  55   7.741 -17.659 -15.625
  402    H    GLU  56           H        GLU  56   2.300 -18.695 -14.351
  403    HA   GLU  56           HA       GLU  56  -0.519 -18.134 -14.581
  404   1HB   GLU  56          1HB       GLU  56   0.894 -20.426 -14.326
  405   2HB   GLU  56          2HB       GLU  56   0.343 -20.314 -12.666
  406   1HG   GLU  56          1HG       GLU  56  -1.069 -21.622 -14.553
  407   2HG   GLU  56          2HG       GLU  56  -1.709 -20.029 -14.920
  408    H    GLU  57           H        GLU  57   1.606 -18.183 -11.721
  409    HA   GLU  57           HA       GLU  57  -0.503 -17.621  -9.717
  410   1HB   GLU  57          1HB       GLU  57   2.537 -17.415  -9.472
  411   2HB   GLU  57          2HB       GLU  57   1.548 -18.809  -9.096
  412   1HG   GLU  57          1HG       GLU  57   1.559 -16.119  -7.573
  413   2HG   GLU  57          2HG       GLU  57   0.389 -17.390  -7.243
  414    H    LEU  58           H        LEU  58   1.726 -15.698 -11.651
  415    HA   LEU  58           HA       LEU  58   1.590 -13.166 -10.209
  416   1HB   LEU  58          1HB       LEU  58   2.720 -14.168 -12.735
  417   2HB   LEU  58          2HB       LEU  58   2.026 -12.578 -12.972
  418    HG   LEU  58           HG       LEU  58   3.911 -13.085 -10.605
  419   1HD1  LEU  58          1HD1      LEU  58   3.557 -10.542 -12.326
  420   2HD1  LEU  58          2HD1      LEU  58   2.670 -10.828 -10.822
  421   3HD1  LEU  58          3HD1      LEU  58   4.444 -10.687 -10.787
  422   1HD2  LEU  58          1HD2      LEU  58   5.886 -12.611 -12.005
  423   2HD2  LEU  58          2HD2      LEU  58   5.015 -13.997 -12.708
  424   3HD2  LEU  58          3HD2      LEU  58   4.870 -12.394 -13.452
  425    H    ASP  59           H        ASP  59  -0.401 -14.679 -12.689
  426    HA   ASP  59           HA       ASP  59  -1.993 -12.463 -13.621
  427   1HB   ASP  59          1HB       ASP  59  -2.842 -15.405 -13.383
  428   2HB   ASP  59          2HB       ASP  59  -2.034 -14.663 -14.744
  429    H    ALA  60           H        ALA  60  -2.314 -14.510 -10.757
  430    HA   ALA  60           HA       ALA  60  -4.972 -13.417  -9.901
  431   1HB   ALA  60          1HB       ALA  60  -4.671 -14.865  -7.898
  432   2HB   ALA  60          2HB       ALA  60  -4.392 -15.769  -9.399
  433   3HB   ALA  60          3HB       ALA  60  -3.010 -15.262  -8.396
  434    H    ILE  61           H        ILE  61  -1.555 -13.009  -9.080
  435    HA   ILE  61           HA       ILE  61  -1.679 -11.310  -6.745
  436    HB   ILE  61           HB       ILE  61   0.363 -11.832  -8.846
  437   1HG1  ILE  61          1HG1      ILE  61   0.013 -12.305  -6.008
  438   2HG1  ILE  61          2HG1      ILE  61   1.269 -12.907  -7.069
  439   1HG2  ILE  61          1HG2      ILE  61   1.851  -9.896  -8.259
  440   2HG2  ILE  61          2HG2      ILE  61   0.365  -9.328  -9.019
  441   3HG2  ILE  61          3HG2      ILE  61   0.561  -9.186  -7.257
  442   1HD1  ILE  61          1HD1      ILE  61   1.461 -10.275  -5.489
  443   2HD1  ILE  61          2HD1      ILE  61   2.336 -11.792  -5.188
  444   3HD1  ILE  61          3HD1      ILE  61   2.679 -10.853  -6.659
  445    H    ILE  62           H        ILE  62  -2.119 -10.639 -10.188
  446    HA   ILE  62           HA       ILE  62  -2.371  -7.664  -9.859
  447    HB   ILE  62           HB       ILE  62  -2.586  -9.525 -12.257
  448   1HG1  ILE  62          1HG1      ILE  62  -0.596  -7.464 -11.250
  449   2HG1  ILE  62          2HG1      ILE  62  -0.313  -9.026 -11.988
  450   1HG2  ILE  62          1HG2      ILE  62  -3.114  -7.575 -13.748
  451   2HG2  ILE  62          2HG2      ILE  62  -4.423  -7.838 -12.598
  452   3HG2  ILE  62          3HG2      ILE  62  -3.273  -6.509 -12.330
  453   1HD1  ILE  62          1HD1      ILE  62  -1.098  -6.494 -13.550
  454   2HD1  ILE  62          2HD1      ILE  62   0.478  -7.311 -13.521
  455   3HD1  ILE  62          3HD1      ILE  62  -0.920  -8.119 -14.267
  456    H    GLU  63           H        GLU  63  -4.416 -10.519 -10.244
  457    HA   GLU  63           HA       GLU  63  -7.021  -9.466 -10.641
  458   1HB   GLU  63          1HB       GLU  63  -6.579 -11.697  -8.607
  459   2HB   GLU  63          2HB       GLU  63  -6.245 -11.949 -10.309
  460   1HG   GLU  63          1HG       GLU  63  -8.963 -11.269  -9.026
  461   2HG   GLU  63          2HG       GLU  63  -8.713 -11.179 -10.761
  462    H    GLU  64           H        GLU  64  -5.031  -9.447  -7.732
  463    HA   GLU  64           HA       GLU  64  -6.924  -8.365  -5.792
  464   1HB   GLU  64          1HB       GLU  64  -5.132  -8.942  -4.576
  465   2HB   GLU  64          2HB       GLU  64  -4.019  -8.801  -5.922
  466   1HG   GLU  64          1HG       GLU  64  -5.016  -6.257  -4.530
  467   2HG   GLU  64          2HG       GLU  64  -3.549  -6.485  -5.465
  468    H    VAL  65           H        VAL  65  -4.428  -6.684  -7.739
  469    HA   VAL  65           HA       VAL  65  -5.895  -4.036  -7.361
  470    HB   VAL  65           HB       VAL  65  -3.007  -4.464  -8.286
  471   1HG1  VAL  65          1HG1      VAL  65  -3.925  -3.511  -5.497
  472   2HG1  VAL  65          2HG1      VAL  65  -3.448  -5.180  -5.859
  473   3HG1  VAL  65          3HG1      VAL  65  -2.263  -3.863  -6.033
  474   1HG2  VAL  65          1HG2      VAL  65  -2.656  -2.058  -8.025
  475   2HG2  VAL  65          2HG2      VAL  65  -4.109  -2.246  -9.036
  476   3HG2  VAL  65          3HG2      VAL  65  -4.277  -1.817  -7.328
  477    H    ASP  66           H        ASP  66  -7.479  -4.871  -8.919
  478    HA   ASP  66           HA       ASP  66  -7.122  -3.792 -11.614
  479   1HB   ASP  66          1HB       ASP  66  -7.405  -6.803 -11.880
  480   2HB   ASP  66          2HB       ASP  66  -5.808  -6.148 -11.601
  481    H    GLU  67           H        GLU  67  -8.942  -2.996 -10.198
  482    HA   GLU  67           HA       GLU  67 -11.470  -4.637 -10.120
  483   1HB   GLU  67          1HB       GLU  67 -11.412  -1.711  -9.337
  484   2HB   GLU  67          2HB       GLU  67 -10.496  -2.841  -8.357
  485   1HG   GLU  67          1HG       GLU  67 -13.533  -2.827  -8.862
  486   2HG   GLU  67          2HG       GLU  67 -12.699  -2.543  -7.344
  487    H    ASP  68           H        ASP  68 -10.433  -4.145 -12.723
  488    HA   ASP  68           HA       ASP  68 -12.659  -2.491 -13.983
  489   1HB   ASP  68          1HB       ASP  68 -11.222  -0.829 -14.494
  490   2HB   ASP  68          2HB       ASP  68 -10.674  -1.897 -15.765
  491    H    GLY  69           H        GLY  69  -9.927  -4.733 -14.523
  492   1HA   GLY  69          1HA       GLY  69 -10.310  -7.086 -15.419
  493   2HA   GLY  69          2HA       GLY  69 -11.723  -6.472 -16.288
  494    H    SER  70           H        SER  70  -8.686  -4.722 -16.129
  495    HA   SER  70           HA       SER  70  -8.489  -4.571 -19.122
  496   1HB   SER  70          1HB       SER  70  -8.105  -2.518 -17.922
  497   2HB   SER  70          2HB       SER  70  -6.576  -2.996 -18.664
  498    HG   SER  70           HG       SER  70  -5.873  -3.756 -16.702
  499    H    GLY  71           H        GLY  71  -6.612  -5.894 -16.396
  500   1HA   GLY  71          1HA       GLY  71  -5.318  -8.063 -16.561
  501   2HA   GLY  71          2HA       GLY  71  -5.116  -7.764 -18.293
  502    H    THR  72           H        THR  72  -4.479  -4.943 -17.968
  503    HA   THR  72           HA       THR  72  -1.556  -5.210 -17.145
  504    HB   THR  72           HB       THR  72  -1.191  -3.096 -18.497
  505    HG1  THR  72           HG1      THR  72  -3.007  -3.040 -20.165
  506   1HG2  THR  72          1HG2      THR  72  -1.210  -4.140 -20.726
  507   2HG2  THR  72          2HG2      THR  72  -0.635  -5.332 -19.540
  508   3HG2  THR  72          3HG2      THR  72  -2.294  -5.440 -20.184
  509    H    ILE  73           H        ILE  73  -0.801  -2.698 -16.681
  510    HA   ILE  73           HA       ILE  73  -2.618  -1.462 -14.564
  511    HB   ILE  73           HB       ILE  73   0.259  -2.358 -14.032
  512   1HG1  ILE  73          1HG1      ILE  73  -1.020  -4.261 -13.505
  513   2HG1  ILE  73          2HG1      ILE  73  -2.460  -3.346 -13.113
  514   1HG2  ILE  73          1HG2      ILE  73   0.132  -1.232 -11.814
  515   2HG2  ILE  73          2HG2      ILE  73  -0.114  -0.038 -13.096
  516   3HG2  ILE  73          3HG2      ILE  73  -1.507  -0.630 -12.159
  517   1HD1  ILE  73          1HD1      ILE  73  -1.570  -2.667 -10.900
  518   2HD1  ILE  73          2HD1      ILE  73  -1.510  -4.432 -11.092
  519   3HD1  ILE  73          3HD1      ILE  73  -0.018  -3.476 -11.251
  520    H    ASP  74           H        ASP  74  -2.992   0.181 -15.997
  521    HA   ASP  74           HA       ASP  74  -0.832   1.707 -17.366
  522   1HB   ASP  74          1HB       ASP  74  -2.504   3.061 -18.360
  523   2HB   ASP  74          2HB       ASP  74  -3.650   2.813 -17.063
  524    H    PHE  75           H        PHE  75  -0.924   4.194 -17.090
  525    HA   PHE  75           HA       PHE  75   0.124   4.926 -14.444
  526   1HB   PHE  75          1HB       PHE  75  -0.921   6.990 -16.452
  527   2HB   PHE  75          2HB       PHE  75   0.501   6.054 -16.825
  528    HD1  PHE  75           HD1      PHE  75   0.246   6.587 -13.239
  529    HD2  PHE  75           HD2      PHE  75   1.490   8.500 -16.888
  530    HE1  PHE  75           HE1      PHE  75   1.626   8.167 -11.953
  531    HE2  PHE  75           HE2      PHE  75   2.870  10.067 -15.582
  532    HZ   PHE  75           HZ       PHE  75   2.926   9.917 -13.119
  533    H    GLU  76           H        GLU  76  -3.061   4.905 -15.888
  534    HA   GLU  76           HA       GLU  76  -4.313   6.629 -13.739
  535   1HB   GLU  76          1HB       GLU  76  -5.325   5.497 -16.362
  536   2HB   GLU  76          2HB       GLU  76  -6.476   5.954 -15.126
  537   1HG   GLU  76          1HG       GLU  76  -5.454   8.317 -15.120
  538   2HG   GLU  76          2HG       GLU  76  -4.417   7.819 -16.440
  539    H    GLU  77           H        GLU  77  -3.127   4.342 -12.761
  540    HA   GLU  77           HA       GLU  77  -5.375   3.067 -11.273
  541   1HB   GLU  77          1HB       GLU  77  -5.640   1.542 -13.026
  542   2HB   GLU  77          2HB       GLU  77  -3.932   1.463 -13.393
  543   1HG   GLU  77          1HG       GLU  77  -5.077   0.312 -10.777
  544   2HG   GLU  77          2HG       GLU  77  -3.471   0.033 -11.440
  545    H    PHE  78           H        PHE  78  -1.936   2.992 -12.154
  546    HA   PHE  78           HA       PHE  78  -0.846   1.688  -9.804
  547   1HB   PHE  78          1HB       PHE  78   0.405   2.246 -11.981
  548   2HB   PHE  78          2HB       PHE  78   0.549   3.901 -11.444
  549    HD1  PHE  78           HD1      PHE  78   1.817   0.455 -11.071
  550    HD2  PHE  78           HD2      PHE  78   1.950   4.377  -9.307
  551    HE1  PHE  78           HE1      PHE  78   3.879  -0.144  -9.866
  552    HE2  PHE  78           HE2      PHE  78   3.993   3.750  -8.087
  553    HZ   PHE  78           HZ       PHE  78   4.966   1.497  -8.369
  554    H    LEU  79           H        LEU  79  -1.781   5.028 -10.452
  555    HA   LEU  79           HA       LEU  79  -0.619   6.279  -8.052
  556   1HB   LEU  79          1HB       LEU  79  -2.192   8.203  -8.554
  557   2HB   LEU  79          2HB       LEU  79  -2.956   7.246  -9.804
  558    HG   LEU  79           HG       LEU  79  -0.672   7.116 -11.007
  559   1HD1  LEU  79          1HD1      LEU  79  -0.903   9.392 -12.007
  560   2HD1  LEU  79          2HD1      LEU  79  -2.496   8.651 -11.764
  561   3HD1  LEU  79          3HD1      LEU  79  -1.928   9.916 -10.646
  562   1HD2  LEU  79          1HD2      LEU  79   0.104   9.324  -8.983
  563   2HD2  LEU  79          2HD2      LEU  79   0.859   7.717  -9.124
  564   3HD2  LEU  79          3HD2      LEU  79   1.027   8.885 -10.443
  565    H    VAL  80           H        VAL  80  -3.701   4.740  -8.798
  566    HA   VAL  80           HA       VAL  80  -5.208   5.523  -6.395
  567    HB   VAL  80           HB       VAL  80  -5.593   3.391  -8.503
  568   1HG1  VAL  80          1HG1      VAL  80  -7.622   2.493  -7.345
  569   2HG1  VAL  80          2HG1      VAL  80  -6.161   2.136  -6.416
  570   3HG1  VAL  80          3HG1      VAL  80  -7.240   3.449  -5.891
  571   1HG2  VAL  80          1HG2      VAL  80  -7.499   5.578  -7.441
  572   2HG2  VAL  80          2HG2      VAL  80  -6.523   5.700  -8.923
  573   3HG2  VAL  80          3HG2      VAL  80  -7.806   4.486  -8.813
  574    H    MET  81           H        MET  81  -2.958   2.926  -7.209
  575    HA   MET  81           HA       MET  81  -3.260   1.234  -4.815
  576   1HB   MET  81          1HB       MET  81  -0.566   1.403  -6.201
  577   2HB   MET  81          2HB       MET  81  -1.935   0.851  -7.148
  578   1HG   MET  81          1HG       MET  81  -1.291  -0.452  -4.437
  579   2HG   MET  81          2HG       MET  81  -2.302  -1.089  -5.745
  580   1HE   MET  81          1HE       MET  81  -0.883  -3.356  -5.406
  581   2HE   MET  81          2HE       MET  81   0.866  -3.497  -5.754
  582   3HE   MET  81          3HE       MET  81   0.318  -2.638  -4.286
  583    H    MET  82           H        MET  82  -0.556   3.410  -5.676
  584    HA   MET  82           HA       MET  82   0.829   3.434  -3.175
  585   1HB   MET  82          1HB       MET  82   0.722   5.350  -5.505
  586   2HB   MET  82          2HB       MET  82   1.408   5.975  -4.017
  587   1HG   MET  82          1HG       MET  82   2.395   3.294  -5.152
  588   2HG   MET  82          2HG       MET  82   2.979   4.828  -5.811
  589   1HE   MET  82          1HE       MET  82   5.089   3.436  -5.240
  590   2HE   MET  82          2HE       MET  82   5.038   2.487  -3.726
  591   3HE   MET  82          3HE       MET  82   6.065   3.947  -3.827
  592    H    VAL  83           H        VAL  83  -2.016   5.239  -4.189
  593    HA   VAL  83           HA       VAL  83  -2.059   7.281  -2.087
  594    HB   VAL  83           HB       VAL  83  -3.828   6.504  -4.295
  595   1HG1  VAL  83          1HG1      VAL  83  -5.982   7.376  -3.372
  596   2HG1  VAL  83          2HG1      VAL  83  -5.488   5.907  -2.518
  597   3HG1  VAL  83          3HG1      VAL  83  -5.264   7.493  -1.745
  598   1HG2  VAL  83          1HG2      VAL  83  -3.504   9.193  -2.804
  599   2HG2  VAL  83          2HG2      VAL  83  -2.599   8.692  -4.250
  600   3HG2  VAL  83          3HG2      VAL  83  -4.346   8.952  -4.357
  601    NH1  ARG  84           NH1      ARG  84  -9.888   0.793  -2.736
  602    NH2  ARG  84           NH2      ARG  84  -9.424  -1.364  -2.198
  603    H    ARG  84           H        ARG  84  -3.815   4.188  -2.480
  604    HA   ARG  84           HA       ARG  84  -5.380   4.199  -0.018
  605   1HB   ARG  84          1HB       ARG  84  -4.506   2.062  -1.978
  606   2HB   ARG  84          2HB       ARG  84  -4.975   1.515  -0.375
  607   1HG   ARG  84          1HG       ARG  84  -7.216   2.300  -0.563
  608   2HG   ARG  84          2HG       ARG  84  -6.837   3.431  -1.865
  609   1HD   ARG  84          1HD       ARG  84  -6.084   0.953  -2.994
  610   2HD   ARG  84          2HD       ARG  84  -7.573   1.834  -3.345
  611    HE   ARG  84           HE       ARG  84  -7.385  -0.312  -1.158
  612   1HH1  ARG  84          1HH1      ARG  84  -8.728  -2.048  -1.883
  613   2HH1  ARG  84          2HH1      ARG  84 -10.401  -1.553  -2.450
  614   1HH2  ARG  84          1HH2      ARG  84  -9.539   1.750  -2.858
  615   2HH2  ARG  84          2HH2      ARG  84 -10.842   0.459  -2.917
  616    H    GLN  85           H        GLN  85  -2.067   3.195  -0.748
  617    HA   GLN  85           HA       GLN  85  -1.518   1.816   1.825
  618   1HB   GLN  85          1HB       GLN  85   0.139   2.617  -0.582
  619   2HB   GLN  85          2HB       GLN  85   0.989   2.326   0.924
  620   1HG   GLN  85          1HG       GLN  85   0.248   0.384  -0.962
  621   2HG   GLN  85          2HG       GLN  85  -0.992   0.174   0.254
  622   1HE2  GLN  85          1HE2      GLN  85   1.631  -2.093   1.480
  623   2HE2  GLN  85          2HE2      GLN  85   0.330  -1.971   0.192
  624    H    MET  86           H        MET  86  -1.137   5.077   0.541
  625    HA   MET  86           HA       MET  86   0.655   6.228   2.542
  626   1HB   MET  86          1HB       MET  86   0.530   8.074   1.273
  627   2HB   MET  86          2HB       MET  86  -0.482   7.143   0.185
  628   1HG   MET  86          1HG       MET  86  -2.551   8.017   1.044
  629   2HG   MET  86          2HG       MET  86  -1.790   8.667   2.503
  630   1HE   MET  86          1HE       MET  86  -3.493   9.798  -0.494
  631   2HE   MET  86          2HE       MET  86  -2.399  10.845  -1.445
  632   3HE   MET  86          3HE       MET  86  -2.180   9.071  -1.472
  633    H    LYS  87           H        LYS  87  -2.894   6.086   2.287
  634    HA   LYS  87           HA       LYS  87  -3.693   7.650   4.570
  635   1HB   LYS  87          1HB       LYS  87  -5.685   5.859   4.708
  636   2HB   LYS  87          2HB       LYS  87  -5.001   5.259   3.205
  637   1HG   LYS  87          1HG       LYS  87  -5.374   8.225   3.206
  638   2HG   LYS  87          2HG       LYS  87  -5.722   7.054   1.945
  639   1HD   LYS  87          1HD       LYS  87  -7.935   7.312   2.423
  640   2HD   LYS  87          2HD       LYS  87  -7.639   6.458   3.933
  641   1HE   LYS  87          1HE       LYS  87  -7.054   9.453   3.930
  642   2HE   LYS  87          2HE       LYS  87  -8.751   8.957   3.890
  643   1HZ   LYS  87          1HZ       LYS  87  -7.882   7.374   5.830
  644   2HZ   LYS  87          2HZ       LYS  87  -8.400   8.917   6.116
  645   3HZ   LYS  87          3HZ       LYS  87  -6.783   8.594   6.016
  646    H    GLU  88           H        GLU  88  -3.461   4.073   4.476
  647    HA   GLU  88           HA       GLU  88  -2.746   2.457   6.102
  648   1HB   GLU  88          1HB       GLU  88  -0.727   4.051   6.191
  649   2HB   GLU  88          2HB       GLU  88  -1.439   4.772   7.622
  650   1HG   GLU  88          1HG       GLU  88  -0.019   2.148   7.296
  651   2HG   GLU  88          2HG       GLU  88  -1.470   2.025   8.276
  652    H    ASP  89           H        ASP  89  -5.292   3.568   6.120
  653    HA   ASP  89           HA       ASP  89  -7.278   3.881   7.452
  654   1HB   ASP  89          1HB       ASP  89  -7.324   1.640   7.966
  655   2HB   ASP  89          2HB       ASP  89  -7.243   2.318   9.576
  656    H    ALA  90           H        ALA  90  -5.372   5.894   7.725
  657    HA   ALA  90           HA       ALA  90  -4.894   6.592  10.615
  658   1HB   ALA  90          1HB       ALA  90  -3.986   8.755   9.727
  659   2HB   ALA  90          2HB       ALA  90  -3.250   7.374   8.890
  660   3HB   ALA  90          3HB       ALA  90  -4.511   8.333   8.078
   
  Start of MODEL          13
 Raw file had  660 H/Q atoms
  Start of MODEL   13
    1   1H    ALA   1          1H        ALA   1 -25.719   7.495 -17.338
    2   2H    ALA   1          2H        ALA   1 -25.197   9.091 -17.423
    3   3H    ALA   1          3H        ALA   1 -24.547   7.937 -18.460
    4    HA   ALA   1           HA       ALA   1 -23.924   8.575 -15.719
    5   1HB   ALA   1          1HB       ALA   1 -23.189   6.042 -15.398
    6   2HB   ALA   1          2HB       ALA   1 -24.427   5.687 -16.617
    7   3HB   ALA   1          3HB       ALA   1 -24.886   6.480 -15.088
    8    H    SER   2           H        SER   2 -21.742   8.776 -15.558
    9    HA   SER   2           HA       SER   2 -19.761   7.652 -17.466
   10   1HB   SER   2          1HB       SER   2 -21.076   9.915 -18.469
   11   2HB   SER   2          2HB       SER   2 -19.587  10.595 -17.808
   12    HG   SER   2           HG       SER   2 -18.436   8.998 -18.968
   13    H    MET   3           H        MET   3 -17.575   8.583 -17.034
   14    HA   MET   3           HA       MET   3 -15.783   9.285 -15.594
   15   1HB   MET   3          1HB       MET   3 -17.705  11.227 -15.265
   16   2HB   MET   3          2HB       MET   3 -17.598  10.648 -13.612
   17   1HG   MET   3          1HG       MET   3 -15.981  12.351 -13.596
   18   2HG   MET   3          2HG       MET   3 -14.957  10.950 -13.938
   19   1HE   MET   3          1HE       MET   3 -15.359  14.338 -14.541
   20   2HE   MET   3          2HE       MET   3 -16.659  14.285 -15.768
   21   3HE   MET   3          3HE       MET   3 -14.992  14.711 -16.256
   22    H    THR   4           H        THR   4 -15.440   7.129 -15.022
   23    HA   THR   4           HA       THR   4 -16.725   5.717 -12.785
   24    HB   THR   4           HB       THR   4 -14.370   5.190 -14.525
   25    HG1  THR   4           HG1      THR   4 -15.745   3.091 -14.020
   26   1HG2  THR   4          1HG2      THR   4 -13.095   4.372 -12.742
   27   2HG2  THR   4          2HG2      THR   4 -14.094   2.940 -13.075
   28   3HG2  THR   4          3HG2      THR   4 -14.501   4.017 -11.715
   29    H    ASP   5           H        ASP   5 -16.541   6.103 -10.712
   30    HA   ASP   5           HA       ASP   5 -14.420   7.912  -9.555
   31   1HB   ASP   5          1HB       ASP   5 -16.719   8.285  -8.787
   32   2HB   ASP   5          2HB       ASP   5 -15.679   7.835  -7.454
   33    H    GLN   6           H        GLN   6 -13.299   5.653 -10.607
   34    HA   GLN   6           HA       GLN   6 -12.841   3.554  -8.473
   35   1HB   GLN   6          1HB       GLN   6 -13.041   2.689 -10.717
   36   2HB   GLN   6          2HB       GLN   6 -11.896   3.850 -11.364
   37   1HG   GLN   6          1HG       GLN   6 -10.270   2.561  -9.517
   38   2HG   GLN   6          2HG       GLN   6 -11.374   1.261  -9.906
   39   1HE2  GLN   6          1HE2      GLN   6  -8.343   1.846 -12.419
   40   2HE2  GLN   6          2HE2      GLN   6  -8.438   2.284 -10.640
   41    H    GLN   7           H        GLN   7 -11.056   6.073 -10.251
   42    HA   GLN   7           HA       GLN   7  -8.955   6.239  -8.028
   43   1HB   GLN   7          1HB       GLN   7  -8.045   4.777  -9.915
   44   2HB   GLN   7          2HB       GLN   7  -7.095   6.200  -9.499
   45   1HG   GLN   7          1HG       GLN   7  -7.856   7.433 -11.482
   46   2HG   GLN   7          2HG       GLN   7  -7.167   5.890 -11.964
   47   1HE2  GLN   7          1HE2      GLN   7 -10.389   4.619 -13.151
   48   2HE2  GLN   7          2HE2      GLN   7  -8.728   4.147 -12.531
   49    H    ALA   8           H        ALA   8 -11.336   7.837  -9.105
   50    HA   ALA   8           HA       ALA   8 -10.221  10.347 -10.264
   51   1HB   ALA   8          1HB       ALA   8 -12.540  11.223 -10.025
   52   2HB   ALA   8          2HB       ALA   8 -12.527   9.629 -10.805
   53   3HB   ALA   8          3HB       ALA   8 -13.023   9.781  -9.100
   54    H    GLU   9           H        GLU   9 -11.088   9.123  -7.077
   55    HA   GLU   9           HA       GLU   9 -10.955  11.687  -5.583
   56   1HB   GLU   9          1HB       GLU   9 -11.143   8.763  -4.759
   57   2HB   GLU   9          2HB       GLU   9 -10.536   9.913  -3.576
   58   1HG   GLU   9          1HG       GLU   9 -12.824  11.271  -4.472
   59   2HG   GLU   9          2HG       GLU   9 -13.336   9.593  -4.610
   60    H    ALA  10           H        ALA  10  -8.693   9.108  -6.410
   61    HA   ALA  10           HA       ALA  10  -6.503   9.902  -4.580
   62   1HB   ALA  10          1HB       ALA  10  -5.131   8.262  -5.856
   63   2HB   ALA  10          2HB       ALA  10  -6.703   7.576  -5.404
   64   3HB   ALA  10          3HB       ALA  10  -6.410   8.099  -7.082
   65    NH1  ARG  11           NH1      ARG  11  -7.832  13.790 -15.018
   66    NH2  ARG  11           NH2      ARG  11  -8.707  15.781 -14.365
   67    H    ARG  11           H        ARG  11  -7.443  10.667  -7.882
   68    HA   ARG  11           HA       ARG  11  -4.921  11.865  -8.854
   69   1HB   ARG  11          1HB       ARG  11  -6.234  11.363 -10.684
   70   2HB   ARG  11          2HB       ARG  11  -7.742  11.654  -9.831
   71   1HG   ARG  11          1HG       ARG  11  -7.810  13.944 -10.314
   72   2HG   ARG  11          2HG       ARG  11  -6.058  14.105 -10.457
   73   1HD   ARG  11          1HD       ARG  11  -6.044  12.946 -12.644
   74   2HD   ARG  11          2HD       ARG  11  -7.754  12.534 -12.512
   75    HE   ARG  11           HE       ARG  11  -7.110  15.493 -12.446
   76   1HH1  ARG  11          1HH1      ARG  11  -7.259  12.974 -14.777
   77   2HH1  ARG  11          2HH1      ARG  11  -8.314  13.961 -15.907
   78   1HH2  ARG  11          1HH2      ARG  11  -8.784  16.496 -13.633
   79   2HH2  ARG  11          2HH2      ARG  11  -9.146  15.802 -15.292
   80    H    ALA  12           H        ALA  12  -7.787  13.076  -7.183
   81    HA   ALA  12           HA       ALA  12  -7.062  15.966  -7.326
   82   1HB   ALA  12          1HB       ALA  12  -9.012  16.309  -5.821
   83   2HB   ALA  12          2HB       ALA  12  -9.435  15.271  -7.196
   84   3HB   ALA  12          3HB       ALA  12  -9.180  14.552  -5.587
   85    H    PHE  13           H        PHE  13  -6.617  13.292  -5.075
   86    HA   PHE  13           HA       PHE  13  -5.786  14.828  -2.719
   87   1HB   PHE  13          1HB       PHE  13  -6.644  12.384  -2.861
   88   2HB   PHE  13          2HB       PHE  13  -5.025  11.912  -3.308
   89    HD1  PHE  13           HD1      PHE  13  -5.391  14.759  -0.936
   90    HD2  PHE  13           HD2      PHE  13  -4.950  10.486  -1.222
   91    HE1  PHE  13           HE1      PHE  13  -4.851  14.642   1.463
   92    HE2  PHE  13           HE2      PHE  13  -4.415  10.391   1.177
   93    HZ   PHE  13           HZ       PHE  13  -4.361  12.463   2.522
   94    H    LEU  14           H        LEU  14  -4.123  13.449  -5.504
   95    HA   LEU  14           HA       LEU  14  -1.372  14.332  -4.492
   96   1HB   LEU  14          1HB       LEU  14  -1.827  12.675  -7.018
   97   2HB   LEU  14          2HB       LEU  14  -0.367  12.837  -6.067
   98    HG   LEU  14           HG       LEU  14  -2.764  11.565  -4.695
   99   1HD1  LEU  14          1HD1      LEU  14  -2.268   9.330  -5.692
  100   2HD1  LEU  14          2HD1      LEU  14  -2.791  10.473  -6.943
  101   3HD1  LEU  14          3HD1      LEU  14  -1.065  10.056  -6.789
  102   1HD2  LEU  14          1HD2      LEU  14   0.265  10.936  -4.618
  103   2HD2  LEU  14          2HD2      LEU  14  -0.650  11.842  -3.387
  104   3HD2  LEU  14          3HD2      LEU  14  -0.990  10.125  -3.646
  105    H    SER  15           H        SER  15  -0.226  15.835  -5.547
  106    HA   SER  15           HA       SER  15  -1.685  17.610  -7.534
  107   1HB   SER  15          1HB       SER  15   0.973  18.340  -6.238
  108   2HB   SER  15          2HB       SER  15  -0.313  19.395  -6.828
  109    HG   SER  15           HG       SER  15  -0.580  19.357  -4.708
  110    H    GLU  16           H        GLU  16   0.649  18.838  -8.579
  111    HA   GLU  16           HA       GLU  16   1.323  16.945 -10.803
  112   1HB   GLU  16          1HB       GLU  16   0.835  19.600 -10.826
  113   2HB   GLU  16          2HB       GLU  16   2.575  19.697 -10.639
  114   1HG   GLU  16          1HG       GLU  16   2.298  19.785 -12.986
  115   2HG   GLU  16          2HG       GLU  16   0.943  18.670 -12.992
  116    H    GLU  17           H        GLU  17   2.868  18.453  -8.029
  117    HA   GLU  17           HA       GLU  17   5.661  17.609  -8.748
  118   1HB   GLU  17          1HB       GLU  17   4.979  18.596  -5.967
  119   2HB   GLU  17          2HB       GLU  17   4.823  19.717  -7.305
  120   1HG   GLU  17          1HG       GLU  17   7.413  18.166  -6.647
  121   2HG   GLU  17          2HG       GLU  17   7.244  19.380  -7.903
  122    H    MET  18           H        MET  18   3.025  16.593  -6.634
  123    HA   MET  18           HA       MET  18   4.444  14.470  -5.124
  124   1HB   MET  18          1HB       MET  18   2.036  13.568  -4.728
  125   2HB   MET  18          2HB       MET  18   1.463  14.962  -5.624
  126   1HG   MET  18          1HG       MET  18   1.393  16.041  -3.608
  127   2HG   MET  18          2HG       MET  18   3.153  16.191  -3.745
  128   1HE   MET  18          1HE       MET  18   0.178  13.869  -2.412
  129   2HE   MET  18          2HE       MET  18   0.802  13.672  -0.747
  130   3HE   MET  18          3HE       MET  18   0.477  15.309  -1.389
  131    H    ILE  19           H        ILE  19   2.609  14.662  -8.145
  132    HA   ILE  19           HA       ILE  19   2.449  11.750  -8.672
  133    HB   ILE  19           HB       ILE  19   1.755  14.230 -10.230
  134   1HG1  ILE  19          1HG1      ILE  19   0.242  12.519  -8.692
  135   2HG1  ILE  19          2HG1      ILE  19   0.073  11.700 -10.230
  136   1HG2  ILE  19          1HG2      ILE  19   1.354  12.974 -12.363
  137   2HG2  ILE  19          2HG2      ILE  19   3.069  12.954 -11.959
  138   3HG2  ILE  19          3HG2      ILE  19   2.080  11.506 -11.663
  139   1HD1  ILE  19          1HD1      ILE  19  -0.925  13.690 -11.320
  140   2HD1  ILE  19          2HD1      ILE  19  -1.805  13.285  -9.832
  141   3HD1  ILE  19          3HD1      ILE  19  -0.672  14.657  -9.841
  142    H    ALA  20           H        ALA  20   4.680  14.380  -9.426
  143    HA   ALA  20           HA       ALA  20   6.332  13.151 -11.458
  144   1HB   ALA  20          1HB       ALA  20   8.055  14.842 -10.839
  145   2HB   ALA  20          2HB       ALA  20   6.439  15.568 -10.940
  146   3HB   ALA  20          3HB       ALA  20   7.169  15.241  -9.348
  147    H    GLU  21           H        GLU  21   6.474  12.989  -7.917
  148    HA   GLU  21           HA       GLU  21   9.119  11.791  -7.596
  149   1HB   GLU  21          1HB       GLU  21   6.682  11.996  -5.799
  150   2HB   GLU  21          2HB       GLU  21   8.237  12.792  -5.659
  151   1HG   GLU  21          1HG       GLU  21   8.001   9.744  -5.313
  152   2HG   GLU  21          2HG       GLU  21   9.312  10.789  -4.790
  153    H    PHE  22           H        PHE  22   5.891  10.464  -8.131
  154    HA   PHE  22           HA       PHE  22   6.678   7.593  -7.738
  155   1HB   PHE  22          1HB       PHE  22   4.043   8.822  -8.758
  156   2HB   PHE  22          2HB       PHE  22   4.312   7.115  -8.538
  157    HD1  PHE  22           HD1      PHE  22   3.925   6.064  -6.423
  158    HD2  PHE  22           HD2      PHE  22   4.356  10.345  -6.572
  159    HE1  PHE  22           HE1      PHE  22   3.336   6.217  -4.041
  160    HE2  PHE  22           HE2      PHE  22   3.766  10.476  -4.186
  161    HZ   PHE  22           HZ       PHE  22   3.253   8.418  -2.918
  162    H    LYS  23           H        LYS  23   6.344   9.901 -10.351
  163    HA   LYS  23           HA       LYS  23   5.925   8.244 -12.688
  164   1HB   LYS  23          1HB       LYS  23   7.189  10.961 -12.244
  165   2HB   LYS  23          2HB       LYS  23   7.592  10.154 -13.743
  166   1HG   LYS  23          1HG       LYS  23   5.545  11.821 -13.645
  167   2HG   LYS  23          2HG       LYS  23   4.676  10.494 -12.894
  168   1HD   LYS  23          1HD       LYS  23   6.115  10.007 -15.551
  169   2HD   LYS  23          2HD       LYS  23   4.764   9.106 -14.852
  170   1HE   LYS  23          1HE       LYS  23   3.184  10.960 -15.290
  171   2HE   LYS  23          2HE       LYS  23   4.049  10.590 -16.789
  172   1HZ   LYS  23          1HZ       LYS  23   4.328  12.830 -16.729
  173   2HZ   LYS  23          2HZ       LYS  23   5.649  12.465 -15.807
  174   3HZ   LYS  23          3HZ       LYS  23   4.247  12.955 -15.084
  175    H    ALA  24           H        ALA  24   8.956   9.235 -11.083
  176    HA   ALA  24           HA       ALA  24  10.889   8.100 -12.903
  177   1HB   ALA  24          1HB       ALA  24  12.496   8.182 -11.007
  178   2HB   ALA  24          2HB       ALA  24  11.529   9.666 -11.096
  179   3HB   ALA  24          3HB       ALA  24  11.167   8.442  -9.852
  180    H    ALA  25           H        ALA  25   9.589   6.695  -9.874
  181    HA   ALA  25           HA       ALA  25  10.898   4.043 -10.249
  182   1HB   ALA  25          1HB       ALA  25   9.716   3.415  -8.151
  183   2HB   ALA  25          2HB       ALA  25  10.534   4.980  -7.979
  184   3HB   ALA  25          3HB       ALA  25   8.766   4.920  -8.193
  185    H    PHE  26           H        PHE  26   8.099   5.464 -11.549
  186    HA   PHE  26           HA       PHE  26   6.250   3.113 -11.528
  187   1HB   PHE  26          1HB       PHE  26   5.228   5.313 -11.593
  188   2HB   PHE  26          2HB       PHE  26   6.136   5.807 -12.996
  189    HD1  PHE  26           HD1      PHE  26   3.203   3.917 -11.778
  190    HD2  PHE  26           HD2      PHE  26   5.515   4.844 -15.286
  191    HE1  PHE  26           HE1      PHE  26   1.379   3.093 -13.211
  192    HE2  PHE  26           HE2      PHE  26   3.678   4.018 -16.703
  193    HZ   PHE  26           HZ       PHE  26   1.602   3.165 -15.672
  194    H    ASP  27           H        ASP  27   8.337   4.767 -13.903
  195    HA   ASP  27           HA       ASP  27   7.956   2.879 -16.126
  196   1HB   ASP  27          1HB       ASP  27   9.923   5.114 -15.583
  197   2HB   ASP  27          2HB       ASP  27  10.395   3.909 -16.759
  198    H    MET  28           H        MET  28  10.118   3.037 -13.359
  199    HA   MET  28           HA       MET  28  12.035   0.912 -14.111
  200   1HB   MET  28          1HB       MET  28  11.314   1.455 -11.195
  201   2HB   MET  28          2HB       MET  28  12.168   2.672 -12.124
  202   1HG   MET  28          1HG       MET  28  13.343  -0.127 -12.227
  203   2HG   MET  28          2HG       MET  28  13.458   0.745 -10.689
  204   1HE   MET  28          1HE       MET  28  15.236   2.443 -10.134
  205   2HE   MET  28          2HE       MET  28  15.815   3.683 -11.286
  206   3HE   MET  28          3HE       MET  28  14.082   3.611 -10.853
  207    H    PHE  29           H        PHE  29   8.919   1.010 -12.429
  208    HA   PHE  29           HA       PHE  29   8.766  -1.814 -11.595
  209   1HB   PHE  29          1HB       PHE  29   6.308  -0.096 -12.244
  210   2HB   PHE  29          2HB       PHE  29   7.272   0.213 -10.825
  211    HD1  PHE  29           HD1      PHE  29   4.540  -0.383 -10.285
  212    HD2  PHE  29           HD2      PHE  29   7.681  -3.227 -11.044
  213    HE1  PHE  29           HE1      PHE  29   3.283  -2.115  -9.070
  214    HE2  PHE  29           HE2      PHE  29   6.410  -4.940  -9.819
  215    HZ   PHE  29           HZ       PHE  29   4.205  -4.397  -8.850
  216    H    ASP  30           H        ASP  30   7.918  -0.015 -14.515
  217    HA   ASP  30           HA       ASP  30   6.600  -2.309 -15.914
  218   1HB   ASP  30          1HB       ASP  30   6.147   0.276 -16.268
  219   2HB   ASP  30          2HB       ASP  30   7.527   0.223 -17.341
  220    H    ALA  31           H        ALA  31   7.435  -2.959 -18.096
  221    HA   ALA  31           HA       ALA  31  10.447  -3.022 -18.412
  222   1HB   ALA  31          1HB       ALA  31  10.587  -5.513 -18.403
  223   2HB   ALA  31          2HB       ALA  31  10.058  -4.880 -16.833
  224   3HB   ALA  31          3HB       ALA  31   8.876  -5.639 -17.931
  225    H    ASP  32           H        ASP  32   7.947  -2.110 -19.831
  226    HA   ASP  32           HA       ASP  32   8.191  -3.667 -22.455
  227   1HB   ASP  32          1HB       ASP  32   5.798  -2.551 -21.039
  228   2HB   ASP  32          2HB       ASP  32   5.846  -2.204 -22.752
  229    H    GLY  33           H        GLY  33   6.996  -0.415 -21.571
  230   1HA   GLY  33          1HA       GLY  33   8.857   1.488 -22.277
  231   2HA   GLY  33          2HA       GLY  33   8.591   0.786 -23.856
  232    H    GLY  34           H        GLY  34   5.740   0.255 -23.377
  233   1HA   GLY  34          1HA       GLY  34   3.624   1.327 -23.876
  234   2HA   GLY  34          2HA       GLY  34   4.586   2.680 -24.488
  235    H    GLY  35           H        GLY  35   3.476   1.216 -21.441
  236   1HA   GLY  35          1HA       GLY  35   2.470   3.739 -20.238
  237   2HA   GLY  35          2HA       GLY  35   4.082   3.370 -19.609
  238    H    ASP  36           H        ASP  36   1.164   1.468 -20.404
  239    HA   ASP  36           HA       ASP  36   0.432   0.830 -17.643
  240   1HB   ASP  36          1HB       ASP  36  -0.488  -1.126 -19.725
  241   2HB   ASP  36          2HB       ASP  36  -1.377  -0.319 -18.455
  242    H    ILE  37           H        ILE  37   0.633  -1.100 -16.503
  243    HA   ILE  37           HA       ILE  37   3.099  -2.776 -17.146
  244    HB   ILE  37           HB       ILE  37   1.817  -3.231 -14.507
  245   1HG1  ILE  37          1HG1      ILE  37   2.409  -0.439 -15.221
  246   2HG1  ILE  37          2HG1      ILE  37   1.656  -1.096 -13.780
  247   1HG2  ILE  37          1HG2      ILE  37   4.150  -3.444 -13.743
  248   2HG2  ILE  37          2HG2      ILE  37   3.924  -4.364 -15.237
  249   3HG2  ILE  37          3HG2      ILE  37   4.763  -2.795 -15.284
  250   1HD1  ILE  37          1HD1      ILE  37   4.694  -0.785 -14.169
  251   2HD1  ILE  37          2HD1      ILE  37   3.632   0.165 -13.106
  252   3HD1  ILE  37          3HD1      ILE  37   3.924  -1.554 -12.754
  253    H    SER  38           H        SER  38   2.847  -5.098 -16.194
  254    HA   SER  38           HA       SER  38   0.124  -6.310 -16.877
  255   1HB   SER  38          1HB       SER  38   0.837  -7.593 -18.618
  256   2HB   SER  38          2HB       SER  38   2.036  -6.310 -18.802
  257    HG   SER  38           HG       SER  38   2.663  -8.659 -18.638
  258    H    THR  39           H        THR  39   0.744  -8.924 -16.613
  259    HA   THR  39           HA       THR  39   1.078  -9.273 -13.665
  260    HB   THR  39           HB       THR  39   0.929 -11.850 -14.491
  261    HG1  THR  39           HG1      THR  39  -0.099 -12.061 -16.318
  262   1HG2  THR  39          1HG2      THR  39  -1.502 -11.802 -14.148
  263   2HG2  THR  39          2HG2      THR  39  -0.739 -10.715 -12.964
  264   3HG2  THR  39          3HG2      THR  39  -1.565 -10.041 -14.394
  265    H    LYS  40           H        LYS  40   2.614 -11.024 -16.393
  266    HA   LYS  40           HA       LYS  40   4.903 -12.040 -15.030
  267   1HB   LYS  40          1HB       LYS  40   4.192 -12.762 -17.271
  268   2HB   LYS  40          2HB       LYS  40   4.678 -11.256 -18.005
  269   1HG   LYS  40          1HG       LYS  40   6.321 -13.589 -16.920
  270   2HG   LYS  40          2HG       LYS  40   7.081 -12.020 -16.887
  271   1HD   LYS  40          1HD       LYS  40   6.378 -12.026 -19.550
  272   2HD   LYS  40          2HD       LYS  40   7.881 -12.596 -18.887
  273   1HE   LYS  40          1HE       LYS  40   7.144 -14.255 -20.460
  274   2HE   LYS  40          2HE       LYS  40   7.087 -14.977 -18.857
  275   1HZ   LYS  40          1HZ       LYS  40   4.597 -14.275 -18.961
  276   2HZ   LYS  40          2HZ       LYS  40   5.085 -15.585 -19.842
  277   3HZ   LYS  40          3HZ       LYS  40   4.839 -14.132 -20.589
  278    H    GLU  41           H        GLU  41   4.310  -8.875 -16.466
  279    HA   GLU  41           HA       GLU  41   6.966  -7.688 -16.327
  280   1HB   GLU  41          1HB       GLU  41   4.611  -5.883 -15.842
  281   2HB   GLU  41          2HB       GLU  41   4.590  -6.822 -17.319
  282   1HG   GLU  41          1HG       GLU  41   6.344  -4.495 -16.562
  283   2HG   GLU  41          2HG       GLU  41   7.169  -5.776 -17.424
  284    H    LEU  42           H        LEU  42   4.257  -7.684 -14.007
  285    HA   LEU  42           HA       LEU  42   5.307  -6.002 -11.931
  286   1HB   LEU  42          1HB       LEU  42   3.222  -8.135 -12.075
  287   2HB   LEU  42          2HB       LEU  42   3.949  -8.009 -10.489
  288    HG   LEU  42           HG       LEU  42   3.330  -5.298 -11.327
  289   1HD1  LEU  42          1HD1      LEU  42   1.873  -7.035  -9.239
  290   2HD1  LEU  42          2HD1      LEU  42   3.438  -6.260  -8.952
  291   3HD1  LEU  42          3HD1      LEU  42   2.000  -5.257  -9.266
  292   1HD2  LEU  42          1HD2      LEU  42   0.894  -5.370 -11.727
  293   2HD2  LEU  42          2HD2      LEU  42   1.684  -6.394 -12.952
  294   3HD2  LEU  42          3HD2      LEU  42   0.868  -7.146 -11.569
  295    H    GLY  43           H        GLY  43   5.943  -9.389 -12.673
  296   1HA   GLY  43          1HA       GLY  43   7.433 -10.052 -10.181
  297   2HA   GLY  43          2HA       GLY  43   7.340 -11.066 -11.626
  298    H    THR  44           H        THR  44   8.254  -9.022 -13.462
  299    HA   THR  44           HA       THR  44  10.999  -9.725 -13.705
  300    HB   THR  44           HB       THR  44   9.449  -7.388 -14.862
  301    HG1  THR  44           HG1      THR  44   9.389  -9.650 -15.546
  302   1HG2  THR  44          1HG2      THR  44  11.380  -6.814 -16.343
  303   2HG2  THR  44          2HG2      THR  44  11.737  -6.429 -14.646
  304   3HG2  THR  44          3HG2      THR  44  12.443  -7.884 -15.396
  305    H    VAL  45           H        VAL  45   9.692  -6.671 -12.386
  306    HA   VAL  45           HA       VAL  45  12.288  -5.513 -11.627
  307    HB   VAL  45           HB       VAL  45   9.600  -4.580 -11.700
  308   1HG1  VAL  45          1HG1      VAL  45  12.074  -2.956 -10.840
  309   2HG1  VAL  45          2HG1      VAL  45  11.747  -3.411 -12.516
  310   3HG1  VAL  45          3HG1      VAL  45  10.605  -2.357 -11.653
  311   1HG2  VAL  45          1HG2      VAL  45   9.218  -3.368  -9.618
  312   2HG2  VAL  45          2HG2      VAL  45   9.485  -5.067  -9.164
  313   3HG2  VAL  45          3HG2      VAL  45  10.782  -3.886  -8.938
  314    H    MET  46           H        MET  46   9.920  -7.579 -10.035
  315    HA   MET  46           HA       MET  46  10.792  -7.342  -7.261
  316   1HB   MET  46          1HB       MET  46   9.367  -9.658  -8.689
  317   2HB   MET  46          2HB       MET  46   9.753  -9.687  -6.978
  318   1HG   MET  46          1HG       MET  46   8.431  -7.197  -7.239
  319   2HG   MET  46          2HG       MET  46   7.563  -8.239  -8.379
  320   1HE   MET  46          1HE       MET  46   7.317 -11.092  -7.469
  321   2HE   MET  46          2HE       MET  46   6.017 -11.067  -6.242
  322   3HE   MET  46          3HE       MET  46   5.856 -10.089  -7.729
  323    NH1  ARG  47           NH1      ARG  47  16.509 -11.106 -15.452
  324    NH2  ARG  47           NH2      ARG  47  16.747 -13.150 -14.487
  325    H    ARG  47           H        ARG  47  11.945  -9.241  -9.989
  326    HA   ARG  47           HA       ARG  47  13.570 -11.264  -8.751
  327   1HB   ARG  47          1HB       ARG  47  13.071 -10.607 -11.353
  328   2HB   ARG  47          2HB       ARG  47  14.298 -11.750 -10.824
  329   1HG   ARG  47          1HG       ARG  47  14.927  -8.775 -11.299
  330   2HG   ARG  47          2HG       ARG  47  16.087 -10.063 -10.977
  331   1HD   ARG  47          1HD       ARG  47  14.266  -9.975 -13.481
  332   2HD   ARG  47          2HD       ARG  47  15.929  -9.412 -13.432
  333    HE   ARG  47           HE       ARG  47  15.694 -12.244 -12.532
  334   1HH1  ARG  47          1HH1      ARG  47  16.179 -10.139 -15.360
  335   2HH1  ARG  47          2HH1      ARG  47  16.962 -11.526 -16.271
  336   1HH2  ARG  47          1HH2      ARG  47  16.601 -13.743 -13.662
  337   2HH2  ARG  47          2HH2      ARG  47  17.183 -13.427 -15.373
  338    H    MET  48           H        MET  48  14.156  -7.831  -9.198
  339    HA   MET  48           HA       MET  48  16.975  -7.519  -9.006
  340   1HB   MET  48          1HB       MET  48  14.759  -5.743  -7.848
  341   2HB   MET  48          2HB       MET  48  16.456  -5.338  -7.668
  342   1HG   MET  48          1HG       MET  48  15.039  -5.746 -10.388
  343   2HG   MET  48          2HG       MET  48  15.359  -4.176  -9.634
  344   1HE   MET  48          1HE       MET  48  16.364  -5.058 -12.632
  345   2HE   MET  48          2HE       MET  48  17.989  -5.802 -12.698
  346   3HE   MET  48          3HE       MET  48  16.594  -6.758 -12.118
  347    H    LEU  49           H        LEU  49  14.633  -7.977  -6.365
  348    HA   LEU  49           HA       LEU  49  16.240  -7.760  -4.023
  349   1HB   LEU  49          1HB       LEU  49  14.759  -9.653  -3.040
  350   2HB   LEU  49          2HB       LEU  49  13.988  -9.766  -4.607
  351    HG   LEU  49           HG       LEU  49  13.837  -7.495  -2.572
  352   1HD1  LEU  49          1HD1      LEU  49  11.631  -8.892  -4.214
  353   2HD1  LEU  49          2HD1      LEU  49  12.127  -9.386  -2.585
  354   3HD1  LEU  49          3HD1      LEU  49  11.403  -7.779  -2.840
  355   1HD2  LEU  49          1HD2      LEU  49  12.832  -5.941  -4.193
  356   2HD2  LEU  49          2HD2      LEU  49  14.417  -6.427  -4.843
  357   3HD2  LEU  49          3HD2      LEU  49  12.940  -7.142  -5.505
  358    H    GLY  50           H        GLY  50  15.553 -10.869  -5.663
  359   1HA   GLY  50          1HA       GLY  50  17.681 -12.388  -4.309
  360   2HA   GLY  50          2HA       GLY  50  18.287 -11.874  -5.890
  361    H    GLN  51           H        GLN  51  15.245 -13.189  -4.556
  362    HA   GLN  51           HA       GLN  51  15.211 -15.546  -6.442
  363   1HB   GLN  51          1HB       GLN  51  14.305 -16.287  -4.469
  364   2HB   GLN  51          2HB       GLN  51  12.833 -15.816  -5.299
  365   1HG   GLN  51          1HG       GLN  51  14.155 -14.563  -2.892
  366   2HG   GLN  51          2HG       GLN  51  13.399 -13.436  -3.996
  367   1HE2  GLN  51          1HE2      GLN  51  10.029 -14.940  -3.373
  368   2HE2  GLN  51          2HE2      GLN  51  11.077 -14.387  -4.774
  369    H    ASN  52           H        ASN  52  13.325 -15.916  -7.808
  370    HA   ASN  52           HA       ASN  52  11.872 -13.446  -8.782
  371   1HB   ASN  52          1HB       ASN  52  14.088 -13.899 -10.105
  372   2HB   ASN  52          2HB       ASN  52  13.270 -15.263 -10.835
  373   1HD2  ASN  52          1HD2      ASN  52  12.621 -12.564 -13.253
  374   2HD2  ASN  52          2HD2      ASN  52  13.680 -14.001 -12.830
  375    HA   PRO  53           HA       PRO  53   8.798 -17.117  -8.311
  376   1HB   PRO  53          1HB       PRO  53   6.913 -14.762  -8.691
  377   2HB   PRO  53          2HB       PRO  53   6.891 -16.102  -7.535
  378   1HG   PRO  53          1HG       PRO  53   7.713 -13.583  -6.809
  379   2HG   PRO  53          2HG       PRO  53   8.318 -15.040  -5.987
  380   1HD   PRO  53          1HD       PRO  53  10.439 -14.281  -6.764
  381   2HD   PRO  53          2HD       PRO  53   9.712 -13.234  -8.018
  382    H    THR  54           H        THR  54   7.090 -17.795  -9.839
  383    HA   THR  54           HA       THR  54   7.862 -17.228 -12.721
  384    HB   THR  54           HB       THR  54   7.683 -19.631 -11.697
  385    HG1  THR  54           HG1      THR  54   7.490 -20.306 -13.679
  386   1HG2  THR  54          1HG2      THR  54   5.529 -20.795 -12.049
  387   2HG2  THR  54          2HG2      THR  54   5.329 -19.520 -10.824
  388   3HG2  THR  54          3HG2      THR  54   4.723 -19.268 -12.481
  389    H    LYS  55           H        LYS  55   5.717 -17.672 -14.155
  390    HA   LYS  55           HA       LYS  55   4.242 -15.145 -14.026
  391   1HB   LYS  55          1HB       LYS  55   4.621 -16.215 -16.195
  392   2HB   LYS  55          2HB       LYS  55   3.804 -17.686 -15.707
  393   1HG   LYS  55          1HG       LYS  55   1.672 -16.111 -15.429
  394   2HG   LYS  55          2HG       LYS  55   2.566 -14.992 -16.442
  395   1HD   LYS  55          1HD       LYS  55   0.889 -16.687 -17.599
  396   2HD   LYS  55          2HD       LYS  55   2.449 -16.390 -18.348
  397   1HE   LYS  55          1HE       LYS  55   3.232 -18.519 -16.896
  398   2HE   LYS  55          2HE       LYS  55   1.512 -18.900 -16.887
  399   1HZ   LYS  55          1HZ       LYS  55   2.003 -19.854 -18.858
  400   2HZ   LYS  55          2HZ       LYS  55   3.411 -19.016 -19.070
  401   3HZ   LYS  55          3HZ       LYS  55   1.970 -18.335 -19.506
  402    H    GLU  56           H        GLU  56   3.609 -18.423 -12.915
  403    HA   GLU  56           HA       GLU  56   0.782 -18.447 -12.509
  404   1HB   GLU  56          1HB       GLU  56   1.868 -20.505 -12.216
  405   2HB   GLU  56          2HB       GLU  56   3.055 -19.874 -11.092
  406   1HG   GLU  56          1HG       GLU  56   0.778 -19.485  -9.573
  407   2HG   GLU  56          2HG       GLU  56   1.773 -20.930  -9.509
  408    H    GLU  57           H        GLU  57   3.218 -17.734  -9.981
  409    HA   GLU  57           HA       GLU  57   1.495 -16.885  -7.871
  410   1HB   GLU  57          1HB       GLU  57   4.082 -15.370  -8.091
  411   2HB   GLU  57          2HB       GLU  57   4.193 -17.117  -8.075
  412   1HG   GLU  57          1HG       GLU  57   3.956 -15.356  -5.821
  413   2HG   GLU  57          2HG       GLU  57   2.404 -16.182  -5.886
  414    H    LEU  58           H        LEU  58   3.000 -14.858 -10.398
  415    HA   LEU  58           HA       LEU  58   2.123 -12.270  -9.520
  416   1HB   LEU  58          1HB       LEU  58   2.826 -13.346 -12.297
  417   2HB   LEU  58          2HB       LEU  58   2.330 -11.681 -12.071
  418    HG   LEU  58           HG       LEU  58   4.651 -12.901 -10.458
  419   1HD1  LEU  58          1HD1      LEU  58   6.244 -11.891 -12.138
  420   2HD1  LEU  58          2HD1      LEU  58   5.280 -13.184 -12.865
  421   3HD1  LEU  58          3HD1      LEU  58   4.876 -11.483 -13.204
  422   1HD2  LEU  58          1HD2      LEU  58   3.968  -9.973 -11.164
  423   2HD2  LEU  58          2HD2      LEU  58   3.712 -10.757  -9.586
  424   3HD2  LEU  58          3HD2      LEU  58   5.360 -10.521 -10.197
  425    H    ASP  59           H        ASP  59   0.511 -14.703 -11.517
  426    HA   ASP  59           HA       ASP  59  -1.714 -13.201 -12.565
  427   1HB   ASP  59          1HB       ASP  59  -1.708 -16.190 -11.850
  428   2HB   ASP  59          2HB       ASP  59  -1.119 -15.498 -13.344
  429    H    ALA  60           H        ALA  60  -1.275 -14.814  -9.448
  430    HA   ALA  60           HA       ALA  60  -4.006 -14.412  -8.402
  431   1HB   ALA  60          1HB       ALA  60  -3.039 -15.082  -6.207
  432   2HB   ALA  60          2HB       ALA  60  -2.527 -16.180  -7.504
  433   3HB   ALA  60          3HB       ALA  60  -1.389 -14.967  -6.863
  434    H    ILE  61           H        ILE  61  -1.001 -12.569  -8.324
  435    HA   ILE  61           HA       ILE  61  -1.564 -10.675  -6.200
  436    HB   ILE  61           HB       ILE  61   0.434 -10.869  -8.365
  437   1HG1  ILE  61          1HG1      ILE  61   0.382 -10.790  -5.490
  438   2HG1  ILE  61          2HG1      ILE  61   1.760 -11.054  -6.538
  439   1HG2  ILE  61          1HG2      ILE  61   1.142  -8.459  -8.386
  440   2HG2  ILE  61          2HG2      ILE  61  -0.471  -8.638  -9.073
  441   3HG2  ILE  61          3HG2      ILE  61  -0.285  -8.013  -7.418
  442   1HD1  ILE  61          1HD1      ILE  61   0.889  -8.294  -5.495
  443   2HD1  ILE  61          2HD1      ILE  61   2.308  -9.245  -5.005
  444   3HD1  ILE  61          3HD1      ILE  61   2.220  -8.574  -6.651
  445    H    ILE  62           H        ILE  62  -2.103 -10.446  -9.727
  446    HA   ILE  62           HA       ILE  62  -3.493  -7.815  -9.608
  447    HB   ILE  62           HB       ILE  62  -2.716  -9.725 -11.776
  448   1HG1  ILE  62          1HG1      ILE  62  -2.841  -6.681 -12.053
  449   2HG1  ILE  62          2HG1      ILE  62  -1.647  -7.370 -10.974
  450   1HG2  ILE  62          1HG2      ILE  62  -4.233  -8.721 -13.507
  451   2HG2  ILE  62          2HG2      ILE  62  -5.178  -9.560 -12.278
  452   3HG2  ILE  62          3HG2      ILE  62  -5.080  -7.784 -12.250
  453   1HD1  ILE  62          1HD1      ILE  62  -1.810  -7.980 -13.985
  454   2HD1  ILE  62          2HD1      ILE  62  -0.592  -7.007 -13.135
  455   3HD1  ILE  62          3HD1      ILE  62  -0.677  -8.760 -12.847
  456    H    GLU  63           H        GLU  63  -4.375 -11.235  -9.739
  457    HA   GLU  63           HA       GLU  63  -7.195 -11.179 -10.148
  458   1HB   GLU  63          1HB       GLU  63  -5.687 -13.234  -9.828
  459   2HB   GLU  63          2HB       GLU  63  -5.871 -13.028  -8.097
  460   1HG   GLU  63          1HG       GLU  63  -8.292 -13.467  -8.213
  461   2HG   GLU  63          2HG       GLU  63  -8.303 -13.342  -9.964
  462    H    GLU  64           H        GLU  64  -5.314 -10.362  -7.281
  463    HA   GLU  64           HA       GLU  64  -7.451 -10.263  -5.293
  464   1HB   GLU  64          1HB       GLU  64  -5.594 -10.195  -4.053
  465   2HB   GLU  64          2HB       GLU  64  -4.601  -9.624  -5.380
  466   1HG   GLU  64          1HG       GLU  64  -6.397  -7.586  -3.988
  467   2HG   GLU  64          2HG       GLU  64  -4.848  -7.340  -4.776
  468    H    VAL  65           H        VAL  65  -5.710  -7.462  -6.685
  469    HA   VAL  65           HA       VAL  65  -8.208  -5.745  -6.317
  470    HB   VAL  65           HB       VAL  65  -6.559  -4.725  -5.049
  471   1HG1  VAL  65          1HG1      VAL  65  -6.198  -3.210  -7.715
  472   2HG1  VAL  65          2HG1      VAL  65  -7.663  -3.114  -6.719
  473   3HG1  VAL  65          3HG1      VAL  65  -6.108  -2.544  -6.066
  474   1HG2  VAL  65          1HG2      VAL  65  -4.188  -4.397  -5.556
  475   2HG2  VAL  65          2HG2      VAL  65  -4.555  -6.095  -5.945
  476   3HG2  VAL  65          3HG2      VAL  65  -4.399  -4.910  -7.248
  477    H    ASP  66           H        ASP  66  -9.359  -5.735  -8.122
  478    HA   ASP  66           HA       ASP  66  -8.523  -4.471 -10.611
  479   1HB   ASP  66          1HB       ASP  66  -7.528  -7.132 -10.490
  480   2HB   ASP  66          2HB       ASP  66  -8.941  -7.251 -11.513
  481    H    GLU  67           H        GLU  67 -10.566  -3.951  -9.141
  482    HA   GLU  67           HA       GLU  67 -13.073  -5.440  -9.896
  483   1HB   GLU  67          1HB       GLU  67 -14.216  -4.158  -8.271
  484   2HB   GLU  67          2HB       GLU  67 -13.062  -2.838  -8.314
  485   1HG   GLU  67          1HG       GLU  67 -11.490  -3.979  -6.919
  486   2HG   GLU  67          2HG       GLU  67 -12.094  -5.571  -7.343
  487    H    ASP  68           H        ASP  68 -11.395  -3.933 -11.919
  488    HA   ASP  68           HA       ASP  68 -13.542  -2.038 -13.001
  489   1HB   ASP  68          1HB       ASP  68 -11.264  -0.992 -12.369
  490   2HB   ASP  68          2HB       ASP  68 -11.961  -0.595 -13.922
  491    H    GLY  69           H        GLY  69 -11.149  -4.549 -13.758
  492   1HA   GLY  69          1HA       GLY  69 -11.616  -6.498 -15.267
  493   2HA   GLY  69          2HA       GLY  69 -12.908  -5.558 -16.027
  494    H    SER  70           H        SER  70  -9.386  -5.688 -15.639
  495    HA   SER  70           HA       SER  70  -8.981  -4.655 -18.488
  496   1HB   SER  70          1HB       SER  70  -8.698  -2.612 -17.399
  497   2HB   SER  70          2HB       SER  70  -7.038  -3.204 -17.503
  498    HG   SER  70           HG       SER  70  -7.024  -3.641 -15.416
  499    H    GLY  71           H        GLY  71  -7.412  -5.912 -15.526
  500   1HA   GLY  71          1HA       GLY  71  -5.963  -8.099 -16.995
  501   2HA   GLY  71          2HA       GLY  71  -5.884  -7.794 -15.255
  502    H    THR  72           H        THR  72  -5.276  -4.959 -15.554
  503    HA   THR  72           HA       THR  72  -2.298  -5.151 -15.773
  504    HB   THR  72           HB       THR  72  -2.014  -3.279 -17.403
  505    HG1  THR  72           HG1      THR  72  -4.648  -3.799 -18.231
  506   1HG2  THR  72          1HG2      THR  72  -2.351  -4.525 -19.499
  507   2HG2  THR  72          2HG2      THR  72  -1.717  -5.637 -18.266
  508   3HG2  THR  72          3HG2      THR  72  -3.443  -5.688 -18.713
  509    H    ILE  73           H        ILE  73  -1.278  -3.497 -14.685
  510    HA   ILE  73           HA       ILE  73  -3.030  -1.746 -12.903
  511    HB   ILE  73           HB       ILE  73  -0.117  -2.621 -12.571
  512   1HG1  ILE  73          1HG1      ILE  73  -2.246  -4.222 -12.059
  513   2HG1  ILE  73          2HG1      ILE  73  -2.351  -3.271 -10.592
  514   1HG2  ILE  73          1HG2      ILE  73  -0.086  -1.433 -10.382
  515   2HG2  ILE  73          2HG2      ILE  73  -0.441  -0.279 -11.674
  516   3HG2  ILE  73          3HG2      ILE  73  -1.752  -0.856 -10.618
  517   1HD1  ILE  73          1HD1      ILE  73  -0.067  -3.915  -9.872
  518   2HD1  ILE  73          2HD1      ILE  73  -1.049  -5.353 -10.222
  519   3HD1  ILE  73          3HD1      ILE  73   0.182  -4.819 -11.391
  520    H    ASP  74           H        ASP  74  -3.453  -0.385 -14.753
  521    HA   ASP  74           HA       ASP  74  -1.469   1.140 -16.233
  522   1HB   ASP  74          1HB       ASP  74  -3.573   2.914 -16.234
  523   2HB   ASP  74          2HB       ASP  74  -3.366   1.581 -17.347
  524    H    PHE  75           H        PHE  75  -1.586   3.699 -16.002
  525    HA   PHE  75           HA       PHE  75  -0.118   4.400 -13.545
  526   1HB   PHE  75          1HB       PHE  75  -1.267   6.374 -15.607
  527   2HB   PHE  75          2HB       PHE  75   0.189   5.454 -15.880
  528    HD1  PHE  75           HD1      PHE  75  -1.329   8.093 -13.681
  529    HD2  PHE  75           HD2      PHE  75   2.313   6.114 -14.837
  530    HE1  PHE  75           HE1      PHE  75  -0.012   9.809 -12.509
  531    HE2  PHE  75           HE2      PHE  75   3.612   7.838 -13.652
  532    HZ   PHE  75           HZ       PHE  75   2.457   9.696 -12.508
  533    H    GLU  76           H        GLU  76  -3.406   4.917 -14.746
  534    HA   GLU  76           HA       GLU  76  -4.359   6.785 -12.702
  535   1HB   GLU  76          1HB       GLU  76  -6.385   4.954 -13.940
  536   2HB   GLU  76          2HB       GLU  76  -6.434   6.679 -13.645
  537   1HG   GLU  76          1HG       GLU  76  -5.988   7.067 -15.835
  538   2HG   GLU  76          2HG       GLU  76  -4.408   6.336 -15.645
  539    H    GLU  77           H        GLU  77  -4.494   3.248 -13.005
  540    HA   GLU  77           HA       GLU  77  -5.959   2.781 -10.451
  541   1HB   GLU  77          1HB       GLU  77  -6.417   0.893 -11.526
  542   2HB   GLU  77          2HB       GLU  77  -5.174   1.172 -12.724
  543   1HG   GLU  77          1HG       GLU  77  -4.298   0.059 -10.020
  544   2HG   GLU  77          2HG       GLU  77  -3.560  -0.174 -11.600
  545    H    PHE  78           H        PHE  78  -2.617   3.031 -11.441
  546    HA   PHE  78           HA       PHE  78  -1.303   1.742  -9.186
  547   1HB   PHE  78          1HB       PHE  78  -0.104   2.330 -11.291
  548   2HB   PHE  78          2HB       PHE  78  -0.287   4.037 -10.982
  549    HD1  PHE  78           HD1      PHE  78   0.952   5.016  -8.859
  550    HD2  PHE  78           HD2      PHE  78   1.719   1.060 -10.367
  551    HE1  PHE  78           HE1      PHE  78   3.129   4.987  -7.709
  552    HE2  PHE  78           HE2      PHE  78   3.889   1.047  -9.206
  553    HZ   PHE  78           HZ       PHE  78   4.596   3.004  -7.873
  554    H    LEU  79           H        LEU  79  -2.096   5.176  -9.779
  555    HA   LEU  79           HA       LEU  79  -1.087   6.270  -7.273
  556   1HB   LEU  79          1HB       LEU  79  -3.337   7.369  -9.062
  557   2HB   LEU  79          2HB       LEU  79  -2.602   8.252  -7.741
  558    HG   LEU  79           HG       LEU  79  -1.251   7.397 -10.367
  559   1HD1  LEU  79          1HD1      LEU  79  -0.978   9.852 -10.720
  560   2HD1  LEU  79          2HD1      LEU  79  -2.689   9.438 -10.509
  561   3HD1  LEU  79          3HD1      LEU  79  -1.789  10.193  -9.170
  562   1HD2  LEU  79          1HD2      LEU  79   0.114   8.743  -7.938
  563   2HD2  LEU  79          2HD2      LEU  79   0.459   7.111  -8.565
  564   3HD2  LEU  79          3HD2      LEU  79   0.842   8.530  -9.550
  565    H    VAL  80           H        VAL  80  -4.222   4.923  -8.203
  566    HA   VAL  80           HA       VAL  80  -5.713   5.627  -5.742
  567    HB   VAL  80           HB       VAL  80  -6.708   5.007  -8.045
  568   1HG1  VAL  80          1HG1      VAL  80  -8.062   3.657  -5.627
  569   2HG1  VAL  80          2HG1      VAL  80  -8.039   5.409  -5.865
  570   3HG1  VAL  80          3HG1      VAL  80  -8.843   4.369  -7.063
  571   1HG2  VAL  80          1HG2      VAL  80  -7.369   2.687  -8.478
  572   2HG2  VAL  80          2HG2      VAL  80  -5.602   2.694  -8.275
  573   3HG2  VAL  80          3HG2      VAL  80  -6.635   2.121  -6.957
  574    H    MET  81           H        MET  81  -3.651   2.980  -6.804
  575    HA   MET  81           HA       MET  81  -4.222   0.947  -4.772
  576   1HB   MET  81          1HB       MET  81  -2.782   0.692  -6.937
  577   2HB   MET  81          2HB       MET  81  -1.460   1.385  -6.015
  578   1HG   MET  81          1HG       MET  81  -1.084  -0.936  -5.758
  579   2HG   MET  81          2HG       MET  81  -1.921  -0.537  -4.248
  580   1HE   MET  81          1HE       MET  81  -2.353  -3.186  -4.053
  581   2HE   MET  81          2HE       MET  81  -3.376  -4.116  -5.188
  582   3HE   MET  81          3HE       MET  81  -1.750  -3.575  -5.695
  583    H    MET  82           H        MET  82  -1.589   3.367  -4.939
  584    HA   MET  82           HA       MET  82  -0.508   2.826  -2.260
  585   1HB   MET  82          1HB       MET  82   0.552   5.240  -2.658
  586   2HB   MET  82          2HB       MET  82  -0.096   5.073  -4.279
  587   1HG   MET  82          1HG       MET  82   2.104   4.235  -4.523
  588   2HG   MET  82          2HG       MET  82   1.159   2.749  -4.360
  589   1HE   MET  82          1HE       MET  82   3.986   1.580  -3.381
  590   2HE   MET  82          2HE       MET  82   2.282   1.056  -3.528
  591   3HE   MET  82          3HE       MET  82   3.134   0.885  -1.966
  592    H    VAL  83           H        VAL  83  -2.965   5.011  -3.517
  593    HA   VAL  83           HA       VAL  83  -3.138   6.918  -1.306
  594    HB   VAL  83           HB       VAL  83  -4.818   6.302  -3.692
  595   1HG1  VAL  83          1HG1      VAL  83  -6.802   7.615  -2.923
  596   2HG1  VAL  83          2HG1      VAL  83  -6.621   6.140  -1.963
  597   3HG1  VAL  83          3HG1      VAL  83  -6.132   7.705  -1.274
  598   1HG2  VAL  83          1HG2      VAL  83  -4.050   8.978  -2.347
  599   2HG2  VAL  83          2HG2      VAL  83  -3.204   8.225  -3.718
  600   3HG2  VAL  83          3HG2      VAL  83  -4.867   8.794  -3.920
  601    NH1  ARG  84           NH1      ARG  84  -9.970  -1.042  -0.934
  602    NH2  ARG  84           NH2      ARG  84  -8.891  -2.212   0.687
  603    H    ARG  84           H        ARG  84  -4.589   3.766  -1.950
  604    HA   ARG  84           HA       ARG  84  -6.758   3.608  -0.059
  605   1HB   ARG  84          1HB       ARG  84  -5.290   1.723  -1.685
  606   2HB   ARG  84          2HB       ARG  84  -5.294   1.079  -0.050
  607   1HG   ARG  84          1HG       ARG  84  -7.706   1.032   0.093
  608   2HG   ARG  84          2HG       ARG  84  -7.908   2.052  -1.333
  609   1HD   ARG  84          1HD       ARG  84  -8.132   0.145  -2.564
  610   2HD   ARG  84          2HD       ARG  84  -6.400  -0.124  -2.358
  611    HE   ARG  84           HE       ARG  84  -6.938  -1.946  -0.869
  612   1HH1  ARG  84          1HH1      ARG  84  -7.996  -2.513   1.088
  613   2HH1  ARG  84          2HH1      ARG  84  -9.828  -2.417   1.050
  614   1HH2  ARG  84          1HH2      ARG  84  -9.898  -0.427  -1.752
  615   2HH2  ARG  84          2HH2      ARG  84 -10.832  -1.360  -0.478
  616    H    GLN  85           H        GLN  85  -3.351   2.604   0.439
  617    HA   GLN  85           HA       GLN  85  -3.612   1.931   3.290
  618   1HB   GLN  85          1HB       GLN  85  -0.906   2.494   3.000
  619   2HB   GLN  85          2HB       GLN  85  -1.360   2.193   1.333
  620   1HG   GLN  85          1HG       GLN  85  -2.577   0.014   2.531
  621   2HG   GLN  85          2HG       GLN  85  -0.988  -0.002   1.797
  622   1HE2  GLN  85          1HE2      GLN  85  -0.761   0.576   5.905
  623   2HE2  GLN  85          2HE2      GLN  85  -1.624   1.767   4.808
  624    H    MET  86           H        MET  86  -2.767   4.852   1.500
  625    HA   MET  86           HA       MET  86  -1.626   6.546   3.513
  626   1HB   MET  86          1HB       MET  86  -2.785   6.967   0.864
  627   2HB   MET  86          2HB       MET  86  -3.373   8.221   1.940
  628   1HG   MET  86          1HG       MET  86  -0.602   8.154   2.551
  629   2HG   MET  86          2HG       MET  86  -0.646   7.844   0.808
  630   1HE   MET  86          1HE       MET  86  -3.160   9.303  -0.376
  631   2HE   MET  86          2HE       MET  86  -2.537  10.952  -0.680
  632   3HE   MET  86          3HE       MET  86  -1.519   9.531  -1.059
  633    H    LYS  87           H        LYS  87  -4.986   5.693   2.870
  634    HA   LYS  87           HA       LYS  87  -6.467   7.612   4.410
  635   1HB   LYS  87          1HB       LYS  87  -7.041   4.654   3.850
  636   2HB   LYS  87          2HB       LYS  87  -8.080   5.579   4.923
  637   1HG   LYS  87          1HG       LYS  87  -7.653   5.955   1.934
  638   2HG   LYS  87          2HG       LYS  87  -8.170   7.339   2.883
  639   1HD   LYS  87          1HD       LYS  87 -10.313   6.492   3.198
  640   2HD   LYS  87          2HD       LYS  87  -9.900   5.683   1.691
  641   1HE   LYS  87          1HE       LYS  87  -9.276   4.233   4.319
  642   2HE   LYS  87          2HE       LYS  87 -10.947   4.276   3.743
  643   1HZ   LYS  87          1HZ       LYS  87 -10.452   2.937   1.995
  644   2HZ   LYS  87          2HZ       LYS  87  -9.205   2.445   2.962
  645   3HZ   LYS  87          3HZ       LYS  87  -8.932   3.541   1.756
  646    H    GLU  88           H        GLU  88  -5.672   4.320   5.575
  647    HA   GLU  88           HA       GLU  88  -6.217   4.736   8.389
  648   1HB   GLU  88          1HB       GLU  88  -4.743   2.670   6.796
  649   2HB   GLU  88          2HB       GLU  88  -4.256   2.789   8.475
  650   1HG   GLU  88          1HG       GLU  88  -6.957   1.970   7.311
  651   2HG   GLU  88          2HG       GLU  88  -6.939   2.686   8.913
  652    H    ASP  89           H        ASP  89  -2.900   4.041   7.402
  653    HA   ASP  89           HA       ASP  89  -1.585   5.345   9.572
  654   1HB   ASP  89          1HB       ASP  89   0.369   5.575   7.606
  655   2HB   ASP  89          2HB       ASP  89  -0.654   4.340   6.910
  656    H    ALA  90           H        ALA  90  -1.721   7.351  10.173
  657    HA   ALA  90           HA       ALA  90  -1.705   9.632   8.113
  658   1HB   ALA  90          1HB       ALA  90  -3.042  10.988   9.745
  659   2HB   ALA  90          2HB       ALA  90  -3.912   9.508   9.297
  660   3HB   ALA  90          3HB       ALA  90  -3.104   9.617  10.880
   
  Start of MODEL          14
 Raw file had  660 H/Q atoms
  Start of MODEL   14
    1   1H    ALA   1          1H        ALA   1 -22.135  -0.670 -18.194
    2   2H    ALA   1          2H        ALA   1 -21.064  -1.111 -19.413
    3   3H    ALA   1          3H        ALA   1 -21.621  -2.266 -18.326
    4    HA   ALA   1           HA       ALA   1 -20.616  -0.787 -16.532
    5   1HB   ALA   1          1HB       ALA   1 -18.584  -2.283 -18.272
    6   2HB   ALA   1          2HB       ALA   1 -19.878  -3.166 -17.440
    7   3HB   ALA   1          3HB       ALA   1 -18.695  -2.225 -16.496
    8    H    SER   2           H        SER   2 -20.241   1.331 -16.582
    9    HA   SER   2           HA       SER   2 -18.041   2.487 -18.346
   10   1HB   SER   2          1HB       SER   2 -20.644   2.711 -19.217
   11   2HB   SER   2          2HB       SER   2 -20.508   4.190 -18.262
   12    HG   SER   2           HG       SER   2 -19.341   3.494 -20.615
   13    H    MET   3           H        MET   3 -17.413   2.104 -15.911
   14    HA   MET   3           HA       MET   3 -18.061   4.529 -14.182
   15   1HB   MET   3          1HB       MET   3 -16.450   2.035 -13.400
   16   2HB   MET   3          2HB       MET   3 -17.000   3.306 -12.323
   17   1HG   MET   3          1HG       MET   3 -19.453   2.612 -13.165
   18   2HG   MET   3          2HG       MET   3 -18.649   1.131 -13.701
   19   1HE   MET   3          1HE       MET   3 -19.407  -0.878 -10.680
   20   2HE   MET   3          2HE       MET   3 -18.049  -0.963 -11.841
   21   3HE   MET   3          3HE       MET   3 -19.687  -0.536 -12.416
   22    H    THR   4           H        THR   4 -16.687   6.148 -14.031
   23    HA   THR   4           HA       THR   4 -13.723   5.752 -14.530
   24    HB   THR   4           HB       THR   4 -13.403   7.296 -16.157
   25    HG1  THR   4           HG1      THR   4 -15.947   8.432 -15.792
   26   1HG2  THR   4          1HG2      THR   4 -15.092   7.136 -18.000
   27   2HG2  THR   4          2HG2      THR   4 -16.250   6.362 -16.896
   28   3HG2  THR   4          3HG2      THR   4 -14.730   5.535 -17.321
   29    H    ASP   5           H        ASP   5 -15.412   6.132 -12.163
   30    HA   ASP   5           HA       ASP   5 -14.820   8.896 -11.108
   31   1HB   ASP   5          1HB       ASP   5 -16.771   8.420 -10.065
   32   2HB   ASP   5          2HB       ASP   5 -15.743   7.640  -8.886
   33    H    GLN   6           H        GLN   6 -13.747   5.555 -10.729
   34    HA   GLN   6           HA       GLN   6 -12.085   5.661  -8.398
   35   1HB   GLN   6          1HB       GLN   6 -11.279   3.596  -8.986
   36   2HB   GLN   6          2HB       GLN   6 -12.684   3.659 -10.034
   37   1HG   GLN   6          1HG       GLN   6  -9.910   4.506 -11.045
   38   2HG   GLN   6          2HG       GLN   6 -11.332   4.170 -12.008
   39   1HE2  GLN   6          1HE2      GLN   6  -8.950   1.156 -11.963
   40   2HE2  GLN   6          2HE2      GLN   6  -8.675   2.958 -12.172
   41    H    GLN   7           H        GLN   7 -11.462   6.770 -11.688
   42    HA   GLN   7           HA       GLN   7  -8.554   7.432 -11.174
   43   1HB   GLN   7          1HB       GLN   7  -8.742   8.396 -13.610
   44   2HB   GLN   7          2HB       GLN   7 -10.352   7.692 -13.641
   45   1HG   GLN   7          1HG       GLN   7  -7.992   6.382 -14.392
   46   2HG   GLN   7          2HG       GLN   7  -8.273   5.713 -12.792
   47   1HE2  GLN   7          1HE2      GLN   7 -11.421   5.195 -15.499
   48   2HE2  GLN   7          2HE2      GLN   7 -10.598   6.825 -15.320
   49    H    ALA   8           H        ALA   8 -11.665   9.060 -11.698
   50    HA   ALA   8           HA       ALA   8 -10.999  11.800 -11.997
   51   1HB   ALA   8          1HB       ALA   8 -13.178  12.337 -10.921
   52   2HB   ALA   8          2HB       ALA   8 -13.331  10.967 -12.037
   53   3HB   ALA   8          3HB       ALA   8 -13.308  10.683 -10.278
   54    H    GLU   9           H        GLU   9 -10.737   9.791  -9.128
   55    HA   GLU   9           HA       GLU   9 -10.356  12.024  -7.179
   56   1HB   GLU   9          1HB       GLU   9  -9.693  10.114  -5.558
   57   2HB   GLU   9          2HB       GLU   9 -11.353  10.197  -6.132
   58   1HG   GLU   9          1HG       GLU   9  -9.300   8.324  -7.464
   59   2HG   GLU   9          2HG       GLU   9 -11.044   8.325  -7.695
   60    H    ALA  10           H        ALA  10  -8.250   9.526  -8.630
   61    HA   ALA  10           HA       ALA  10  -5.792  10.114  -7.220
   62   1HB   ALA  10          1HB       ALA  10  -4.640   8.883  -9.051
   63   2HB   ALA  10          2HB       ALA  10  -6.111   8.039  -8.532
   64   3HB   ALA  10          3HB       ALA  10  -6.104   8.953 -10.062
   65    NH1  ARG  11           NH1      ARG  11 -10.012  13.707 -14.566
   66    NH2  ARG  11           NH2      ARG  11  -8.403  13.889 -16.160
   67    H    ARG  11           H        ARG  11  -6.981  11.308 -10.365
   68    HA   ARG  11           HA       ARG  11  -4.610  12.944 -11.079
   69   1HB   ARG  11          1HB       ARG  11  -6.186  13.993 -12.802
   70   2HB   ARG  11          2HB       ARG  11  -5.938  12.257 -12.915
   71   1HG   ARG  11          1HG       ARG  11  -8.228  12.527 -11.218
   72   2HG   ARG  11          2HG       ARG  11  -8.461  13.724 -12.494
   73   1HD   ARG  11          1HD       ARG  11  -7.707  10.797 -13.099
   74   2HD   ARG  11          2HD       ARG  11  -9.385  11.331 -12.978
   75    HE   ARG  11           HE       ARG  11  -7.805  11.580 -15.349
   76   1HH1  ARG  11          1HH1      ARG  11 -10.383  13.185 -13.765
   77   2HH1  ARG  11          2HH1      ARG  11 -10.410  14.555 -14.986
   78   1HH2  ARG  11          1HH2      ARG  11  -7.548  13.503 -16.577
   79   2HH2  ARG  11          2HH2      ARG  11  -8.911  14.726 -16.465
   80    H    ALA  12           H        ALA  12  -7.679  13.514  -9.429
   81    HA   ALA  12           HA       ALA  12  -7.567  16.462  -9.235
   82   1HB   ALA  12          1HB       ALA  12  -9.317  16.226  -7.485
   83   2HB   ALA  12          2HB       ALA  12  -9.694  15.235  -8.909
   84   3HB   ALA  12          3HB       ALA  12  -9.069  14.463  -7.430
   85    H    PHE  13           H        PHE  13  -6.170  13.794  -7.422
   86    HA   PHE  13           HA       PHE  13  -5.460  15.257  -4.959
   87   1HB   PHE  13          1HB       PHE  13  -4.358  12.623  -6.093
   88   2HB   PHE  13          2HB       PHE  13  -5.746  12.779  -5.048
   89    HD1  PHE  13           HD1      PHE  13  -5.341  13.646  -2.607
   90    HD2  PHE  13           HD2      PHE  13  -2.091  12.592  -5.224
   91    HE1  PHE  13           HE1      PHE  13  -3.827  13.469  -0.674
   92    HE2  PHE  13           HE2      PHE  13  -0.596  12.414  -3.279
   93    HZ   PHE  13           HZ       PHE  13  -1.457  12.852  -1.005
   94    H    LEU  14           H        LEU  14  -3.450  13.983  -7.640
   95    HA   LEU  14           HA       LEU  14  -1.263  16.047  -7.011
   96   1HB   LEU  14          1HB       LEU  14   0.077  14.242  -6.841
   97   2HB   LEU  14          2HB       LEU  14   0.022  14.189  -8.590
   98    HG   LEU  14           HG       LEU  14  -1.991  12.612  -6.885
   99   1HD1  LEU  14          1HD1      LEU  14  -2.239  11.220  -8.942
  100   2HD1  LEU  14          2HD1      LEU  14  -2.614  12.918  -9.286
  101   3HD1  LEU  14          3HD1      LEU  14  -1.053  12.234  -9.804
  102   1HD2  LEU  14          1HD2      LEU  14   0.749  11.599  -7.906
  103   2HD2  LEU  14          2HD2      LEU  14   0.283  11.825  -6.202
  104   3HD2  LEU  14          3HD2      LEU  14  -0.525  10.590  -7.177
  105    H    SER  15           H        SER  15  -0.704  17.432  -8.529
  106    HA   SER  15           HA       SER  15  -2.298  17.702 -11.042
  107   1HB   SER  15          1HB       SER  15  -1.554  19.884 -11.139
  108   2HB   SER  15          2HB       SER  15   0.069  19.509 -10.553
  109    HG   SER  15           HG       SER  15  -1.490  20.621  -9.124
  110    H    GLU  16           H        GLU  16  -0.262  18.873 -12.655
  111    HA   GLU  16           HA       GLU  16   0.770  16.474 -14.063
  112   1HB   GLU  16          1HB       GLU  16   0.962  19.466 -14.621
  113   2HB   GLU  16          2HB       GLU  16  -0.019  18.264 -15.436
  114   1HG   GLU  16          1HG       GLU  16   1.644  18.476 -17.036
  115   2HG   GLU  16          2HG       GLU  16   2.398  17.207 -16.087
  116    H    GLU  17           H        GLU  17   2.070  18.978 -11.974
  117    HA   GLU  17           HA       GLU  17   4.953  18.468 -12.492
  118   1HB   GLU  17          1HB       GLU  17   4.108  20.661 -11.636
  119   2HB   GLU  17          2HB       GLU  17   3.710  19.923 -10.096
  120   1HG   GLU  17          1HG       GLU  17   6.511  20.357 -11.297
  121   2HG   GLU  17          2HG       GLU  17   6.264  19.271  -9.941
  122    H    MET  18           H        MET  18   2.549  17.357 -10.156
  123    HA   MET  18           HA       MET  18   4.404  15.756  -8.445
  124   1HB   MET  18          1HB       MET  18   2.266  14.707  -7.532
  125   2HB   MET  18          2HB       MET  18   1.343  15.675  -8.667
  126   1HG   MET  18          1HG       MET  18   1.665  17.678  -7.482
  127   2HG   MET  18          2HG       MET  18   3.250  17.196  -6.855
  128   1HE   MET  18          1HE       MET  18   0.546  18.492  -5.287
  129   2HE   MET  18          2HE       MET  18   0.728  17.671  -3.709
  130   3HE   MET  18          3HE       MET  18   2.163  18.357  -4.527
  131    H    ILE  19           H        ILE  19   2.340  15.242 -11.262
  132    HA   ILE  19           HA       ILE  19   2.383  12.319 -11.392
  133    HB   ILE  19           HB       ILE  19   1.856  14.461 -13.483
  134   1HG1  ILE  19          1HG1      ILE  19  -0.043  12.182 -12.727
  135   2HG1  ILE  19          2HG1      ILE  19   0.160  13.512 -11.607
  136   1HG2  ILE  19          1HG2      ILE  19   1.335  12.713 -15.203
  137   2HG2  ILE  19          2HG2      ILE  19   3.038  12.638 -14.757
  138   3HG2  ILE  19          3HG2      ILE  19   1.906  11.431 -14.106
  139   1HD1  ILE  19          1HD1      ILE  19  -0.861  13.822 -14.493
  140   2HD1  ILE  19          2HD1      ILE  19  -1.790  13.976 -12.988
  141   3HD1  ILE  19          3HD1      ILE  19  -0.537  15.177 -13.378
  142    H    ALA  20           H        ALA  20   4.584  14.869 -12.456
  143    HA   ALA  20           HA       ALA  20   6.379  13.594 -14.231
  144   1HB   ALA  20          1HB       ALA  20   8.133  15.176 -13.437
  145   2HB   ALA  20          2HB       ALA  20   6.567  15.987 -13.627
  146   3HB   ALA  20          3HB       ALA  20   7.165  15.576 -11.999
  147    H    GLU  21           H        GLU  21   6.300  13.360 -10.686
  148    HA   GLU  21           HA       GLU  21   8.829  12.069 -10.156
  149   1HB   GLU  21          1HB       GLU  21   6.363  11.376  -8.513
  150   2HB   GLU  21          2HB       GLU  21   6.967  13.021  -8.519
  151   1HG   GLU  21          1HG       GLU  21   8.240  10.505  -7.366
  152   2HG   GLU  21          2HG       GLU  21   9.326  11.762  -7.931
  153    H    PHE  22           H        PHE  22   5.621  10.677 -10.843
  154    HA   PHE  22           HA       PHE  22   6.567   7.843 -10.785
  155   1HB   PHE  22          1HB       PHE  22   3.836   8.768 -11.836
  156   2HB   PHE  22          2HB       PHE  22   4.281   7.205 -11.208
  157    HD1  PHE  22           HD1      PHE  22   2.670  10.236 -10.328
  158    HD2  PHE  22           HD2      PHE  22   5.239   7.217  -8.650
  159    HE1  PHE  22           HE1      PHE  22   2.053  10.957  -8.059
  160    HE2  PHE  22           HE2      PHE  22   4.601   7.948  -6.388
  161    HZ   PHE  22           HZ       PHE  22   3.005   9.810  -6.087
  162    H    LYS  23           H        LYS  23   6.321  10.354 -13.157
  163    HA   LYS  23           HA       LYS  23   5.781   8.828 -15.617
  164   1HB   LYS  23          1HB       LYS  23   6.626  11.604 -14.957
  165   2HB   LYS  23          2HB       LYS  23   7.417  11.007 -16.399
  166   1HG   LYS  23          1HG       LYS  23   4.401  10.640 -16.206
  167   2HG   LYS  23          2HG       LYS  23   5.422  10.818 -17.622
  168   1HD   LYS  23          1HD       LYS  23   3.841  12.840 -16.586
  169   2HD   LYS  23          2HD       LYS  23   5.374  13.228 -15.797
  170   1HE   LYS  23          1HE       LYS  23   6.545  13.475 -17.935
  171   2HE   LYS  23          2HE       LYS  23   5.218  12.731 -18.840
  172   1HZ   LYS  23          1HZ       LYS  23   3.951  14.634 -18.669
  173   2HZ   LYS  23          2HZ       LYS  23   5.457  15.312 -18.709
  174   3HZ   LYS  23          3HZ       LYS  23   4.655  15.165 -17.272
  175    H    ALA  24           H        ALA  24   8.689   9.598 -13.772
  176    HA   ALA  24           HA       ALA  24  10.668   8.743 -15.791
  177   1HB   ALA  24          1HB       ALA  24  12.331   8.957 -13.954
  178   2HB   ALA  24          2HB       ALA  24  11.259  10.368 -14.018
  179   3HB   ALA  24          3HB       ALA  24  11.029   9.134 -12.753
  180    H    ALA  25           H        ALA  25   9.533   7.272 -12.729
  181    HA   ALA  25           HA       ALA  25  11.067   4.749 -13.043
  182   1HB   ALA  25          1HB       ALA  25   9.882   4.032 -10.977
  183   2HB   ALA  25          2HB       ALA  25  10.538   5.670 -10.801
  184   3HB   ALA  25          3HB       ALA  25   8.792   5.435 -11.072
  185    H    PHE  26           H        PHE  26   8.050   5.883 -14.254
  186    HA   PHE  26           HA       PHE  26   6.399   3.459 -14.218
  187   1HB   PHE  26          1HB       PHE  26   5.236   5.504 -14.641
  188   2HB   PHE  26          2HB       PHE  26   6.282   5.977 -15.953
  189    HD1  PHE  26           HD1      PHE  26   3.326   3.999 -14.980
  190    HD2  PHE  26           HD2      PHE  26   6.062   4.740 -18.216
  191    HE1  PHE  26           HE1      PHE  26   1.711   3.051 -16.578
  192    HE2  PHE  26           HE2      PHE  26   4.436   3.783 -19.798
  193    HZ   PHE  26           HZ       PHE  26   2.256   2.951 -18.986
  194    H    ASP  27           H        ASP  27   8.567   4.866 -16.682
  195    HA   ASP  27           HA       ASP  27   8.236   2.730 -18.683
  196   1HB   ASP  27          1HB       ASP  27  10.314   3.704 -19.781
  197   2HB   ASP  27          2HB       ASP  27   8.954   4.787 -19.591
  198    H    MET  28           H        MET  28  10.380   3.253 -15.954
  199    HA   MET  28           HA       MET  28  12.392   1.187 -16.489
  200   1HB   MET  28          1HB       MET  28  12.181   3.099 -14.520
  201   2HB   MET  28          2HB       MET  28  11.697   1.684 -13.603
  202   1HG   MET  28          1HG       MET  28  14.282   1.600 -15.256
  203   2HG   MET  28          2HG       MET  28  13.820   0.592 -13.875
  204   1HE   MET  28          1HE       MET  28  12.733   2.329 -11.595
  205   2HE   MET  28          2HE       MET  28  13.463   3.940 -11.325
  206   3HE   MET  28          3HE       MET  28  12.333   3.691 -12.689
  207    H    PHE  29           H        PHE  29   9.191   1.157 -15.011
  208    HA   PHE  29           HA       PHE  29   9.336  -1.637 -13.957
  209   1HB   PHE  29          1HB       PHE  29   7.875   0.303 -13.011
  210   2HB   PHE  29          2HB       PHE  29   6.788   0.035 -14.346
  211    HD1  PHE  29           HD1      PHE  29   8.546  -2.885 -12.814
  212    HD2  PHE  29           HD2      PHE  29   4.929  -0.551 -12.791
  213    HE1  PHE  29           HE1      PHE  29   7.399  -4.652 -11.539
  214    HE2  PHE  29           HE2      PHE  29   3.800  -2.334 -11.525
  215    HZ   PHE  29           HZ       PHE  29   5.022  -4.391 -10.917
  216    H    ASP  30           H        ASP  30   8.142   0.047 -16.815
  217    HA   ASP  30           HA       ASP  30   6.510  -2.042 -18.011
  218   1HB   ASP  30          1HB       ASP  30   8.043  -0.073 -19.766
  219   2HB   ASP  30          2HB       ASP  30   6.792   0.510 -18.692
  220    H    ALA  31           H        ALA  31   9.847  -1.066 -18.889
  221    HA   ALA  31           HA       ALA  31  11.794  -2.412 -19.429
  222   1HB   ALA  31          1HB       ALA  31  11.716  -4.883 -19.091
  223   2HB   ALA  31          2HB       ALA  31  11.100  -4.007 -17.676
  224   3HB   ALA  31          3HB       ALA  31   9.964  -4.817 -18.786
  225    H    ASP  32           H        ASP  32   9.559  -1.497 -21.208
  226    HA   ASP  32           HA       ASP  32  10.358  -2.910 -23.745
  227   1HB   ASP  32          1HB       ASP  32   7.605  -3.306 -22.539
  228   2HB   ASP  32          2HB       ASP  32   8.653  -4.452 -23.341
  229    H    GLY  33           H        GLY  33   7.373  -1.116 -23.081
  230   1HA   GLY  33          1HA       GLY  33   7.937   1.631 -23.387
  231   2HA   GLY  33          2HA       GLY  33   8.175   1.038 -25.015
  232    H    GLY  34           H        GLY  34   6.447   1.931 -26.016
  233   1HA   GLY  34          1HA       GLY  34   4.143   2.079 -26.818
  234   2HA   GLY  34          2HA       GLY  34   3.704   0.822 -25.655
  235    H    GLY  35           H        GLY  35   2.886   1.329 -23.711
  236   1HA   GLY  35          1HA       GLY  35   2.888   3.791 -22.182
  237   2HA   GLY  35          2HA       GLY  35   1.623   3.993 -23.401
  238    H    ASP  36           H        ASP  36   2.728   1.214 -21.451
  239    HA   ASP  36           HA       ASP  36   0.649   0.932 -19.546
  240   1HB   ASP  36          1HB       ASP  36  -1.187   0.865 -20.976
  241   2HB   ASP  36          2HB       ASP  36  -0.885  -0.830 -20.672
  242    H    ILE  37           H        ILE  37   0.881  -0.911 -18.364
  243    HA   ILE  37           HA       ILE  37   3.249  -2.701 -19.089
  244    HB   ILE  37           HB       ILE  37   2.183  -2.660 -16.277
  245   1HG1  ILE  37          1HG1      ILE  37   3.749  -0.328 -17.479
  246   2HG1  ILE  37          2HG1      ILE  37   2.376  -0.299 -16.389
  247   1HG2  ILE  37          1HG2      ILE  37   4.497  -3.259 -15.677
  248   2HG2  ILE  37          2HG2      ILE  37   3.920  -4.322 -16.968
  249   3HG2  ILE  37          3HG2      ILE  37   5.047  -2.999 -17.350
  250   1HD1  ILE  37          1HD1      ILE  37   5.238  -1.076 -15.564
  251   2HD1  ILE  37          2HD1      ILE  37   4.355   0.409 -15.151
  252   3HD1  ILE  37          3HD1      ILE  37   3.815  -1.151 -14.489
  253    H    SER  38           H        SER  38   2.656  -4.480 -20.018
  254    HA   SER  38           HA       SER  38  -0.007  -5.788 -19.614
  255   1HB   SER  38          1HB       SER  38   2.221  -7.191 -21.109
  256   2HB   SER  38          2HB       SER  38   1.593  -5.682 -21.779
  257    HG   SER  38           HG       SER  38  -0.556  -6.755 -21.265
  258    H    THR  39           H        THR  39   0.878  -8.480 -19.804
  259    HA   THR  39           HA       THR  39   1.358  -9.115 -16.911
  260    HB   THR  39           HB       THR  39   1.354 -11.589 -18.152
  261    HG1  THR  39           HG1      THR  39   0.731 -11.212 -20.072
  262   1HG2  THR  39          1HG2      THR  39  -0.976 -11.848 -17.422
  263   2HG2  THR  39          2HG2      THR  39  -0.091 -10.926 -16.184
  264   3HG2  THR  39          3HG2      THR  39  -1.199 -10.087 -17.302
  265    H    LYS  40           H        LYS  40   2.837 -10.408 -19.915
  266    HA   LYS  40           HA       LYS  40   5.230 -11.493 -18.869
  267   1HB   LYS  40          1HB       LYS  40   4.413 -11.729 -21.212
  268   2HB   LYS  40          2HB       LYS  40   4.932 -10.114 -21.614
  269   1HG   LYS  40          1HG       LYS  40   6.348 -12.601 -21.759
  270   2HG   LYS  40          2HG       LYS  40   7.111 -11.782 -20.422
  271   1HD   LYS  40          1HD       LYS  40   6.949 -10.667 -23.303
  272   2HD   LYS  40          2HD       LYS  40   7.569  -9.804 -21.925
  273   1HE   LYS  40          1HE       LYS  40   9.610 -10.586 -22.330
  274   2HE   LYS  40          2HE       LYS  40   9.093 -12.180 -21.797
  275   1HZ   LYS  40          1HZ       LYS  40   9.848 -12.623 -23.901
  276   2HZ   LYS  40          2HZ       LYS  40   9.445 -11.148 -24.525
  277   3HZ   LYS  40          3HZ       LYS  40   8.280 -12.300 -24.310
  278    H    GLU  41           H        GLU  41   4.431  -8.136 -19.592
  279    HA   GLU  41           HA       GLU  41   7.134  -6.979 -19.396
  280   1HB   GLU  41          1HB       GLU  41   6.229  -4.980 -19.914
  281   2HB   GLU  41          2HB       GLU  41   4.927  -5.112 -18.751
  282   1HG   GLU  41          1HG       GLU  41   4.584  -6.941 -21.109
  283   2HG   GLU  41          2HG       GLU  41   3.421  -5.920 -20.291
  284    H    LEU  42           H        LEU  42   4.417  -7.314 -17.127
  285    HA   LEU  42           HA       LEU  42   5.424  -5.760 -14.897
  286   1HB   LEU  42          1HB       LEU  42   3.689  -8.288 -14.659
  287   2HB   LEU  42          2HB       LEU  42   3.059  -6.738 -15.172
  288    HG   LEU  42           HG       LEU  42   4.442  -7.118 -12.450
  289   1HD1  LEU  42          1HD1      LEU  42   1.404  -7.210 -12.960
  290   2HD1  LEU  42          2HD1      LEU  42   2.403  -8.650 -12.713
  291   3HD1  LEU  42          3HD1      LEU  42   2.246  -7.448 -11.407
  292   1HD2  LEU  42          1HD2      LEU  42   3.334  -5.008 -11.799
  293   2HD2  LEU  42          2HD2      LEU  42   4.216  -4.721 -13.319
  294   3HD2  LEU  42          3HD2      LEU  42   2.456  -4.930 -13.348
  295    H    GLY  43           H        GLY  43   5.695  -9.255 -15.572
  296   1HA   GLY  43          1HA       GLY  43   7.265 -10.942 -14.815
  297   2HA   GLY  43          2HA       GLY  43   7.067 -10.174 -13.237
  298    H    THR  44           H        THR  44   8.311  -8.336 -15.935
  299    HA   THR  44           HA       THR  44  11.104  -8.919 -15.919
  300    HB   THR  44           HB       THR  44   9.689  -6.296 -16.564
  301    HG1  THR  44           HG1      THR  44  11.043  -8.199 -18.158
  302   1HG2  THR  44          1HG2      THR  44  11.782  -5.508 -17.683
  303   2HG2  THR  44          2HG2      THR  44  11.998  -5.619 -15.924
  304   3HG2  THR  44          3HG2      THR  44  12.686  -6.875 -16.985
  305    H    VAL  45           H        VAL  45   9.691  -6.052 -14.313
  306    HA   VAL  45           HA       VAL  45  12.103  -5.473 -12.715
  307    HB   VAL  45           HB       VAL  45   9.412  -4.227 -13.026
  308   1HG1  VAL  45          1HG1      VAL  45  12.162  -2.913 -12.561
  309   2HG1  VAL  45          2HG1      VAL  45  11.582  -3.415 -14.154
  310   3HG1  VAL  45          3HG1      VAL  45  10.698  -2.163 -13.251
  311   1HG2  VAL  45          1HG2      VAL  45   9.440  -2.851 -11.009
  312   2HG2  VAL  45          2HG2      VAL  45   9.532  -4.541 -10.462
  313   3HG2  VAL  45          3HG2      VAL  45  10.992  -3.541 -10.466
  314    H    MET  46           H        MET  46   9.131  -7.287 -12.210
  315    HA   MET  46           HA       MET  46   9.098  -7.667  -9.351
  316   1HB   MET  46          1HB       MET  46   8.156 -10.098 -10.072
  317   2HB   MET  46          2HB       MET  46   8.098  -9.359 -11.661
  318   1HG   MET  46          1HG       MET  46   6.838  -7.370 -10.166
  319   2HG   MET  46          2HG       MET  46   6.004  -8.663 -11.045
  320   1HE   MET  46          1HE       MET  46   6.673 -11.357  -9.503
  321   2HE   MET  46          2HE       MET  46   5.378 -11.409  -8.271
  322   3HE   MET  46          3HE       MET  46   4.996 -10.904  -9.943
  323    NH1  ARG  47           NH1      ARG  47  17.800 -11.220 -12.694
  324    NH2  ARG  47           NH2      ARG  47  18.664  -9.465 -13.850
  325    H    ARG  47           H        ARG  47  11.080  -9.137 -11.862
  326    HA   ARG  47           HA       ARG  47  12.143 -11.459 -10.437
  327   1HB   ARG  47          1HB       ARG  47  12.398 -10.490 -13.026
  328   2HB   ARG  47          2HB       ARG  47  13.237 -11.875 -12.340
  329   1HG   ARG  47          1HG       ARG  47  14.356  -9.011 -12.502
  330   2HG   ARG  47          2HG       ARG  47  15.158 -10.328 -11.645
  331   1HD   ARG  47          1HD       ARG  47  15.292 -11.673 -13.798
  332   2HD   ARG  47          2HD       ARG  47  14.460 -10.382 -14.650
  333    HE   ARG  47           HE       ARG  47  16.455  -9.052 -14.688
  334   1HH1  ARG  47          1HH1      ARG  47  16.970 -11.777 -12.458
  335   2HH1  ARG  47          2HH1      ARG  47  18.757 -11.369 -12.355
  336   1HH2  ARG  47          1HH2      ARG  47  18.498  -8.683 -14.493
  337   2HH2  ARG  47          2HH2      ARG  47  19.560  -9.737 -13.431
  338    H    MET  48           H        MET  48  13.115  -8.070 -10.606
  339    HA   MET  48           HA       MET  48  15.768  -8.053  -9.566
  340   1HB   MET  48          1HB       MET  48  14.127  -6.017 -10.227
  341   2HB   MET  48          2HB       MET  48  15.598  -5.806  -9.294
  342   1HG   MET  48          1HG       MET  48  13.124  -4.830  -8.527
  343   2HG   MET  48          2HG       MET  48  13.152  -6.349  -7.616
  344   1HE   MET  48          1HE       MET  48  13.925  -2.708  -7.388
  345   2HE   MET  48          2HE       MET  48  15.601  -2.554  -6.785
  346   3HE   MET  48          3HE       MET  48  15.305  -3.050  -8.476
  347    H    LEU  49           H        LEU  49  12.731  -8.594  -7.878
  348    HA   LEU  49           HA       LEU  49  13.351  -8.165  -5.131
  349   1HB   LEU  49          1HB       LEU  49  11.755 -10.144  -4.635
  350   2HB   LEU  49          2HB       LEU  49  11.636 -10.398  -6.362
  351    HG   LEU  49           HG       LEU  49  10.780  -7.957  -6.576
  352   1HD1  LEU  49          1HD1      LEU  49  10.390  -8.182  -3.526
  353   2HD1  LEU  49          2HD1      LEU  49  11.634  -7.185  -4.302
  354   3HD1  LEU  49          3HD1      LEU  49   9.911  -6.819  -4.569
  355   1HD2  LEU  49          1HD2      LEU  49   8.455  -8.551  -6.030
  356   2HD2  LEU  49          2HD2      LEU  49   9.254 -10.033  -6.611
  357   3HD2  LEU  49          3HD2      LEU  49   8.981  -9.804  -4.878
  358    H    GLY  50           H        GLY  50  13.212 -11.530  -6.234
  359   1HA   GLY  50          1HA       GLY  50  16.026 -12.223  -5.383
  360   2HA   GLY  50          2HA       GLY  50  14.790 -12.730  -4.224
  361    H    GLN  51           H        GLN  51  12.708 -13.520  -5.721
  362    HA   GLN  51           HA       GLN  51  13.602 -16.186  -6.799
  363   1HB   GLN  51          1HB       GLN  51  11.205 -16.737  -6.945
  364   2HB   GLN  51          2HB       GLN  51  11.651 -16.153  -5.353
  365   1HG   GLN  51          1HG       GLN  51  10.441 -14.129  -5.569
  366   2HG   GLN  51          2HG       GLN  51  10.508 -14.125  -7.318
  367   1HE2  GLN  51          1HE2      GLN  51   6.994 -15.045  -6.625
  368   2HE2  GLN  51          2HE2      GLN  51   8.131 -13.610  -6.748
  369    H    ASN  52           H        ASN  52  11.726 -16.625  -8.769
  370    HA   ASN  52           HA       ASN  52  12.063 -14.478 -10.874
  371   1HB   ASN  52          1HB       ASN  52  13.875 -16.483 -10.906
  372   2HB   ASN  52          2HB       ASN  52  12.620 -17.340 -11.774
  373   1HD2  ASN  52          1HD2      ASN  52  14.979 -15.274 -14.056
  374   2HD2  ASN  52          2HD2      ASN  52  15.323 -16.229 -12.527
  375    HA   PRO  53           HA       PRO  53   7.495 -15.987 -10.746
  376   1HB   PRO  53          1HB       PRO  53   7.338 -13.523 -12.532
  377   2HB   PRO  53          2HB       PRO  53   6.306 -14.069 -11.201
  378   1HG   PRO  53          1HG       PRO  53   8.142 -12.066 -10.851
  379   2HG   PRO  53          2HG       PRO  53   7.665 -13.133  -9.510
  380   1HD   PRO  53          1HD       PRO  53   9.987 -13.698  -9.492
  381   2HD   PRO  53          2HD       PRO  53  10.234 -13.114 -11.164
  382    H    THR  54           H        THR  54   6.103 -16.592 -12.574
  383    HA   THR  54           HA       THR  54   7.608 -17.295 -15.146
  384    HB   THR  54           HB       THR  54   7.070 -19.241 -13.403
  385    HG1  THR  54           HG1      THR  54   7.804 -19.112 -15.756
  386   1HG2  THR  54          1HG2      THR  54   5.031 -20.525 -13.961
  387   2HG2  THR  54          2HG2      THR  54   4.578 -18.933 -13.309
  388   3HG2  THR  54          3HG2      THR  54   4.471 -19.242 -15.060
  389    H    LYS  55           H        LYS  55   6.141 -17.678 -16.970
  390    HA   LYS  55           HA       LYS  55   4.378 -15.350 -17.337
  391   1HB   LYS  55          1HB       LYS  55   5.830 -16.978 -19.063
  392   2HB   LYS  55          2HB       LYS  55   4.701 -15.731 -19.549
  393   1HG   LYS  55          1HG       LYS  55   4.421 -17.904 -20.757
  394   2HG   LYS  55          2HG       LYS  55   3.992 -18.712 -19.260
  395   1HD   LYS  55          1HD       LYS  55   2.196 -16.438 -19.460
  396   2HD   LYS  55          2HD       LYS  55   2.323 -17.097 -21.084
  397   1HE   LYS  55          1HE       LYS  55   1.855 -19.097 -18.859
  398   2HE   LYS  55          2HE       LYS  55   0.512 -18.030 -19.256
  399   1HZ   LYS  55          1HZ       LYS  55   0.156 -19.713 -20.739
  400   2HZ   LYS  55          2HZ       LYS  55   1.746 -20.141 -20.873
  401   3HZ   LYS  55          3HZ       LYS  55   1.170 -18.833 -21.702
  402    H    GLU  56           H        GLU  56   3.896 -18.782 -16.698
  403    HA   GLU  56           HA       GLU  56   1.034 -18.970 -17.352
  404   1HB   GLU  56          1HB       GLU  56   1.345 -21.028 -15.579
  405   2HB   GLU  56          2HB       GLU  56   3.032 -20.745 -15.962
  406   1HG   GLU  56          1HG       GLU  56   1.091 -20.979 -18.303
  407   2HG   GLU  56          2HG       GLU  56   2.788 -21.420 -18.222
  408    H    GLU  57           H        GLU  57   2.699 -18.966 -14.178
  409    HA   GLU  57           HA       GLU  57   0.275 -18.647 -12.551
  410   1HB   GLU  57          1HB       GLU  57   2.967 -19.208 -11.996
  411   2HB   GLU  57          2HB       GLU  57   1.611 -19.181 -10.889
  412   1HG   GLU  57          1HG       GLU  57   3.733 -17.013 -11.349
  413   2HG   GLU  57          2HG       GLU  57   2.181 -16.549 -10.665
  414    H    LEU  58           H        LEU  58   2.506 -16.400 -14.076
  415    HA   LEU  58           HA       LEU  58   2.030 -13.974 -12.628
  416   1HB   LEU  58          1HB       LEU  58   3.429 -14.748 -14.983
  417   2HB   LEU  58          2HB       LEU  58   2.341 -13.485 -15.524
  418    HG   LEU  58           HG       LEU  58   3.529 -12.521 -13.064
  419   1HD1  LEU  58          1HD1      LEU  58   4.342 -11.728 -15.939
  420   2HD1  LEU  58          2HD1      LEU  58   2.872 -11.141 -15.148
  421   3HD1  LEU  58          3HD1      LEU  58   4.465 -10.728 -14.469
  422   1HD2  LEU  58          1HD2      LEU  58   5.957 -12.727 -13.449
  423   2HD2  LEU  58          2HD2      LEU  58   5.254 -14.362 -13.401
  424   3HD2  LEU  58          3HD2      LEU  58   5.692 -13.635 -14.958
  425    H    ASP  59           H        ASP  59   0.157 -15.561 -15.153
  426    HA   ASP  59           HA       ASP  59  -1.640 -13.463 -15.978
  427   1HB   ASP  59          1HB       ASP  59  -1.544 -15.539 -17.252
  428   2HB   ASP  59          2HB       ASP  59  -2.119 -16.489 -15.902
  429    H    ALA  60           H        ALA  60  -1.874 -15.768 -13.281
  430    HA   ALA  60           HA       ALA  60  -4.485 -14.841 -12.234
  431   1HB   ALA  60          1HB       ALA  60  -3.938 -16.230 -10.241
  432   2HB   ALA  60          2HB       ALA  60  -3.649 -17.119 -11.749
  433   3HB   ALA  60          3HB       ALA  60  -2.273 -16.467 -10.824
  434    H    ILE  61           H        ILE  61  -1.082 -14.121 -11.553
  435    HA   ILE  61           HA       ILE  61  -1.240 -12.428  -9.238
  436    HB   ILE  61           HB       ILE  61   0.730 -12.839 -11.384
  437   1HG1  ILE  61          1HG1      ILE  61   1.891 -13.553  -9.567
  438   2HG1  ILE  61          2HG1      ILE  61   0.581 -13.050  -8.520
  439   1HG2  ILE  61          1HG2      ILE  61   2.011 -10.695 -11.121
  440   2HG2  ILE  61          2HG2      ILE  61   0.432 -10.390 -11.843
  441   3HG2  ILE  61          3HG2      ILE  61   0.701 -10.014 -10.125
  442   1HD1  ILE  61          1HD1      ILE  61   1.571 -10.804  -8.161
  443   2HD1  ILE  61          2HD1      ILE  61   2.751 -12.078  -7.788
  444   3HD1  ILE  61          3HD1      ILE  61   2.883 -11.173  -9.314
  445    H    ILE  62           H        ILE  62  -1.963 -11.789 -12.637
  446    HA   ILE  62           HA       ILE  62  -2.422  -8.852 -12.315
  447    HB   ILE  62           HB       ILE  62  -2.854 -10.762 -14.653
  448   1HG1  ILE  62          1HG1      ILE  62  -0.663  -8.949 -13.786
  449   2HG1  ILE  62          2HG1      ILE  62  -0.632 -10.284 -14.918
  450   1HG2  ILE  62          1HG2      ILE  62  -3.539  -8.818 -16.086
  451   2HG2  ILE  62          2HG2      ILE  62  -4.710  -9.068 -14.793
  452   3HG2  ILE  62          3HG2      ILE  62  -3.531  -7.743 -14.665
  453   1HD1  ILE  62          1HD1      ILE  62  -1.467  -7.415 -15.652
  454   2HD1  ILE  62          2HD1      ILE  62   0.022  -8.267 -16.110
  455   3HD1  ILE  62          3HD1      ILE  62  -1.541  -8.812 -16.761
  456    H    GLU  63           H        GLU  63  -4.368 -11.813 -12.617
  457    HA   GLU  63           HA       GLU  63  -7.037 -10.838 -12.631
  458   1HB   GLU  63          1HB       GLU  63  -6.245 -13.284 -12.681
  459   2HB   GLU  63          2HB       GLU  63  -6.195 -13.242 -10.929
  460   1HG   GLU  63          1HG       GLU  63  -8.306 -14.254 -11.597
  461   2HG   GLU  63          2HG       GLU  63  -8.679 -12.693 -10.885
  462    H    GLU  64           H        GLU  64  -4.727 -10.984  -9.974
  463    HA   GLU  64           HA       GLU  64  -6.529 -10.362  -7.750
  464   1HB   GLU  64          1HB       GLU  64  -3.640  -9.509  -7.565
  465   2HB   GLU  64          2HB       GLU  64  -3.943 -11.207  -7.878
  466   1HG   GLU  64          1HG       GLU  64  -3.912 -11.281  -5.559
  467   2HG   GLU  64          2HG       GLU  64  -5.628 -10.976  -5.767
  468    H    VAL  65           H        VAL  65  -4.248  -8.320  -9.606
  469    HA   VAL  65           HA       VAL  65  -5.652  -5.798  -8.614
  470    HB   VAL  65           HB       VAL  65  -3.367  -5.641  -8.072
  471   1HG1  VAL  65          1HG1      VAL  65  -3.547  -4.010 -10.687
  472   2HG1  VAL  65          2HG1      VAL  65  -4.379  -3.559  -9.187
  473   3HG1  VAL  65          3HG1      VAL  65  -2.600  -3.624  -9.228
  474   1HG2  VAL  65          1HG2      VAL  65  -1.425  -6.059  -9.498
  475   2HG2  VAL  65          2HG2      VAL  65  -2.489  -7.475  -9.671
  476   3HG2  VAL  65          3HG2      VAL  65  -2.436  -6.255 -10.951
  477    H    ASP  66           H        ASP  66  -7.430  -5.990  -9.991
  478    HA   ASP  66           HA       ASP  66  -7.385  -4.629 -12.519
  479   1HB   ASP  66          1HB       ASP  66  -8.073  -7.144 -13.707
  480   2HB   ASP  66          2HB       ASP  66  -6.580  -7.432 -12.843
  481    H    GLU  67           H        GLU  67  -9.036  -3.903 -11.035
  482    HA   GLU  67           HA       GLU  67 -11.525  -5.479 -10.540
  483   1HB   GLU  67          1HB       GLU  67 -12.480  -3.426  -9.608
  484   2HB   GLU  67          2HB       GLU  67 -11.182  -2.446 -10.264
  485   1HG   GLU  67          1HG       GLU  67  -9.659  -3.076  -8.591
  486   2HG   GLU  67          2HG       GLU  67 -10.311  -4.698  -8.432
  487    H    ASP  68           H        ASP  68 -10.302  -3.235 -12.950
  488    HA   ASP  68           HA       ASP  68 -12.922  -2.839 -14.350
  489   1HB   ASP  68          1HB       ASP  68 -11.168  -1.882 -16.206
  490   2HB   ASP  68          2HB       ASP  68 -11.829  -0.947 -14.885
  491    H    GLY  69           H        GLY  69 -10.059  -4.866 -14.643
  492   1HA   GLY  69          1HA       GLY  69  -9.919  -7.100 -15.673
  493   2HA   GLY  69          2HA       GLY  69 -11.548  -6.869 -16.321
  494    H    SER  70           H        SER  70  -8.699  -4.770 -16.642
  495    HA   SER  70           HA       SER  70  -8.959  -4.660 -19.657
  496   1HB   SER  70          1HB       SER  70  -8.506  -2.517 -18.910
  497   2HB   SER  70          2HB       SER  70  -6.877  -3.062 -19.320
  498    HG   SER  70           HG       SER  70  -6.526  -3.541 -17.160
  499    H    GLY  71           H        GLY  71  -6.768  -5.833 -17.119
  500   1HA   GLY  71          1HA       GLY  71  -5.389  -7.923 -17.354
  501   2HA   GLY  71          2HA       GLY  71  -5.398  -7.693 -19.108
  502    H    THR  72           H        THR  72  -4.828  -4.843 -18.971
  503    HA   THR  72           HA       THR  72  -1.822  -4.964 -18.528
  504    HB   THR  72           HB       THR  72  -2.075  -2.544 -19.689
  505    HG1  THR  72           HG1      THR  72  -3.677  -2.878 -21.362
  506   1HG2  THR  72          1HG2      THR  72  -1.617  -3.522 -21.901
  507   2HG2  THR  72          2HG2      THR  72  -0.694  -4.419 -20.675
  508   3HG2  THR  72          3HG2      THR  72  -2.170  -5.129 -21.382
  509    H    ILE  73           H        ILE  73  -1.148  -2.424 -18.036
  510    HA   ILE  73           HA       ILE  73  -2.697  -1.395 -15.629
  511    HB   ILE  73           HB       ILE  73   0.195  -2.364 -15.476
  512   1HG1  ILE  73          1HG1      ILE  73  -1.101  -4.192 -14.768
  513   2HG1  ILE  73          2HG1      ILE  73  -2.426  -3.199 -14.198
  514   1HG2  ILE  73          1HG2      ILE  73   0.444  -1.247 -13.263
  515   2HG2  ILE  73          2HG2      ILE  73   0.096  -0.033 -14.501
  516   3HG2  ILE  73          3HG2      ILE  73  -1.186  -0.547 -13.379
  517   1HD1  ILE  73          1HD1      ILE  73  -1.221  -2.575 -12.122
  518   2HD1  ILE  73          2HD1      ILE  73  -1.284  -4.340 -12.311
  519   3HD1  ILE  73          3HD1      ILE  73   0.226  -3.467 -12.666
  520    H    ASP  74           H        ASP  74  -3.179   0.103 -17.371
  521    HA   ASP  74           HA       ASP  74  -1.291   1.789 -18.769
  522   1HB   ASP  74          1HB       ASP  74  -3.059   3.175 -19.422
  523   2HB   ASP  74          2HB       ASP  74  -3.909   3.037 -17.901
  524    H    PHE  75           H        PHE  75  -1.053   4.187 -18.354
  525    HA   PHE  75           HA       PHE  75   0.526   4.571 -15.917
  526   1HB   PHE  75          1HB       PHE  75   0.964   5.797 -18.066
  527   2HB   PHE  75          2HB       PHE  75  -0.522   6.690 -17.889
  528    HD1  PHE  75           HD1      PHE  75   2.858   7.127 -17.616
  529    HD2  PHE  75           HD2      PHE  75  -0.626   7.690 -15.153
  530    HE1  PHE  75           HE1      PHE  75   4.036   8.863 -16.329
  531    HE2  PHE  75           HE2      PHE  75   0.568   9.430 -13.883
  532    HZ   PHE  75           HZ       PHE  75   2.893  10.020 -14.467
  533    H    GLU  76           H        GLU  76  -2.606   5.932 -16.978
  534    HA   GLU  76           HA       GLU  76  -3.256   7.508 -14.648
  535   1HB   GLU  76          1HB       GLU  76  -4.430   7.376 -17.001
  536   2HB   GLU  76          2HB       GLU  76  -5.266   7.950 -15.574
  537   1HG   GLU  76          1HG       GLU  76  -5.559   5.132 -16.793
  538   2HG   GLU  76          2HG       GLU  76  -6.337   5.651 -15.313
  539    H    GLU  77           H        GLU  77  -3.627   4.078 -15.302
  540    HA   GLU  77           HA       GLU  77  -5.394   3.400 -13.025
  541   1HB   GLU  77          1HB       GLU  77  -5.567   1.773 -14.624
  542   2HB   GLU  77          2HB       GLU  77  -3.882   1.840 -15.085
  543   1HG   GLU  77          1HG       GLU  77  -3.183   0.355 -13.332
  544   2HG   GLU  77          2HG       GLU  77  -4.617   0.656 -12.357
  545    H    PHE  78           H        PHE  78  -1.892   3.395 -13.559
  546    HA   PHE  78           HA       PHE  78  -1.052   2.046 -11.095
  547   1HB   PHE  78          1HB       PHE  78   0.403   2.506 -13.169
  548   2HB   PHE  78          2HB       PHE  78   0.550   4.169 -12.661
  549    HD1  PHE  78           HD1      PHE  78   0.397   1.860  -9.821
  550    HD2  PHE  78           HD2      PHE  78   3.088   3.463 -12.771
  551    HE1  PHE  78           HE1      PHE  78   2.324   1.214  -8.431
  552    HE2  PHE  78           HE2      PHE  78   5.002   2.789 -11.379
  553    HZ   PHE  78           HZ       PHE  78   4.626   1.664  -9.211
  554    H    LEU  79           H        LEU  79  -1.662   5.434 -11.949
  555    HA   LEU  79           HA       LEU  79  -0.732   6.699  -9.482
  556   1HB   LEU  79          1HB       LEU  79  -2.549   7.573 -11.757
  557   2HB   LEU  79          2HB       LEU  79  -2.590   8.514 -10.282
  558    HG   LEU  79           HG       LEU  79  -0.964   9.175 -12.287
  559   1HD1  LEU  79          1HD1      LEU  79   0.540  10.348 -10.677
  560   2HD1  LEU  79          2HD1      LEU  79  -1.146  10.436 -10.134
  561   3HD1  LEU  79          3HD1      LEU  79  -0.020   9.302  -9.348
  562   1HD2  LEU  79          1HD2      LEU  79   0.837   7.175 -10.759
  563   2HD2  LEU  79          2HD2      LEU  79   0.311   7.030 -12.455
  564   3HD2  LEU  79          3HD2      LEU  79   1.393   8.348 -11.981
  565    H    VAL  80           H        VAL  80  -3.782   5.222 -10.432
  566    HA   VAL  80           HA       VAL  80  -5.343   6.090  -8.059
  567    HB   VAL  80           HB       VAL  80  -5.898   4.106 -10.295
  568   1HG1  VAL  80          1HG1      VAL  80  -7.507   6.590  -9.435
  569   2HG1  VAL  80          2HG1      VAL  80  -6.214   6.648 -10.640
  570   3HG1  VAL  80          3HG1      VAL  80  -7.658   5.657 -10.947
  571   1HG2  VAL  80          1HG2      VAL  80  -8.115   3.561  -9.398
  572   2HG2  VAL  80          2HG2      VAL  80  -6.927   3.127  -8.147
  573   3HG2  VAL  80          3HG2      VAL  80  -7.876   4.612  -7.981
  574    H    MET  81           H        MET  81  -3.313   3.355  -8.937
  575    HA   MET  81           HA       MET  81  -3.972   1.469  -6.814
  576   1HB   MET  81          1HB       MET  81  -1.766   1.747  -8.789
  577   2HB   MET  81          2HB       MET  81  -1.219   1.076  -7.263
  578   1HG   MET  81          1HG       MET  81  -1.847  -0.771  -8.754
  579   2HG   MET  81          2HG       MET  81  -2.996  -0.729  -7.407
  580   1HE   MET  81          1HE       MET  81  -5.323  -1.269  -7.848
  581   2HE   MET  81          2HE       MET  81  -6.052  -1.313  -9.482
  582   3HE   MET  81          3HE       MET  81  -4.618  -2.317  -9.120
  583    H    MET  82           H        MET  82  -1.694   4.189  -6.975
  584    HA   MET  82           HA       MET  82  -0.590   3.707  -4.229
  585   1HB   MET  82          1HB       MET  82   0.572   6.036  -4.832
  586   2HB   MET  82          2HB       MET  82  -0.001   5.704  -6.456
  587   1HG   MET  82          1HG       MET  82   1.827   4.388  -6.803
  588   2HG   MET  82          2HG       MET  82   1.233   3.251  -5.586
  589   1HE   MET  82          1HE       MET  82   3.655   2.464  -4.543
  590   2HE   MET  82          2HE       MET  82   5.002   3.640  -4.487
  591   3HE   MET  82          3HE       MET  82   4.197   3.282  -6.043
  592    H    VAL  83           H        VAL  83  -2.918   5.816  -5.809
  593    HA   VAL  83           HA       VAL  83  -3.126   7.874  -3.707
  594    HB   VAL  83           HB       VAL  83  -4.439   7.359  -6.304
  595   1HG1  VAL  83          1HG1      VAL  83  -6.505   8.703  -5.883
  596   2HG1  VAL  83          2HG1      VAL  83  -6.533   7.206  -4.941
  597   3HG1  VAL  83          3HG1      VAL  83  -6.148   8.745  -4.137
  598   1HG2  VAL  83          1HG2      VAL  83  -3.880   9.990  -4.779
  599   2HG2  VAL  83          2HG2      VAL  83  -2.811   9.244  -5.989
  600   3HG2  VAL  83          3HG2      VAL  83  -4.397   9.856  -6.480
  601    NH1  ARG  84           NH1      ARG  84  -8.274  -0.766  -6.447
  602    NH2  ARG  84           NH2      ARG  84  -7.304  -1.911  -4.741
  603    H    ARG  84           H        ARG  84  -4.697   4.797  -4.372
  604    HA   ARG  84           HA       ARG  84  -7.095   4.956  -2.742
  605   1HB   ARG  84          1HB       ARG  84  -5.657   2.862  -4.169
  606   2HB   ARG  84          2HB       ARG  84  -6.023   2.268  -2.556
  607   1HG   ARG  84          1HG       ARG  84  -8.297   3.651  -4.003
  608   2HG   ARG  84          2HG       ARG  84  -8.348   2.309  -2.856
  609   1HD   ARG  84          1HD       ARG  84  -8.768   1.920  -5.500
  610   2HD   ARG  84          2HD       ARG  84  -7.007   1.827  -5.568
  611    HE   ARG  84           HE       ARG  84  -8.111   0.091  -3.413
  612   1HH1  ARG  84          1HH1      ARG  84  -8.676   0.118  -6.779
  613   2HH1  ARG  84          2HH1      ARG  84  -8.166  -1.633  -6.984
  614   1HH2  ARG  84          1HH2      ARG  84  -7.013  -1.918  -3.757
  615   2HH2  ARG  84          2HH2      ARG  84  -7.213  -2.680  -5.415
  616    H    GLN  85           H        GLN  85  -3.747   4.108  -1.922
  617    HA   GLN  85           HA       GLN  85  -4.186   3.111   0.797
  618   1HB   GLN  85          1HB       GLN  85  -1.679   3.669   1.108
  619   2HB   GLN  85          2HB       GLN  85  -1.690   4.282  -0.535
  620   1HG   GLN  85          1HG       GLN  85  -1.626   2.200  -1.472
  621   2HG   GLN  85          2HG       GLN  85  -2.867   1.558  -0.420
  622   1HE2  GLN  85          1HE2      GLN  85   0.830   1.485   1.460
  623   2HE2  GLN  85          2HE2      GLN  85   0.099   3.053   0.846
  624    H    MET  86           H        MET  86  -3.732   6.321  -0.571
  625    HA   MET  86           HA       MET  86  -3.100   8.008   1.647
  626   1HB   MET  86          1HB       MET  86  -3.765   8.500  -0.962
  627   2HB   MET  86          2HB       MET  86  -3.555   9.722   0.278
  628   1HG   MET  86          1HG       MET  86  -6.177   9.414   0.719
  629   2HG   MET  86          2HG       MET  86  -6.181   8.514  -0.804
  630   1HE   MET  86          1HE       MET  86  -5.932   9.530  -3.204
  631   2HE   MET  86          2HE       MET  86  -5.231  11.141  -3.538
  632   3HE   MET  86          3HE       MET  86  -4.210   9.854  -2.832
  633    H    LYS  87           H        LYS  87  -6.158   6.493   0.755
  634    HA   LYS  87           HA       LYS  87  -8.137   7.758   2.332
  635   1HB   LYS  87          1HB       LYS  87  -8.920   5.168   2.802
  636   2HB   LYS  87          2HB       LYS  87  -7.758   4.870   1.518
  637   1HG   LYS  87          1HG       LYS  87  -8.986   6.008  -0.125
  638   2HG   LYS  87          2HG       LYS  87  -9.813   7.056   1.016
  639   1HD   LYS  87          1HD       LYS  87 -11.511   5.572   0.251
  640   2HD   LYS  87          2HD       LYS  87 -10.417   4.195   0.203
  641   1HE   LYS  87          1HE       LYS  87 -10.477   3.925   2.662
  642   2HE   LYS  87          2HE       LYS  87 -11.340   5.455   2.871
  643   1HZ   LYS  87          1HZ       LYS  87 -12.720   3.679   1.081
  644   2HZ   LYS  87          2HZ       LYS  87 -13.274   4.451   2.433
  645   3HZ   LYS  87          3HZ       LYS  87 -12.493   3.003   2.571
  646    H    GLU  88           H        GLU  88  -6.124   5.008   3.449
  647    HA   GLU  88           HA       GLU  88  -6.064   6.174   6.267
  648   1HB   GLU  88          1HB       GLU  88  -6.611   3.977   7.284
  649   2HB   GLU  88          2HB       GLU  88  -6.873   3.269   5.702
  650   1HG   GLU  88          1HG       GLU  88  -8.731   5.161   5.409
  651   2HG   GLU  88          2HG       GLU  88  -8.581   5.374   7.144
  652    H    ASP  89           H        ASP  89  -3.935   6.690   5.942
  653    HA   ASP  89           HA       ASP  89  -1.945   4.369   5.704
  654   1HB   ASP  89          1HB       ASP  89  -0.852   7.127   5.281
  655   2HB   ASP  89          2HB       ASP  89  -2.016   6.623   4.077
  656    H    ALA  90           H        ALA  90  -2.260   3.934   7.915
  657    HA   ALA  90           HA       ALA  90  -1.436   3.915  10.189
  658   1HB   ALA  90          1HB       ALA  90   0.434   5.463  10.818
  659   2HB   ALA  90          2HB       ALA  90   0.777   4.659   9.274
  660   3HB   ALA  90          3HB       ALA  90   0.247   6.359   9.290
   
  Start of MODEL          15
 Raw file had  660 H/Q atoms
  Start of MODEL   15
    1   1H    ALA   1          1H        ALA   1 -23.487   2.309  -1.727
    2   2H    ALA   1          2H        ALA   1 -22.911   1.179  -0.623
    3   3H    ALA   1          3H        ALA   1 -23.324   2.725  -0.106
    4    HA   ALA   1           HA       ALA   1 -21.478   3.699  -0.838
    5   1HB   ALA   1          1HB       ALA   1 -19.522   1.908  -0.634
    6   2HB   ALA   1          2HB       ALA   1 -20.814   0.779  -0.183
    7   3HB   ALA   1          3HB       ALA   1 -20.527   2.240   0.797
    8    H    SER   2           H        SER   2 -22.421   4.012  -3.035
    9    HA   SER   2           HA       SER   2 -21.169   2.353  -5.260
   10   1HB   SER   2          1HB       SER   2 -23.048   4.619  -5.913
   11   2HB   SER   2          2HB       SER   2 -22.881   3.025  -6.653
   12    HG   SER   2           HG       SER   2 -24.726   3.624  -5.135
   13    H    MET   3           H        MET   3 -19.074   3.022  -5.312
   14    HA   MET   3           HA       MET   3 -18.491   5.935  -6.050
   15   1HB   MET   3          1HB       MET   3 -16.695   4.331  -4.152
   16   2HB   MET   3          2HB       MET   3 -16.537   6.020  -4.597
   17   1HG   MET   3          1HG       MET   3 -19.162   5.881  -3.493
   18   2HG   MET   3          2HG       MET   3 -18.215   4.769  -2.495
   19   1HE   MET   3          1HE       MET   3 -19.467   8.150  -2.884
   20   2HE   MET   3          2HE       MET   3 -18.129   8.642  -3.964
   21   3HE   MET   3          3HE       MET   3 -18.223   9.303  -2.305
   22    H    THR   4           H        THR   4 -17.915   5.739  -8.100
   23    HA   THR   4           HA       THR   4 -16.224   3.405  -9.035
   24    HB   THR   4           HB       THR   4 -17.344   5.200 -11.118
   25    HG1  THR   4           HG1      THR   4 -19.159   3.455 -10.023
   26   1HG2  THR   4          1HG2      THR   4 -16.981   2.201 -10.784
   27   2HG2  THR   4          2HG2      THR   4 -16.612   3.238 -12.180
   28   3HG2  THR   4          3HG2      THR   4 -18.297   2.771 -11.832
   29    H    ASP   5           H        ASP   5 -16.236   6.888  -8.703
   30    HA   ASP   5           HA       ASP   5 -13.670   7.323 -10.207
   31   1HB   ASP   5          1HB       ASP   5 -15.407   9.084 -10.297
   32   2HB   ASP   5          2HB       ASP   5 -13.877   9.681  -9.696
   33    H    GLN   6           H        GLN   6 -12.514   5.744  -8.947
   34    HA   GLN   6           HA       GLN   6 -11.876   6.279  -6.034
   35   1HB   GLN   6          1HB       GLN   6 -12.086   3.924  -7.384
   36   2HB   GLN   6          2HB       GLN   6 -11.176   4.142  -5.901
   37   1HG   GLN   6          1HG       GLN   6  -9.048   4.241  -7.067
   38   2HG   GLN   6          2HG       GLN   6  -9.804   4.472  -8.627
   39   1HE2  GLN   6          1HE2      GLN   6  -9.247   0.949  -9.086
   40   2HE2  GLN   6          2HE2      GLN   6  -8.703   2.655  -9.486
   41    H    GLN   7           H        GLN   7 -10.445   6.523  -9.254
   42    HA   GLN   7           HA       GLN   7  -7.677   7.280  -8.432
   43   1HB   GLN   7          1HB       GLN   7  -8.384   8.351 -11.076
   44   2HB   GLN   7          2HB       GLN   7  -7.184   7.150 -10.617
   45   1HG   GLN   7          1HG       GLN   7  -8.444   5.800 -11.977
   46   2HG   GLN   7          2HG       GLN   7  -9.303   5.481 -10.478
   47   1HE2  GLN   7          1HE2      GLN   7 -12.164   6.322 -12.576
   48   2HE2  GLN   7          2HE2      GLN   7 -11.142   4.966 -11.881
   49    H    ALA   8           H        ALA   8 -10.713   8.936  -9.130
   50    HA   ALA   8           HA       ALA   8  -9.824  11.689  -9.330
   51   1HB   ALA   8          1HB       ALA   8 -12.168  12.309  -8.766
   52   2HB   ALA   8          2HB       ALA   8 -12.116  10.985  -9.946
   53   3HB   ALA   8          3HB       ALA   8 -12.517  10.643  -8.243
   54    H    GLU   9           H        GLU   9 -10.383   9.591  -6.564
   55    HA   GLU   9           HA       GLU   9 -10.444  11.655  -4.452
   56   1HB   GLU   9          1HB       GLU   9  -9.660   8.735  -3.929
   57   2HB   GLU   9          2HB       GLU   9 -10.379   9.894  -2.821
   58   1HG   GLU   9          1HG       GLU   9 -12.389   9.843  -4.727
   59   2HG   GLU   9          2HG       GLU   9 -11.746   8.218  -4.932
   60    H    ALA  10           H        ALA  10  -7.951   9.181  -5.170
   61    HA   ALA  10           HA       ALA  10  -5.903  10.225  -3.383
   62   1HB   ALA  10          1HB       ALA  10  -4.335   8.714  -4.591
   63   2HB   ALA  10          2HB       ALA  10  -5.865   7.895  -4.222
   64   3HB   ALA  10          3HB       ALA  10  -5.532   8.453  -5.882
   65    NH1  ARG  11           NH1      ARG  11  -9.554  14.730 -11.853
   66    NH2  ARG  11           NH2      ARG  11  -8.025  15.386 -13.399
   67    H    ARG  11           H        ARG  11  -6.751  10.952  -6.716
   68    HA   ARG  11           HA       ARG  11  -4.239  12.398  -7.478
   69   1HB   ARG  11          1HB       ARG  11  -5.336  11.467  -9.355
   70   2HB   ARG  11          2HB       ARG  11  -6.936  11.918  -8.786
   71   1HG   ARG  11          1HG       ARG  11  -5.293  14.335  -9.265
   72   2HG   ARG  11          2HG       ARG  11  -5.377  13.320 -10.707
   73   1HD   ARG  11          1HD       ARG  11  -7.982  13.207 -10.257
   74   2HD   ARG  11          2HD       ARG  11  -7.733  14.565  -9.158
   75    HE   ARG  11           HE       ARG  11  -6.574  15.662 -11.365
   76   1HH1  ARG  11          1HH1      ARG  11  -7.044  15.594 -13.614
   77   2HH1  ARG  11          2HH1      ARG  11  -8.821  15.441 -14.045
   78   1HH2  ARG  11          1HH2      ARG  11  -9.731  14.382 -10.904
   79   2HH2  ARG  11          2HH2      ARG  11 -10.249  14.877 -12.594
   80    H    ALA  12           H        ALA  12  -7.517  13.234  -6.407
   81    HA   ALA  12           HA       ALA  12  -7.338  16.153  -6.798
   82   1HB   ALA  12          1HB       ALA  12  -9.417  16.280  -5.440
   83   2HB   ALA  12          2HB       ALA  12  -9.528  15.007  -6.672
   84   3HB   ALA  12          3HB       ALA  12  -9.250  14.572  -4.967
   85    H    PHE  13           H        PHE  13  -6.528  13.944  -4.175
   86    HA   PHE  13           HA       PHE  13  -6.137  15.994  -2.057
   87   1HB   PHE  13          1HB       PHE  13  -5.442  13.020  -2.252
   88   2HB   PHE  13          2HB       PHE  13  -6.760  13.756  -1.377
   89    HD1  PHE  13           HD1      PHE  13  -6.233  15.056   0.790
   90    HD2  PHE  13           HD2      PHE  13  -3.165  12.908  -1.333
   91    HE1  PHE  13           HE1      PHE  13  -4.803  15.094   2.793
   92    HE2  PHE  13           HE2      PHE  13  -1.753  12.955   0.680
   93    HZ   PHE  13           HZ       PHE  13  -2.566  14.044   2.744
   94    H    LEU  14           H        LEU  14  -4.031  14.032  -4.166
   95    HA   LEU  14           HA       LEU  14  -1.474  15.270  -3.227
   96   1HB   LEU  14          1HB       LEU  14  -0.349  13.865  -4.871
   97   2HB   LEU  14          2HB       LEU  14  -1.832  13.555  -5.746
   98    HG   LEU  14           HG       LEU  14  -2.632  12.435  -3.423
   99   1HD1  LEU  14          1HD1      LEU  14  -1.849  10.227  -4.287
  100   2HD1  LEU  14          2HD1      LEU  14  -2.454  11.240  -5.611
  101   3HD1  LEU  14          3HD1      LEU  14  -0.699  11.033  -5.384
  102   1HD2  LEU  14          1HD2      LEU  14   0.444  12.166  -3.223
  103   2HD2  LEU  14          2HD2      LEU  14  -0.611  13.018  -2.070
  104   3HD2  LEU  14          3HD2      LEU  14  -0.743  11.263  -2.248
  105    H    SER  15           H        SER  15   0.005  16.299  -4.772
  106    HA   SER  15           HA       SER  15  -1.444  18.300  -6.585
  107   1HB   SER  15          1HB       SER  15  -0.470  19.690  -5.053
  108   2HB   SER  15          2HB       SER  15   0.820  18.560  -4.635
  109    HG   SER  15           HG       SER  15   1.093  20.614  -6.058
  110    H    GLU  16           H        GLU  16   0.113  19.178  -8.316
  111    HA   GLU  16           HA       GLU  16   0.753  16.998 -10.199
  112   1HB   GLU  16          1HB       GLU  16  -0.042  18.956 -11.220
  113   2HB   GLU  16          2HB       GLU  16   1.003  20.023 -10.302
  114   1HG   GLU  16          1HG       GLU  16   2.941  19.496 -11.669
  115   2HG   GLU  16          2HG       GLU  16   2.202  18.044 -12.324
  116    H    GLU  17           H        GLU  17   2.581  19.052  -8.011
  117    HA   GLU  17           HA       GLU  17   5.293  18.333  -9.049
  118   1HB   GLU  17          1HB       GLU  17   6.048  19.415  -6.769
  119   2HB   GLU  17          2HB       GLU  17   4.375  19.913  -6.609
  120   1HG   GLU  17          1HG       GLU  17   6.486  20.853  -8.590
  121   2HG   GLU  17          2HG       GLU  17   5.384  21.800  -7.606
  122    H    MET  18           H        MET  18   3.111  17.286  -6.485
  123    HA   MET  18           HA       MET  18   4.936  15.457  -5.039
  124   1HB   MET  18          1HB       MET  18   2.580  16.427  -4.278
  125   2HB   MET  18          2HB       MET  18   1.916  15.043  -5.126
  126   1HG   MET  18          1HG       MET  18   2.606  13.519  -3.514
  127   2HG   MET  18          2HG       MET  18   4.137  14.354  -3.205
  128   1HE   MET  18          1HE       MET  18   3.832  17.182  -2.307
  129   2HE   MET  18          2HE       MET  18   3.369  17.054  -0.584
  130   3HE   MET  18          3HE       MET  18   4.594  15.941  -1.262
  131    H    ILE  19           H        ILE  19   2.787  15.216  -7.826
  132    HA   ILE  19           HA       ILE  19   2.709  12.279  -8.072
  133    HB   ILE  19           HB       ILE  19   1.759  14.576  -9.699
  134   1HG1  ILE  19          1HG1      ILE  19   0.666  11.766  -9.046
  135   2HG1  ILE  19          2HG1      ILE  19  -0.160  12.863 -10.132
  136   1HG2  ILE  19          1HG2      ILE  19   1.502  13.321 -11.854
  137   2HG2  ILE  19          2HG2      ILE  19   3.210  13.524 -11.469
  138   3HG2  ILE  19          3HG2      ILE  19   2.429  11.951 -11.193
  139   1HD1  ILE  19          1HD1      ILE  19  -0.516  14.551  -8.351
  140   2HD1  ILE  19          2HD1      ILE  19  -1.118  12.962  -7.837
  141   3HD1  ILE  19          3HD1      ILE  19   0.428  13.568  -7.198
  142    H    ALA  20           H        ALA  20   4.827  14.857  -9.233
  143    HA   ALA  20           HA       ALA  20   6.448  13.493 -11.176
  144   1HB   ALA  20          1HB       ALA  20   8.193  15.208 -10.703
  145   2HB   ALA  20          2HB       ALA  20   6.578  15.936 -10.810
  146   3HB   ALA  20          3HB       ALA  20   7.346  15.703  -9.219
  147    H    GLU  21           H        GLU  21   6.624  13.500  -7.641
  148    HA   GLU  21           HA       GLU  21   9.254  12.274  -7.254
  149   1HB   GLU  21          1HB       GLU  21   7.495  13.414  -5.552
  150   2HB   GLU  21          2HB       GLU  21   7.045  11.747  -5.250
  151   1HG   GLU  21          1HG       GLU  21   8.785  12.706  -3.649
  152   2HG   GLU  21          2HG       GLU  21   9.242  11.183  -4.392
  153    H    PHE  22           H        PHE  22   5.978  10.978  -7.651
  154    HA   PHE  22           HA       PHE  22   6.725   8.104  -7.276
  155   1HB   PHE  22          1HB       PHE  22   4.101   9.195  -8.457
  156   2HB   PHE  22          2HB       PHE  22   4.396   7.590  -7.845
  157    HD1  PHE  22           HD1      PHE  22   3.239  10.876  -6.926
  158    HD2  PHE  22           HD2      PHE  22   5.086   7.346  -5.294
  159    HE1  PHE  22           HE1      PHE  22   2.660  11.611  -4.652
  160    HE2  PHE  22           HE2      PHE  22   4.491   8.097  -3.027
  161    HZ   PHE  22           HZ       PHE  22   3.314  10.245  -2.699
  162    H    LYS  23           H        LYS  23   6.583  10.398  -9.894
  163    HA   LYS  23           HA       LYS  23   6.091   8.760 -12.227
  164   1HB   LYS  23          1HB       LYS  23   7.430  11.414 -11.756
  165   2HB   LYS  23          2HB       LYS  23   7.964  10.579 -13.197
  166   1HG   LYS  23          1HG       LYS  23   5.039  11.306 -12.558
  167   2HG   LYS  23          2HG       LYS  23   5.560  10.406 -13.973
  168   1HD   LYS  23          1HD       LYS  23   6.766  13.168 -13.415
  169   2HD   LYS  23          2HD       LYS  23   5.171  13.032 -14.165
  170   1HE   LYS  23          1HE       LYS  23   7.488  11.416 -15.355
  171   2HE   LYS  23          2HE       LYS  23   7.390  13.149 -15.696
  172   1HZ   LYS  23          1HZ       LYS  23   5.632  10.998 -16.578
  173   2HZ   LYS  23          2HZ       LYS  23   6.065  12.393 -17.350
  174   3HZ   LYS  23          3HZ       LYS  23   4.873  12.417 -16.206
  175    H    ALA  24           H        ALA  24   9.130   9.491 -10.517
  176    HA   ALA  24           HA       ALA  24  10.981   8.169 -12.358
  177   1HB   ALA  24          1HB       ALA  24  12.636   8.320 -10.509
  178   2HB   ALA  24          2HB       ALA  24  11.751   9.845 -10.706
  179   3HB   ALA  24          3HB       ALA  24  11.353   8.754  -9.354
  180    H    ALA  25           H        ALA  25   9.698   7.105  -9.186
  181    HA   ALA  25           HA       ALA  25  10.907   4.415  -9.241
  182   1HB   ALA  25          1HB       ALA  25   9.544   3.993  -7.202
  183   2HB   ALA  25          2HB       ALA  25  10.358   5.566  -7.112
  184   3HB   ALA  25          3HB       ALA  25   8.615   5.488  -7.471
  185    H    PHE  26           H        PHE  26   8.102   5.742 -10.732
  186    HA   PHE  26           HA       PHE  26   6.302   3.377 -10.653
  187   1HB   PHE  26          1HB       PHE  26   5.185   5.460 -10.936
  188   2HB   PHE  26          2HB       PHE  26   6.242   6.006 -12.210
  189    HD1  PHE  26           HD1      PHE  26   5.246   6.018 -14.375
  190    HD2  PHE  26           HD2      PHE  26   3.947   3.026 -11.571
  191    HE1  PHE  26           HE1      PHE  26   3.591   5.198 -16.002
  192    HE2  PHE  26           HE2      PHE  26   2.283   2.233 -13.202
  193    HZ   PHE  26           HZ       PHE  26   2.090   3.324 -15.410
  194    H    ASP  27           H        ASP  27   8.586   4.789 -12.984
  195    HA   ASP  27           HA       ASP  27   8.266   2.763 -15.123
  196   1HB   ASP  27          1HB       ASP  27   9.361   5.162 -15.291
  197   2HB   ASP  27          2HB       ASP  27  10.824   4.382 -14.734
  198    H    MET  28           H        MET  28  10.337   3.155 -12.285
  199    HA   MET  28           HA       MET  28  12.178   0.921 -12.648
  200   1HB   MET  28          1HB       MET  28  12.193   2.780 -10.769
  201   2HB   MET  28          2HB       MET  28  11.146   1.688  -9.880
  202   1HG   MET  28          1HG       MET  28  13.019   0.671  -9.075
  203   2HG   MET  28          2HG       MET  28  13.289  -0.003 -10.691
  204   1HE   MET  28          1HE       MET  28  14.712   2.123  -7.905
  205   2HE   MET  28          2HE       MET  28  15.535   3.503  -8.691
  206   3HE   MET  28          3HE       MET  28  13.748   3.446  -8.634
  207    H    PHE  29           H        PHE  29   8.885   1.142 -11.390
  208    HA   PHE  29           HA       PHE  29   8.674  -1.575 -10.268
  209   1HB   PHE  29          1HB       PHE  29   6.230  -0.039 -11.281
  210   2HB   PHE  29          2HB       PHE  29   7.116   0.559  -9.904
  211    HD1  PHE  29           HD1      PHE  29   7.237  -3.088 -10.129
  212    HD2  PHE  29           HD2      PHE  29   4.807   0.185  -8.744
  213    HE1  PHE  29           HE1      PHE  29   6.025  -4.609  -8.622
  214    HE2  PHE  29           HE2      PHE  29   3.604  -1.356  -7.251
  215    HZ   PHE  29           HZ       PHE  29   4.223  -3.745  -7.169
  216    H    ASP  30           H        ASP  30   7.764  -0.100 -13.381
  217    HA   ASP  30           HA       ASP  30   6.607  -2.583 -14.532
  218   1HB   ASP  30          1HB       ASP  30   7.286   0.098 -15.862
  219   2HB   ASP  30          2HB       ASP  30   5.729  -0.416 -15.255
  220    H    ALA  31           H        ALA  31   8.871  -0.845 -16.527
  221    HA   ALA  31           HA       ALA  31  11.351  -2.196 -16.312
  222   1HB   ALA  31          1HB       ALA  31  11.228  -4.184 -17.819
  223   2HB   ALA  31          2HB       ALA  31  10.185  -4.368 -16.396
  224   3HB   ALA  31          3HB       ALA  31   9.466  -3.986 -17.982
  225    H    ASP  32           H        ASP  32   8.846  -1.760 -18.823
  226    HA   ASP  32           HA       ASP  32  10.874  -0.619 -20.782
  227   1HB   ASP  32          1HB       ASP  32   9.719  -2.159 -22.038
  228   2HB   ASP  32          2HB       ASP  32   8.777  -0.727 -22.387
  229    H    GLY  33           H        GLY  33   7.961   0.175 -18.958
  230   1HA   GLY  33          1HA       GLY  33   7.049   2.339 -18.304
  231   2HA   GLY  33          2HA       GLY  33   8.471   3.069 -19.015
  232    H    GLY  34           H        GLY  34   5.674   1.158 -20.199
  233   1HA   GLY  34          1HA       GLY  34   4.614   1.278 -22.434
  234   2HA   GLY  34          2HA       GLY  34   5.558   2.734 -22.774
  235    H    GLY  35           H        GLY  35   3.367   1.898 -20.084
  236   1HA   GLY  35          1HA       GLY  35   1.132   3.658 -20.800
  237   2HA   GLY  35          2HA       GLY  35   2.218   4.575 -19.747
  238    H    ASP  36           H        ASP  36   1.491   1.098 -19.700
  239    HA   ASP  36           HA       ASP  36   0.574   1.334 -16.785
  240   1HB   ASP  36          1HB       ASP  36  -1.506   0.851 -17.583
  241   2HB   ASP  36          2HB       ASP  36  -0.912  -0.789 -17.456
  242    H    ILE  37           H        ILE  37   0.767  -0.726 -15.619
  243    HA   ILE  37           HA       ILE  37   3.370  -2.152 -16.312
  244    HB   ILE  37           HB       ILE  37   2.159  -2.814 -13.688
  245   1HG1  ILE  37          1HG1      ILE  37   2.371   0.039 -14.306
  246   2HG1  ILE  37          2HG1      ILE  37   1.787  -0.751 -12.854
  247   1HG2  ILE  37          1HG2      ILE  37   4.505  -2.778 -12.932
  248   2HG2  ILE  37          2HG2      ILE  37   4.381  -3.671 -14.455
  249   3HG2  ILE  37          3HG2      ILE  37   5.032  -2.015 -14.452
  250   1HD1  ILE  37          1HD1      ILE  37   4.731  -0.018 -13.371
  251   2HD1  ILE  37          2HD1      ILE  37   3.605   0.751 -12.232
  252   3HD1  ILE  37          3HD1      ILE  37   4.145  -0.920 -11.948
  253    H    SER  38           H        SER  38   2.869  -4.465 -14.749
  254    HA   SER  38           HA       SER  38   0.486  -5.928 -15.740
  255   1HB   SER  38          1HB       SER  38   2.522  -5.655 -17.682
  256   2HB   SER  38          2HB       SER  38   2.749  -7.291 -17.057
  257    HG   SER  38           HG       SER  38   1.156  -6.856 -18.803
  258    H    THR  39           H        THR  39   1.271  -8.467 -15.662
  259    HA   THR  39           HA       THR  39   2.072  -8.911 -12.792
  260    HB   THR  39           HB       THR  39   1.691 -11.462 -13.891
  261    HG1  THR  39           HG1      THR  39   0.564 -11.209 -15.561
  262   1HG2  THR  39          1HG2      THR  39  -0.440 -11.522 -12.673
  263   2HG2  THR  39          2HG2      THR  39   0.755 -10.649 -11.685
  264   3HG2  THR  39          3HG2      THR  39  -0.503  -9.747 -12.571
  265    H    LYS  40           H        LYS  40   3.239  -9.606 -16.067
  266    HA   LYS  40           HA       LYS  40   5.586 -11.234 -15.248
  267   1HB   LYS  40          1HB       LYS  40   4.552 -11.565 -17.428
  268   2HB   LYS  40          2HB       LYS  40   4.852  -9.924 -17.939
  269   1HG   LYS  40          1HG       LYS  40   6.483 -12.332 -18.144
  270   2HG   LYS  40          2HG       LYS  40   7.381 -11.222 -17.142
  271   1HD   LYS  40          1HD       LYS  40   6.533  -9.704 -19.490
  272   2HD   LYS  40          2HD       LYS  40   8.120 -10.089 -18.892
  273   1HE   LYS  40          1HE       LYS  40   8.569 -11.475 -20.571
  274   2HE   LYS  40          2HE       LYS  40   7.206 -12.515 -20.182
  275   1HZ   LYS  40          1HZ       LYS  40   7.374 -10.316 -22.134
  276   2HZ   LYS  40          2HZ       LYS  40   5.895 -10.639 -21.473
  277   3HZ   LYS  40          3HZ       LYS  40   6.704 -11.817 -22.302
  278    H    GLU  41           H        GLU  41   4.882  -7.852 -16.003
  279    HA   GLU  41           HA       GLU  41   7.705  -6.904 -16.033
  280   1HB   GLU  41          1HB       GLU  41   6.865  -4.679 -16.342
  281   2HB   GLU  41          2HB       GLU  41   5.269  -5.100 -15.761
  282   1HG   GLU  41          1HG       GLU  41   6.525  -5.959 -18.437
  283   2HG   GLU  41          2HG       GLU  41   5.040  -6.655 -17.826
  284    H    LEU  42           H        LEU  42   4.980  -6.774 -13.749
  285    HA   LEU  42           HA       LEU  42   6.254  -5.180 -11.619
  286   1HB   LEU  42          1HB       LEU  42   3.863  -7.068 -11.719
  287   2HB   LEU  42          2HB       LEU  42   3.888  -5.335 -11.474
  288    HG   LEU  42           HG       LEU  42   5.103  -5.894  -9.168
  289   1HD1  LEU  42          1HD1      LEU  42   2.868  -6.069  -8.042
  290   2HD1  LEU  42          2HD1      LEU  42   2.848  -4.853  -9.328
  291   3HD1  LEU  42          3HD1      LEU  42   2.094  -6.443  -9.603
  292   1HD2  LEU  42          1HD2      LEU  42   3.710  -8.604  -9.710
  293   2HD2  LEU  42          2HD2      LEU  42   5.465  -8.343  -9.563
  294   3HD2  LEU  42          3HD2      LEU  42   4.415  -8.080  -8.159
  295    H    GLY  43           H        GLY  43   6.097  -8.624 -12.410
  296   1HA   GLY  43          1HA       GLY  43   7.149  -9.849 -10.003
  297   2HA   GLY  43          2HA       GLY  43   7.304 -10.546 -11.618
  298    H    THR  44           H        THR  44   8.746  -8.026 -12.525
  299    HA   THR  44           HA       THR  44  11.450  -9.123 -12.299
  300    HB   THR  44           HB       THR  44  10.419  -6.515 -13.487
  301    HG1  THR  44           HG1      THR  44  11.243  -7.611 -15.353
  302   1HG2  THR  44          1HG2      THR  44  12.673  -6.134 -14.503
  303   2HG2  THR  44          2HG2      THR  44  12.727  -5.960 -12.736
  304   3HG2  THR  44          3HG2      THR  44  13.359  -7.439 -13.504
  305    H    VAL  45           H        VAL  45  10.048  -6.078 -11.047
  306    HA   VAL  45           HA       VAL  45  12.440  -5.208  -9.579
  307    HB   VAL  45           HB       VAL  45   9.766  -4.140 -10.045
  308   1HG1  VAL  45          1HG1      VAL  45   9.468  -2.810  -7.953
  309   2HG1  VAL  45          2HG1      VAL  45   9.335  -4.539  -7.607
  310   3HG1  VAL  45          3HG1      VAL  45  10.826  -3.670  -7.181
  311   1HG2  VAL  45          1HG2      VAL  45  12.368  -2.737  -9.140
  312   2HG2  VAL  45          2HG2      VAL  45  11.854  -2.991 -10.824
  313   3HG2  VAL  45          3HG2      VAL  45  10.908  -1.930  -9.771
  314    H    MET  46           H        MET  46   9.504  -7.002  -8.697
  315    HA   MET  46           HA       MET  46   9.953  -7.074  -5.780
  316   1HB   MET  46          1HB       MET  46   7.686  -7.401  -6.607
  317   2HB   MET  46          2HB       MET  46   8.193  -8.812  -5.696
  318   1HG   MET  46          1HG       MET  46   7.648  -8.580  -8.681
  319   2HG   MET  46          2HG       MET  46   8.836  -9.782  -8.149
  320   1HE   MET  46          1HE       MET  46   7.927 -10.770  -5.289
  321   2HE   MET  46          2HE       MET  46   6.792 -12.093  -5.690
  322   3HE   MET  46          3HE       MET  46   8.315 -11.917  -6.609
  323    NH1  ARG  47           NH1      ARG  47  16.705 -11.337 -12.039
  324    NH2  ARG  47           NH2      ARG  47  17.963 -12.271 -10.393
  325    H    ARG  47           H        ARG  47  10.960  -9.059  -8.498
  326    HA   ARG  47           HA       ARG  47  11.864 -11.417  -6.903
  327   1HB   ARG  47          1HB       ARG  47  11.943 -10.651  -9.843
  328   2HB   ARG  47          2HB       ARG  47  11.184 -12.024  -9.048
  329   1HG   ARG  47          1HG       ARG  47  13.794 -12.642  -8.465
  330   2HG   ARG  47          2HG       ARG  47  12.933 -13.216  -9.893
  331   1HD   ARG  47          1HD       ARG  47  14.097 -11.793 -11.375
  332   2HD   ARG  47          2HD       ARG  47  14.256 -10.511 -10.184
  333    HE   ARG  47           HE       ARG  47  15.957 -12.443  -9.089
  334   1HH1  ARG  47          1HH1      ARG  47  15.776 -11.031 -12.350
  335   2HH1  ARG  47          2HH1      ARG  47  17.581 -11.278 -12.569
  336   1HH2  ARG  47          1HH2      ARG  47  17.997 -12.677  -9.451
  337   2HH2  ARG  47          2HH2      ARG  47  18.751 -12.147 -11.038
  338    H    MET  48           H        MET  48  13.292  -8.493  -8.226
  339    HA   MET  48           HA       MET  48  16.086  -9.085  -8.373
  340   1HB   MET  48          1HB       MET  48  16.179  -6.490  -7.344
  341   2HB   MET  48          2HB       MET  48  14.544  -6.556  -7.976
  342   1HG   MET  48          1HG       MET  48  16.403  -7.687  -9.975
  343   2HG   MET  48          2HG       MET  48  15.263  -6.339 -10.130
  344   1HE   MET  48          1HE       MET  48  16.316  -4.470  -7.563
  345   2HE   MET  48          2HE       MET  48  17.389  -3.352  -8.454
  346   3HE   MET  48          3HE       MET  48  15.797  -3.794  -9.138
  347    H    LEU  49           H        LEU  49  14.071  -8.459  -5.551
  348    HA   LEU  49           HA       LEU  49  16.447  -8.530  -3.648
  349   1HB   LEU  49          1HB       LEU  49  15.047  -6.728  -3.070
  350   2HB   LEU  49          2HB       LEU  49  14.676  -7.960  -1.883
  351    HG   LEU  49           HG       LEU  49  12.735  -8.424  -3.906
  352   1HD1  LEU  49          1HD1      LEU  49  12.939  -5.379  -3.467
  353   2HD1  LEU  49          2HD1      LEU  49  13.419  -6.207  -4.960
  354   3HD1  LEU  49          3HD1      LEU  49  11.718  -6.242  -4.436
  355   1HD2  LEU  49          1HD2      LEU  49  11.094  -7.667  -2.237
  356   2HD2  LEU  49          2HD2      LEU  49  12.420  -8.458  -1.350
  357   3HD2  LEU  49          3HD2      LEU  49  12.319  -6.692  -1.385
  358    H    GLY  50           H        GLY  50  13.402 -10.219  -4.377
  359   1HA   GLY  50          1HA       GLY  50  13.871 -12.311  -2.219
  360   2HA   GLY  50          2HA       GLY  50  12.398 -12.136  -3.179
  361    H    GLN  51           H        GLN  51  12.073 -13.382  -4.867
  362    HA   GLN  51           HA       GLN  51  14.324 -15.008  -6.156
  363   1HB   GLN  51          1HB       GLN  51  12.318 -16.061  -4.241
  364   2HB   GLN  51          2HB       GLN  51  12.246 -16.886  -5.787
  365   1HG   GLN  51          1HG       GLN  51  14.983 -16.915  -5.401
  366   2HG   GLN  51          2HG       GLN  51  14.464 -16.869  -3.731
  367   1HE2  GLN  51          1HE2      GLN  51  12.958 -20.218  -3.888
  368   2HE2  GLN  51          2HE2      GLN  51  12.648 -18.546  -3.199
  369    H    ASN  52           H        ASN  52  12.692 -16.678  -7.622
  370    HA   ASN  52           HA       ASN  52  11.166 -14.731  -9.412
  371   1HB   ASN  52          1HB       ASN  52  13.434 -15.782 -10.241
  372   2HB   ASN  52          2HB       ASN  52  12.549 -17.276 -10.460
  373   1HD2  ASN  52          1HD2      ASN  52  12.149 -15.839 -13.790
  374   2HD2  ASN  52          2HD2      ASN  52  13.082 -17.019 -12.739
  375    HA   PRO  53           HA       PRO  53   7.890 -17.867  -7.762
  376   1HB   PRO  53          1HB       PRO  53   6.122 -15.595  -8.712
  377   2HB   PRO  53          2HB       PRO  53   6.121 -16.528  -7.209
  378   1HG   PRO  53          1HG       PRO  53   7.092 -13.957  -7.323
  379   2HG   PRO  53          2HG       PRO  53   7.671 -15.132  -6.119
  380   1HD   PRO  53          1HD       PRO  53   9.792 -14.777  -7.179
  381   2HD   PRO  53          2HD       PRO  53   9.053 -14.138  -8.674
  382    H    THR  54           H        THR  54   5.860 -18.544  -9.041
  383    HA   THR  54           HA       THR  54   6.680 -19.176 -11.890
  384    HB   THR  54           HB       THR  54   5.909 -21.008 -10.294
  385    HG1  THR  54           HG1      THR  54   5.196 -22.094 -11.951
  386   1HG2  THR  54          1HG2      THR  54   3.491 -21.488 -10.094
  387   2HG2  THR  54          2HG2      THR  54   3.862 -19.937  -9.307
  388   3HG2  THR  54          3HG2      THR  54   3.075 -19.960 -10.906
  389    H    LYS  55           H        LYS  55   4.995 -19.068 -13.564
  390    HA   LYS  55           HA       LYS  55   4.130 -16.343 -13.971
  391   1HB   LYS  55          1HB       LYS  55   3.794 -18.937 -15.448
  392   2HB   LYS  55          2HB       LYS  55   2.512 -17.785 -15.757
  393   1HG   LYS  55          1HG       LYS  55   3.917 -17.167 -17.440
  394   2HG   LYS  55          2HG       LYS  55   4.528 -16.070 -16.215
  395   1HD   LYS  55          1HD       LYS  55   6.013 -18.042 -17.713
  396   2HD   LYS  55          2HD       LYS  55   6.608 -16.954 -16.468
  397   1HE   LYS  55          1HE       LYS  55   5.690 -18.786 -14.758
  398   2HE   LYS  55          2HE       LYS  55   5.738 -19.871 -16.145
  399   1HZ   LYS  55          1HZ       LYS  55   7.949 -18.623 -14.686
  400   2HZ   LYS  55          2HZ       LYS  55   8.178 -18.811 -16.311
  401   3HZ   LYS  55          3HZ       LYS  55   7.852 -20.126 -15.366
  402    H    GLU  56           H        GLU  56   2.280 -19.258 -13.086
  403    HA   GLU  56           HA       GLU  56  -0.360 -17.971 -12.959
  404   1HB   GLU  56          1HB       GLU  56   0.682 -20.655 -11.950
  405   2HB   GLU  56          2HB       GLU  56  -0.948 -20.129 -11.576
  406   1HG   GLU  56          1HG       GLU  56  -1.543 -21.149 -13.535
  407   2HG   GLU  56          2HG       GLU  56   0.124 -21.289 -14.064
  408    H    GLU  57           H        GLU  57   2.171 -18.701 -10.590
  409    HA   GLU  57           HA       GLU  57   0.716 -18.149  -8.118
  410   1HB   GLU  57          1HB       GLU  57   3.073 -17.658  -7.145
  411   2HB   GLU  57          2HB       GLU  57   3.698 -18.075  -8.726
  412   1HG   GLU  57          1HG       GLU  57   1.865 -20.210  -7.792
  413   2HG   GLU  57          2HG       GLU  57   3.539 -20.332  -8.320
  414    H    LEU  58           H        LEU  58   2.425 -16.092 -10.416
  415    HA   LEU  58           HA       LEU  58   2.418 -13.606  -8.792
  416   1HB   LEU  58          1HB       LEU  58   3.462 -14.492 -11.377
  417   2HB   LEU  58          2HB       LEU  58   2.607 -12.979 -11.598
  418    HG   LEU  58           HG       LEU  58   4.509 -13.072  -9.242
  419   1HD1  LEU  58          1HD1      LEU  58   6.533 -12.643 -10.689
  420   2HD1  LEU  58          2HD1      LEU  58   5.911 -14.283 -10.925
  421   3HD1  LEU  58          3HD1      LEU  58   5.584 -13.029 -12.147
  422   1HD2  LEU  58          1HD2      LEU  58   3.997 -10.967 -11.444
  423   2HD2  LEU  58          2HD2      LEU  58   3.259 -10.988  -9.823
  424   3HD2  LEU  58          3HD2      LEU  58   5.007 -10.743  -9.993
  425    H    ASP  59           H        ASP  59   0.334 -15.160 -11.168
  426    HA   ASP  59           HA       ASP  59  -1.455 -12.929 -11.786
  427   1HB   ASP  59          1HB       ASP  59  -2.113 -15.924 -11.985
  428   2HB   ASP  59          2HB       ASP  59  -1.250 -15.007 -13.198
  429    H    ALA  60           H        ALA  60  -1.367 -15.327  -9.218
  430    HA   ALA  60           HA       ALA  60  -4.039 -14.836  -8.067
  431   1HB   ALA  60          1HB       ALA  60  -3.201 -16.123  -6.107
  432   2HB   ALA  60          2HB       ALA  60  -2.812 -16.940  -7.633
  433   3HB   ALA  60          3HB       ALA  60  -1.539 -16.068  -6.741
  434    H    ILE  61           H        ILE  61  -0.837 -13.436  -7.634
  435    HA   ILE  61           HA       ILE  61  -1.357 -11.952  -5.129
  436    HB   ILE  61           HB       ILE  61   0.903 -12.133  -7.070
  437   1HG1  ILE  61          1HG1      ILE  61   0.390 -12.800  -4.294
  438   2HG1  ILE  61          2HG1      ILE  61   1.788 -13.192  -5.273
  439   1HG2  ILE  61          1HG2      ILE  61   2.075 -10.062  -6.267
  440   2HG2  ILE  61          2HG2      ILE  61   0.594  -9.643  -7.125
  441   3HG2  ILE  61          3HG2      ILE  61   0.628  -9.578  -5.348
  442   1HD1  ILE  61          1HD1      ILE  61   1.534 -10.643  -3.569
  443   2HD1  ILE  61          2HD1      ILE  61   2.562 -12.059  -3.263
  444   3HD1  ILE  61          3HD1      ILE  61   2.900 -11.009  -4.660
  445    H    ILE  62           H        ILE  62  -1.595 -11.281  -8.589
  446    HA   ILE  62           HA       ILE  62  -2.237  -8.380  -8.291
  447    HB   ILE  62           HB       ILE  62  -2.175 -10.254 -10.695
  448   1HG1  ILE  62          1HG1      ILE  62  -0.316  -8.216  -9.498
  449   2HG1  ILE  62          2HG1      ILE  62   0.041  -9.648 -10.439
  450   1HG2  ILE  62          1HG2      ILE  62  -2.725  -8.321 -12.201
  451   2HG2  ILE  62          2HG2      ILE  62  -4.080  -8.665 -11.128
  452   3HG2  ILE  62          3HG2      ILE  62  -3.020  -7.278 -10.788
  453   1HD1  ILE  62          1HD1      ILE  62  -0.820  -6.955 -11.651
  454   2HD1  ILE  62          2HD1      ILE  62   0.787  -7.709 -11.703
  455   3HD1  ILE  62          3HD1      ILE  62  -0.566  -8.456 -12.583
  456    H    GLU  63           H        GLU  63  -3.965 -11.429  -8.592
  457    HA   GLU  63           HA       GLU  63  -6.633 -10.639  -9.224
  458   1HB   GLU  63          1HB       GLU  63  -6.303 -12.948  -9.102
  459   2HB   GLU  63          2HB       GLU  63  -5.540 -12.899  -7.524
  460   1HG   GLU  63          1HG       GLU  63  -7.751 -13.944  -7.321
  461   2HG   GLU  63          2HG       GLU  63  -7.768 -12.425  -6.441
  462    H    GLU  64           H        GLU  64  -4.825 -10.235  -6.235
  463    HA   GLU  64           HA       GLU  64  -7.120  -9.557  -4.490
  464   1HB   GLU  64          1HB       GLU  64  -4.117  -9.594  -4.164
  465   2HB   GLU  64          2HB       GLU  64  -5.030  -8.607  -3.038
  466   1HG   GLU  64          1HG       GLU  64  -6.339 -11.227  -3.224
  467   2HG   GLU  64          2HG       GLU  64  -4.615 -11.486  -3.021
  468    H    VAL  65           H        VAL  65  -4.343  -7.413  -4.701
  469    HA   VAL  65           HA       VAL  65  -5.666  -4.974  -4.143
  470    HB   VAL  65           HB       VAL  65  -3.450  -4.610  -3.944
  471   1HG1  VAL  65          1HG1      VAL  65  -3.618  -3.632  -6.868
  472   2HG1  VAL  65          2HG1      VAL  65  -4.359  -2.780  -5.501
  473   3HG1  VAL  65          3HG1      VAL  65  -2.592  -2.985  -5.564
  474   1HG2  VAL  65          1HG2      VAL  65  -1.595  -5.495  -5.273
  475   2HG2  VAL  65          2HG2      VAL  65  -2.757  -6.829  -5.080
  476   3HG2  VAL  65          3HG2      VAL  65  -2.672  -5.953  -6.614
  477    H    ASP  66           H        ASP  66  -5.380  -6.660  -7.219
  478    HA   ASP  66           HA       ASP  66  -6.669  -4.450  -8.808
  479   1HB   ASP  66          1HB       ASP  66  -6.273  -7.217  -9.993
  480   2HB   ASP  66          2HB       ASP  66  -4.850  -6.280  -9.602
  481    H    GLU  67           H        GLU  67  -8.515  -4.431  -7.366
  482    HA   GLU  67           HA       GLU  67 -10.507  -6.690  -7.464
  483   1HB   GLU  67          1HB       GLU  67  -9.974  -5.222  -5.397
  484   2HB   GLU  67          2HB       GLU  67 -10.911  -3.950  -6.157
  485   1HG   GLU  67          1HG       GLU  67 -12.649  -4.864  -4.950
  486   2HG   GLU  67          2HG       GLU  67 -12.775  -5.972  -6.306
  487    H    ASP  68           H        ASP  68  -9.721  -5.141  -9.926
  488    HA   ASP  68           HA       ASP  68 -12.384  -3.835 -10.683
  489   1HB   ASP  68          1HB       ASP  68 -11.335  -2.173 -11.782
  490   2HB   ASP  68          2HB       ASP  68 -10.265  -3.269 -12.625
  491    H    GLY  69           H        GLY  69  -9.670  -5.692 -12.120
  492   1HA   GLY  69          1HA       GLY  69 -10.600  -8.034 -13.127
  493   2HA   GLY  69          2HA       GLY  69 -11.598  -6.967 -14.123
  494    H    SER  70           H        SER  70  -9.522  -4.892 -14.290
  495    HA   SER  70           HA       SER  70  -8.451  -5.339 -16.867
  496   1HB   SER  70          1HB       SER  70  -8.393  -3.116 -16.031
  497   2HB   SER  70          2HB       SER  70  -6.703  -3.559 -16.290
  498    HG   SER  70           HG       SER  70  -8.145  -3.246 -13.915
  499    H    GLY  71           H        GLY  71  -6.581  -5.664 -13.818
  500   1HA   GLY  71          1HA       GLY  71  -4.979  -7.990 -15.013
  501   2HA   GLY  71          2HA       GLY  71  -5.189  -7.692 -13.282
  502    H    THR  72           H        THR  72  -4.472  -5.160 -15.610
  503    HA   THR  72           HA       THR  72  -1.561  -4.969 -14.774
  504    HB   THR  72           HB       THR  72  -1.468  -3.048 -16.465
  505    HG1  THR  72           HG1      THR  72  -3.606  -2.614 -16.667
  506   1HG2  THR  72          1HG2      THR  72  -1.316  -4.470 -18.470
  507   2HG2  THR  72          2HG2      THR  72  -0.587  -5.333 -17.098
  508   3HG2  THR  72          3HG2      THR  72  -2.208  -5.792 -17.684
  509    H    ILE  73           H        ILE  73  -0.732  -3.238 -13.677
  510    HA   ILE  73           HA       ILE  73  -2.693  -1.526 -12.088
  511    HB   ILE  73           HB       ILE  73   0.202  -2.330 -11.556
  512   1HG1  ILE  73          1HG1      ILE  73  -2.183  -2.659  -9.647
  513   2HG1  ILE  73          2HG1      ILE  73  -1.920  -3.819 -10.932
  514   1HG2  ILE  73          1HG2      ILE  73   0.235  -0.885  -9.527
  515   2HG2  ILE  73          2HG2      ILE  73  -0.037   0.116 -10.960
  516   3HG2  ILE  73          3HG2      ILE  73  -1.397  -0.271  -9.879
  517   1HD1  ILE  73          1HD1      ILE  73   0.102  -3.245  -8.688
  518   2HD1  ILE  73          2HD1      ILE  73  -0.911  -4.690  -8.893
  519   3HD1  ILE  73          3HD1      ILE  73   0.388  -4.349 -10.061
  520    H    ASP  74           H        ASP  74  -3.193   0.027 -13.558
  521    HA   ASP  74           HA       ASP  74  -1.323   1.481 -15.283
  522   1HB   ASP  74          1HB       ASP  74  -3.092   2.837 -15.972
  523   2HB   ASP  74          2HB       ASP  74  -3.855   2.879 -14.400
  524    H    PHE  75           H        PHE  75  -1.421   4.060 -14.996
  525    HA   PHE  75           HA       PHE  75   0.340   4.663 -12.677
  526   1HB   PHE  75          1HB       PHE  75  -0.812   6.522 -14.845
  527   2HB   PHE  75          2HB       PHE  75   0.727   5.706 -14.906
  528    HD1  PHE  75           HD1      PHE  75   1.221   6.259 -11.724
  529    HD2  PHE  75           HD2      PHE  75   0.269   8.749 -15.102
  530    HE1  PHE  75           HE1      PHE  75   2.264   8.189 -10.609
  531    HE2  PHE  75           HE2      PHE  75   1.325  10.666 -13.972
  532    HZ   PHE  75           HZ       PHE  75   2.320  10.392 -11.729
  533    H    GLU  76           H        GLU  76  -2.976   5.421 -13.679
  534    HA   GLU  76           HA       GLU  76  -3.678   7.321 -11.570
  535   1HB   GLU  76          1HB       GLU  76  -5.902   5.636 -12.657
  536   2HB   GLU  76          2HB       GLU  76  -5.804   7.363 -12.385
  537   1HG   GLU  76          1HG       GLU  76  -4.175   6.135 -14.667
  538   2HG   GLU  76          2HG       GLU  76  -5.904   6.345 -14.850
  539    H    GLU  77           H        GLU  77  -4.118   3.804 -11.879
  540    HA   GLU  77           HA       GLU  77  -5.415   3.416  -9.232
  541   1HB   GLU  77          1HB       GLU  77  -6.066   1.625 -10.410
  542   2HB   GLU  77          2HB       GLU  77  -4.716   1.706 -11.519
  543   1HG   GLU  77          1HG       GLU  77  -4.753   0.314  -8.771
  544   2HG   GLU  77          2HG       GLU  77  -3.262   0.571  -9.669
  545    H    PHE  78           H        PHE  78  -2.140   3.315 -10.494
  546    HA   PHE  78           HA       PHE  78  -0.671   1.997  -8.435
  547   1HB   PHE  78          1HB       PHE  78   0.348   2.845 -10.567
  548   2HB   PHE  78          2HB       PHE  78   0.214   4.497 -10.019
  549    HD1  PHE  78           HD1      PHE  78   1.116   1.969  -7.451
  550    HD2  PHE  78           HD2      PHE  78   2.727   4.658 -10.399
  551    HE1  PHE  78           HE1      PHE  78   3.342   1.790  -6.415
  552    HE2  PHE  78           HE2      PHE  78   4.947   4.455  -9.358
  553    HZ   PHE  78           HZ       PHE  78   5.261   3.020  -7.371
  554    H    LEU  79           H        LEU  79  -1.540   5.456  -8.624
  555    HA   LEU  79           HA       LEU  79  -0.452   6.201  -5.979
  556   1HB   LEU  79          1HB       LEU  79  -2.083   8.282  -6.391
  557   2HB   LEU  79          2HB       LEU  79  -2.256   7.612  -7.999
  558    HG   LEU  79           HG       LEU  79   0.584   8.005  -6.994
  559   1HD1  LEU  79          1HD1      LEU  79  -1.112  10.391  -7.963
  560   2HD1  LEU  79          2HD1      LEU  79  -0.655  10.112  -6.272
  561   3HD1  LEU  79          3HD1      LEU  79   0.606  10.420  -7.491
  562   1HD2  LEU  79          1HD2      LEU  79   1.071   8.526  -9.347
  563   2HD2  LEU  79          2HD2      LEU  79   0.041   7.074  -9.336
  564   3HD2  LEU  79          3HD2      LEU  79  -0.661   8.646  -9.745
  565    H    VAL  80           H        VAL  80  -3.531   4.996  -7.145
  566    HA   VAL  80           HA       VAL  80  -5.242   5.656  -4.879
  567    HB   VAL  80           HB       VAL  80  -5.492   3.339  -6.863
  568   1HG1  VAL  80          1HG1      VAL  80  -7.881   3.140  -6.139
  569   2HG1  VAL  80          2HG1      VAL  80  -6.787   2.760  -4.803
  570   3HG1  VAL  80          3HG1      VAL  80  -7.608   4.337  -4.846
  571   1HG2  VAL  80          1HG2      VAL  80  -7.005   6.032  -6.786
  572   2HG2  VAL  80          2HG2      VAL  80  -5.728   5.606  -7.949
  573   3HG2  VAL  80          3HG2      VAL  80  -7.256   4.713  -7.956
  574    H    MET  81           H        MET  81  -2.906   3.090  -5.471
  575    HA   MET  81           HA       MET  81  -3.522   1.286  -3.258
  576   1HB   MET  81          1HB       MET  81  -2.066   0.407  -4.935
  577   2HB   MET  81          2HB       MET  81  -0.972   1.776  -4.857
  578   1HG   MET  81          1HG       MET  81  -0.119   1.050  -2.622
  579   2HG   MET  81          2HG       MET  81   0.051  -0.242  -3.823
  580   1HE   MET  81          1HE       MET  81  -0.887  -2.537  -3.677
  581   2HE   MET  81          2HE       MET  81  -2.372  -3.003  -2.793
  582   3HE   MET  81          3HE       MET  81  -2.481  -1.907  -4.201
  583    H    MET  82           H        MET  82  -1.082   3.890  -3.509
  584    HA   MET  82           HA       MET  82  -0.128   3.689  -0.734
  585   1HB   MET  82          1HB       MET  82   0.268   5.709  -2.969
  586   2HB   MET  82          2HB       MET  82   0.725   6.173  -1.341
  587   1HG   MET  82          1HG       MET  82   1.754   3.466  -2.216
  588   2HG   MET  82          2HG       MET  82   2.375   4.850  -3.124
  589   1HE   MET  82          1HE       MET  82   1.455   4.404   0.947
  590   2HE   MET  82          2HE       MET  82   3.109   3.851   1.344
  591   3HE   MET  82          3HE       MET  82   2.121   2.931   0.173
  592    H    VAL  83           H        VAL  83  -2.742   5.430  -2.287
  593    HA   VAL  83           HA       VAL  83  -3.158   7.483  -0.169
  594    HB   VAL  83           HB       VAL  83  -4.178   7.031  -2.844
  595   1HG1  VAL  83          1HG1      VAL  83  -6.547   7.780  -2.582
  596   2HG1  VAL  83          2HG1      VAL  83  -6.304   6.208  -1.809
  597   3HG1  VAL  83          3HG1      VAL  83  -6.410   7.675  -0.808
  598   1HG2  VAL  83          1HG2      VAL  83  -4.469   9.492  -0.996
  599   2HG2  VAL  83          2HG2      VAL  83  -3.118   9.185  -2.111
  600   3HG2  VAL  83          3HG2      VAL  83  -4.741   9.465  -2.757
  601    NH1  ARG  84           NH1      ARG  84  -8.189  -1.456  -1.664
  602    NH2  ARG  84           NH2      ARG  84 -10.265  -0.609  -2.024
  603    H    ARG  84           H        ARG  84  -4.436   4.308  -1.021
  604    HA   ARG  84           HA       ARG  84  -6.872   4.183   0.580
  605   1HB   ARG  84          1HB       ARG  84  -5.114   2.213  -0.803
  606   2HB   ARG  84          2HB       ARG  84  -5.827   1.571   0.668
  607   1HG   ARG  84          1HG       ARG  84  -7.770   3.061  -1.075
  608   2HG   ARG  84          2HG       ARG  84  -7.995   1.574  -0.151
  609   1HD   ARG  84          1HD       ARG  84  -6.397   0.439  -1.930
  610   2HD   ARG  84          2HD       ARG  84  -6.668   1.875  -2.919
  611    HE   ARG  84           HE       ARG  84  -8.972   1.143  -3.291
  612   1HH1  ARG  84          1HH1      ARG  84  -7.174  -1.318  -1.724
  613   2HH1  ARG  84          2HH1      ARG  84  -8.676  -2.287  -1.311
  614   1HH2  ARG  84          1HH2      ARG  84 -10.835   0.181  -2.346
  615   2HH2  ARG  84          2HH2      ARG  84 -10.607  -1.502  -1.653
  616    H    GLN  85           H        GLN  85  -3.539   3.114   1.343
  617    HA   GLN  85           HA       GLN  85  -4.003   2.242   4.084
  618   1HB   GLN  85          1HB       GLN  85  -1.915   1.897   2.486
  619   2HB   GLN  85          2HB       GLN  85  -1.760   1.842   4.231
  620   1HG   GLN  85          1HG       GLN  85  -0.481   3.659   2.301
  621   2HG   GLN  85          2HG       GLN  85  -1.313   4.604   3.516
  622   1HE2  GLN  85          1HE2      GLN  85   2.112   3.987   4.881
  623   2HE2  GLN  85          2HE2      GLN  85   1.217   5.023   3.659
  624    H    MET  86           H        MET  86  -3.280   5.381   2.655
  625    HA   MET  86           HA       MET  86  -2.556   6.905   5.028
  626   1HB   MET  86          1HB       MET  86  -3.158   7.542   2.230
  627   2HB   MET  86          2HB       MET  86  -3.963   8.696   3.278
  628   1HG   MET  86          1HG       MET  86  -1.340   8.524   4.391
  629   2HG   MET  86          2HG       MET  86  -1.085   8.462   2.639
  630   1HE   MET  86          1HE       MET  86  -4.014  10.013   1.846
  631   2HE   MET  86          2HE       MET  86  -3.387  11.664   1.564
  632   3HE   MET  86          3HE       MET  86  -2.507  10.253   0.906
  633    H    LYS  87           H        LYS  87  -5.655   6.038   3.586
  634    HA   LYS  87           HA       LYS  87  -7.480   7.809   4.973
  635   1HB   LYS  87          1HB       LYS  87  -9.185   5.818   4.746
  636   2HB   LYS  87          2HB       LYS  87  -7.892   4.962   3.920
  637   1HG   LYS  87          1HG       LYS  87  -9.482   6.086   2.344
  638   2HG   LYS  87          2HG       LYS  87  -7.810   6.556   2.087
  639   1HD   LYS  87          1HD       LYS  87  -9.018   8.451   3.966
  640   2HD   LYS  87          2HD       LYS  87  -8.308   8.737   2.382
  641   1HE   LYS  87          1HE       LYS  87 -10.745   9.496   2.552
  642   2HE   LYS  87          2HE       LYS  87 -10.452   8.365   1.224
  643   1HZ   LYS  87          1HZ       LYS  87 -12.084   7.164   2.119
  644   2HZ   LYS  87          2HZ       LYS  87 -12.111   8.030   3.525
  645   3HZ   LYS  87          3HZ       LYS  87 -11.076   6.753   3.361
  646    H    GLU  88           H        GLU  88  -9.076   7.042   6.647
  647    HA   GLU  88           HA       GLU  88  -7.906   6.678   9.219
  648   1HB   GLU  88          1HB       GLU  88 -10.113   7.500   9.181
  649   2HB   GLU  88          2HB       GLU  88 -10.198   5.968  10.029
  650   1HG   GLU  88          1HG       GLU  88 -10.746   5.633   7.116
  651   2HG   GLU  88          2HG       GLU  88 -11.806   6.829   7.840
  652    H    ASP  89           H        ASP  89  -8.993   4.276   6.871
  653    HA   ASP  89           HA       ASP  89  -8.829   1.787   8.282
  654   1HB   ASP  89          1HB       ASP  89  -7.717   2.101   5.443
  655   2HB   ASP  89          2HB       ASP  89  -8.348   0.654   6.195
  656    H    ALA  90           H        ALA  90  -7.143   0.291   8.568
  657    HA   ALA  90           HA       ALA  90  -4.914  -0.459   9.146
  658   1HB   ALA  90          1HB       ALA  90  -2.927   0.816   8.299
  659   2HB   ALA  90          2HB       ALA  90  -4.101   0.544   6.996
  660   3HB   ALA  90          3HB       ALA  90  -3.976   2.149   7.757
   
  Start of MODEL          16
 Raw file had  660 H/Q atoms
  Start of MODEL   16
    1   1H    ALA   1          1H        ALA   1 -23.464   0.869 -19.603
    2   2H    ALA   1          2H        ALA   1 -23.171   0.608 -21.239
    3   3H    ALA   1          3H        ALA   1 -22.319  -0.266 -20.082
    4    HA   ALA   1           HA       ALA   1 -20.794   1.269 -20.767
    5   1HB   ALA   1          1HB       ALA   1 -22.791   2.583 -21.969
    6   2HB   ALA   1          2HB       ALA   1 -21.285   3.433 -21.571
    7   3HB   ALA   1          3HB       ALA   1 -22.722   3.637 -20.536
    8    H    SER   2           H        SER   2 -19.671   1.061 -18.942
    9    HA   SER   2           HA       SER   2 -20.703   2.049 -16.255
   10   1HB   SER   2          1HB       SER   2 -18.815  -0.066 -17.124
   11   2HB   SER   2          2HB       SER   2 -18.187   0.900 -15.787
   12    HG   SER   2           HG       SER   2 -20.853  -0.028 -15.795
   13    H    MET   3           H        MET   3 -19.484   3.471 -14.986
   14    HA   MET   3           HA       MET   3 -17.648   5.378 -16.534
   15   1HB   MET   3          1HB       MET   3 -19.748   6.472 -16.003
   16   2HB   MET   3          2HB       MET   3 -19.694   5.962 -14.326
   17   1HG   MET   3          1HG       MET   3 -18.820   8.037 -13.901
   18   2HG   MET   3          2HG       MET   3 -17.294   7.404 -14.534
   19   1HE   MET   3          1HE       MET   3 -16.594  10.155 -16.970
   20   2HE   MET   3          2HE       MET   3 -16.003   8.745 -16.042
   21   3HE   MET   3          3HE       MET   3 -16.690  10.153 -15.180
   22    H    THR   4           H        THR   4 -18.308   5.359 -13.077
   23    HA   THR   4           HA       THR   4 -17.013   4.893 -11.145
   24    HB   THR   4           HB       THR   4 -15.274   3.176 -12.952
   25    HG1  THR   4           HG1      THR   4 -17.761   2.848 -11.731
   26   1HG2  THR   4          1HG2      THR   4 -14.129   3.302 -10.804
   27   2HG2  THR   4          2HG2      THR   4 -14.983   1.743 -10.849
   28   3HG2  THR   4          3HG2      THR   4 -15.640   3.096  -9.891
   29    H    ASP   5           H        ASP   5 -16.289   6.874 -10.657
   30    HA   ASP   5           HA       ASP   5 -13.858   8.108 -11.951
   31   1HB   ASP   5          1HB       ASP   5 -15.111   9.302  -9.455
   32   2HB   ASP   5          2HB       ASP   5 -14.284  10.092 -10.778
   33    H    GLN   6           H        GLN   6 -12.583   6.207 -11.404
   34    HA   GLN   6           HA       GLN   6 -11.884   5.658  -8.508
   35   1HB   GLN   6          1HB       GLN   6 -10.146   4.094 -10.033
   36   2HB   GLN   6          2HB       GLN   6 -11.521   4.240 -11.112
   37   1HG   GLN   6          1HG       GLN   6 -11.531   3.087  -8.264
   38   2HG   GLN   6          2HG       GLN   6 -13.016   3.472  -9.105
   39   1HE2  GLN   6          1HE2      GLN   6 -10.764   0.494 -10.963
   40   2HE2  GLN   6          2HE2      GLN   6 -10.015   2.113 -10.532
   41    H    GLN   7           H        GLN   7 -10.133   6.481 -11.522
   42    HA   GLN   7           HA       GLN   7  -7.563   7.133 -10.162
   43   1HB   GLN   7          1HB       GLN   7  -6.642   7.512 -12.292
   44   2HB   GLN   7          2HB       GLN   7  -7.898   6.327 -12.619
   45   1HG   GLN   7          1HG       GLN   7  -9.046   9.011 -12.923
   46   2HG   GLN   7          2HG       GLN   7  -7.569   8.901 -13.868
   47   1HE2  GLN   7          1HE2      GLN   7 -10.952   6.943 -15.107
   48   2HE2  GLN   7          2HE2      GLN   7 -10.882   8.021 -13.625
   49    H    ALA   8           H        ALA   8 -10.392   8.909 -11.288
   50    HA   ALA   8           HA       ALA   8  -9.457  11.640 -11.229
   51   1HB   ALA   8          1HB       ALA   8 -11.845  12.284 -10.940
   52   2HB   ALA   8          2HB       ALA   8 -11.664  11.005 -12.155
   53   3HB   ALA   8          3HB       ALA   8 -12.282  10.607 -10.532
   54    H    GLU   9           H        GLU   9 -10.452   9.467  -8.639
   55    HA   GLU   9           HA       GLU   9 -10.700  11.481  -6.482
   56   1HB   GLU   9          1HB       GLU   9 -10.446   8.416  -6.346
   57   2HB   GLU   9          2HB       GLU   9 -10.559   9.431  -4.916
   58   1HG   GLU   9          1HG       GLU   9 -12.753   8.320  -6.056
   59   2HG   GLU   9          2HG       GLU   9 -12.741   9.795  -7.016
   60    H    ALA  10           H        ALA  10  -8.228   8.988  -7.189
   61    HA   ALA  10           HA       ALA  10  -6.301   9.679  -5.112
   62   1HB   ALA  10          1HB       ALA  10  -4.658   8.389  -6.467
   63   2HB   ALA  10          2HB       ALA  10  -6.205   7.531  -6.341
   64   3HB   ALA  10          3HB       ALA  10  -5.772   8.367  -7.855
   65    NH1  ARG  11           NH1      ARG  11  -8.630  14.077 -13.588
   66    NH2  ARG  11           NH2      ARG  11  -8.482  11.829 -13.302
   67    H    ARG  11           H        ARG  11  -6.969  11.008  -8.291
   68    HA   ARG  11           HA       ARG  11  -4.442  12.499  -8.740
   69   1HB   ARG  11          1HB       ARG  11  -5.532  12.197 -10.769
   70   2HB   ARG  11          2HB       ARG  11  -7.136  12.341 -10.066
   71   1HG   ARG  11          1HG       ARG  11  -7.237  14.657 -10.256
   72   2HG   ARG  11          2HG       ARG  11  -5.496  14.888 -10.074
   73   1HD   ARG  11          1HD       ARG  11  -6.628  15.256 -12.456
   74   2HD   ARG  11          2HD       ARG  11  -5.035  14.503 -12.363
   75    HE   ARG  11           HE       ARG  11  -6.052  12.341 -12.973
   76   1HH1  ARG  11          1HH1      ARG  11  -8.164  14.990 -13.539
   77   2HH1  ARG  11          2HH1      ARG  11  -9.590  13.893 -13.897
   78   1HH2  ARG  11          1HH2      ARG  11  -7.901  11.025 -13.039
   79   2HH2  ARG  11          2HH2      ARG  11  -9.454  11.805 -13.628
   80    H    ALA  12           H        ALA  12  -7.745  13.722  -8.115
   81    HA   ALA  12           HA       ALA  12  -7.239  16.416  -7.400
   82   1HB   ALA  12          1HB       ALA  12  -9.331  16.376  -6.055
   83   2HB   ALA  12          2HB       ALA  12  -9.534  15.505  -7.588
   84   3HB   ALA  12          3HB       ALA  12  -9.343  14.596  -6.068
   85    H    PHE  13           H        PHE  13  -6.908  13.518  -5.376
   86    HA   PHE  13           HA       PHE  13  -6.486  14.746  -2.770
   87   1HB   PHE  13          1HB       PHE  13  -5.271  12.089  -3.708
   88   2HB   PHE  13          2HB       PHE  13  -6.966  12.266  -3.337
   89    HD1  PHE  13           HD1      PHE  13  -4.305  14.103  -1.408
   90    HD2  PHE  13           HD2      PHE  13  -6.890  10.661  -1.459
   91    HE1  PHE  13           HE1      PHE  13  -3.779  13.658   0.955
   92    HE2  PHE  13           HE2      PHE  13  -6.356  10.238   0.905
   93    HZ   PHE  13           HZ       PHE  13  -4.804  11.731   2.115
   94    H    LEU  14           H        LEU  14  -4.138  13.490  -5.166
   95    HA   LEU  14           HA       LEU  14  -1.752  14.610  -3.712
   96   1HB   LEU  14          1HB       LEU  14  -0.377  13.514  -5.346
   97   2HB   LEU  14          2HB       LEU  14  -1.666  13.417  -6.526
   98    HG   LEU  14           HG       LEU  14  -2.791  11.858  -4.547
   99   1HD1  LEU  14          1HD1      LEU  14   0.230  11.298  -4.286
  100   2HD1  LEU  14          2HD1      LEU  14  -0.737  12.144  -3.064
  101   3HD1  LEU  14          3HD1      LEU  14  -1.094  10.443  -3.453
  102   1HD2  LEU  14          1HD2      LEU  14  -2.146   9.886  -5.870
  103   2HD2  LEU  14          2HD2      LEU  14  -2.380  11.234  -7.010
  104   3HD2  LEU  14          3HD2      LEU  14  -0.741  10.735  -6.564
  105    H    SER  15           H        SER  15  -0.162  15.889  -5.023
  106    HA   SER  15           HA       SER  15  -1.537  18.185  -6.488
  107   1HB   SER  15          1HB       SER  15   1.369  18.289  -5.597
  108   2HB   SER  15          2HB       SER  15   0.206  19.601  -5.803
  109    HG   SER  15           HG       SER  15   0.508  17.760  -3.728
  110    H    GLU  16           H        GLU  16   0.363  19.217  -8.007
  111    HA   GLU  16           HA       GLU  16   0.601  17.362 -10.326
  112   1HB   GLU  16          1HB       GLU  16   1.819  20.159 -10.172
  113   2HB   GLU  16          2HB       GLU  16   0.094  19.918 -10.373
  114   1HG   GLU  16          1HG       GLU  16   0.668  20.079 -12.612
  115   2HG   GLU  16          2HG       GLU  16   0.890  18.346 -12.444
  116    H    GLU  17           H        GLU  17   2.693  18.722  -7.856
  117    HA   GLU  17           HA       GLU  17   5.281  17.915  -9.122
  118   1HB   GLU  17          1HB       GLU  17   4.712  19.823  -7.273
  119   2HB   GLU  17          2HB       GLU  17   6.317  19.195  -7.594
  120   1HG   GLU  17          1HG       GLU  17   4.582  17.870  -5.437
  121   2HG   GLU  17          2HG       GLU  17   6.330  17.843  -5.597
  122    H    MET  18           H        MET  18   3.040  16.650  -6.714
  123    HA   MET  18           HA       MET  18   4.683  14.520  -5.561
  124   1HB   MET  18          1HB       MET  18   2.429  13.442  -4.925
  125   2HB   MET  18          2HB       MET  18   1.632  14.763  -5.761
  126   1HG   MET  18          1HG       MET  18   1.607  15.567  -3.556
  127   2HG   MET  18          2HG       MET  18   3.083  16.343  -4.155
  128   1HE   MET  18          1HE       MET  18   1.505  13.866  -1.630
  129   2HE   MET  18          2HE       MET  18   2.845  13.931  -0.447
  130   3HE   MET  18          3HE       MET  18   2.086  15.446  -1.018
  131    H    ILE  19           H        ILE  19   2.620  14.737  -8.415
  132    HA   ILE  19           HA       ILE  19   2.555  11.902  -9.159
  133    HB   ILE  19           HB       ILE  19   1.910  14.471 -10.591
  134   1HG1  ILE  19          1HG1      ILE  19   0.359  11.813 -10.290
  135   2HG1  ILE  19          2HG1      ILE  19  -0.257  13.264 -11.053
  136   1HG2  ILE  19          1HG2      ILE  19   1.549  13.337 -12.798
  137   2HG2  ILE  19          2HG2      ILE  19   3.254  13.280 -12.357
  138   3HG2  ILE  19          3HG2      ILE  19   2.247  11.827 -12.163
  139   1HD1  ILE  19          1HD1      ILE  19  -0.239  14.536  -8.924
  140   2HD1  ILE  19          2HD1      ILE  19  -1.131  13.012  -8.735
  141   3HD1  ILE  19          3HD1      ILE  19   0.516  13.158  -8.079
  142    H    ALA  20           H        ALA  20   4.752  14.598  -9.855
  143    HA   ALA  20           HA       ALA  20   6.547  13.465 -11.810
  144   1HB   ALA  20          1HB       ALA  20   8.248  15.066 -10.942
  145   2HB   ALA  20          2HB       ALA  20   6.661  15.838 -11.121
  146   3HB   ALA  20          3HB       ALA  20   7.254  15.387  -9.502
  147    H    GLU  21           H        GLU  21   6.243  12.915  -8.347
  148    HA   GLU  21           HA       GLU  21   8.753  11.540  -7.806
  149   1HB   GLU  21          1HB       GLU  21   8.015  11.383  -5.699
  150   2HB   GLU  21          2HB       GLU  21   6.681  12.388  -6.232
  151   1HG   GLU  21          1HG       GLU  21   6.567   9.302  -6.177
  152   2HG   GLU  21          2HG       GLU  21   5.224  10.377  -6.527
  153    H    PHE  22           H        PHE  22   5.508  10.311  -8.660
  154    HA   PHE  22           HA       PHE  22   6.617   7.540  -9.243
  155   1HB   PHE  22          1HB       PHE  22   3.653   8.262  -9.462
  156   2HB   PHE  22          2HB       PHE  22   4.389   6.708  -9.178
  157    HD1  PHE  22           HD1      PHE  22   2.737   9.400  -7.546
  158    HD2  PHE  22           HD2      PHE  22   5.902   6.556  -6.895
  159    HE1  PHE  22           HE1      PHE  22   2.353   9.512  -5.120
  160    HE2  PHE  22           HE2      PHE  22   5.505   6.687  -4.470
  161    HZ   PHE  22           HZ       PHE  22   3.700   8.123  -3.582
  162    H    LYS  23           H        LYS  23   6.949  10.089 -10.925
  163    HA   LYS  23           HA       LYS  23   5.721   9.305 -13.592
  164   1HB   LYS  23          1HB       LYS  23   6.411  11.792 -12.585
  165   2HB   LYS  23          2HB       LYS  23   7.865  11.424 -13.486
  166   1HG   LYS  23          1HG       LYS  23   6.851  12.178 -15.360
  167   2HG   LYS  23          2HG       LYS  23   5.798  10.775 -15.304
  168   1HD   LYS  23          1HD       LYS  23   5.056  13.234 -13.643
  169   2HD   LYS  23          2HD       LYS  23   3.999  11.952 -14.246
  170   1HE   LYS  23          1HE       LYS  23   3.464  13.660 -15.777
  171   2HE   LYS  23          2HE       LYS  23   5.077  14.386 -15.720
  172   1HZ   LYS  23          1HZ       LYS  23   4.379  13.084 -17.803
  173   2HZ   LYS  23          2HZ       LYS  23   4.695  11.712 -16.939
  174   3HZ   LYS  23          3HZ       LYS  23   5.898  12.811 -17.214
  175    H    ALA  24           H        ALA  24   8.859   9.451 -11.930
  176    HA   ALA  24           HA       ALA  24  10.455   8.487 -14.264
  177   1HB   ALA  24          1HB       ALA  24  12.378   8.537 -12.689
  178   2HB   ALA  24          2HB       ALA  24  11.458  10.052 -12.629
  179   3HB   ALA  24          3HB       ALA  24  11.289   8.856 -11.319
  180    H    ALA  25           H        ALA  25   9.581   7.160 -11.055
  181    HA   ALA  25           HA       ALA  25  10.837   4.515 -11.441
  182   1HB   ALA  25          1HB       ALA  25   9.715   3.907  -9.305
  183   2HB   ALA  25          2HB       ALA  25  10.507   5.490  -9.183
  184   3HB   ALA  25          3HB       ALA  25   8.736   5.393  -9.355
  185    H    PHE  26           H        PHE  26   7.856   5.878 -12.500
  186    HA   PHE  26           HA       PHE  26   6.088   3.533 -12.458
  187   1HB   PHE  26          1HB       PHE  26   4.964   5.605 -12.706
  188   2HB   PHE  26          2HB       PHE  26   5.995   6.168 -13.995
  189    HD1  PHE  26           HD1      PHE  26   3.521   3.370 -13.259
  190    HD2  PHE  26           HD2      PHE  26   5.164   5.997 -16.243
  191    HE1  PHE  26           HE1      PHE  26   1.824   2.613 -14.875
  192    HE2  PHE  26           HE2      PHE  26   3.462   5.227 -17.846
  193    HZ   PHE  26           HZ       PHE  26   1.782   3.548 -17.163
  194    H    ASP  27           H        ASP  27   8.109   4.989 -15.022
  195    HA   ASP  27           HA       ASP  27   7.618   2.893 -17.050
  196   1HB   ASP  27          1HB       ASP  27   9.825   3.930 -18.103
  197   2HB   ASP  27          2HB       ASP  27   9.646   5.163 -16.876
  198    H    MET  28           H        MET  28   9.978   3.427 -14.500
  199    HA   MET  28           HA       MET  28  12.020   1.445 -15.265
  200   1HB   MET  28          1HB       MET  28  11.519   1.978 -12.320
  201   2HB   MET  28          2HB       MET  28  12.005   3.331 -13.325
  202   1HG   MET  28          1HG       MET  28  14.045   2.444 -12.399
  203   2HG   MET  28          2HG       MET  28  14.046   1.939 -14.097
  204   1HE   MET  28          1HE       MET  28  11.505   0.365 -11.498
  205   2HE   MET  28          2HE       MET  28  12.469  -0.957 -10.774
  206   3HE   MET  28          3HE       MET  28  12.886   0.746 -10.423
  207    H    PHE  29           H        PHE  29   8.978   1.318 -13.489
  208    HA   PHE  29           HA       PHE  29   9.158  -1.543 -12.646
  209   1HB   PHE  29          1HB       PHE  29   7.724   0.260 -11.489
  210   2HB   PHE  29          2HB       PHE  29   6.628   0.196 -12.843
  211    HD1  PHE  29           HD1      PHE  29   4.842  -1.402 -12.854
  212    HD2  PHE  29           HD2      PHE  29   8.197  -2.090 -10.245
  213    HE1  PHE  29           HE1      PHE  29   3.623  -3.233 -11.749
  214    HE2  PHE  29           HE2      PHE  29   6.956  -3.912  -9.151
  215    HZ   PHE  29           HZ       PHE  29   4.672  -4.482  -9.892
  216    H    ASP  30           H        ASP  30   7.888   0.335 -15.348
  217    HA   ASP  30           HA       ASP  30   6.562  -1.891 -16.787
  218   1HB   ASP  30          1HB       ASP  30   7.578   0.616 -18.205
  219   2HB   ASP  30          2HB       ASP  30   6.231   0.718 -17.095
  220    H    ALA  31           H        ALA  31   7.324  -3.135 -18.435
  221    HA   ALA  31           HA       ALA  31  10.300  -3.618 -18.553
  222   1HB   ALA  31          1HB       ALA  31   9.683  -5.702 -19.785
  223   2HB   ALA  31          2HB       ALA  31   8.797  -5.554 -18.255
  224   3HB   ALA  31          3HB       ALA  31   7.970  -5.220 -19.799
  225    H    ASP  32           H        ASP  32   7.641  -2.562 -20.630
  226    HA   ASP  32           HA       ASP  32   9.433  -2.212 -23.058
  227   1HB   ASP  32          1HB       ASP  32   7.196  -1.398 -24.151
  228   2HB   ASP  32          2HB       ASP  32   7.466  -3.103 -23.872
  229    H    GLY  33           H        GLY  33   7.013  -0.234 -21.295
  230   1HA   GLY  33          1HA       GLY  33   7.834   1.916 -20.127
  231   2HA   GLY  33          2HA       GLY  33   8.889   2.163 -21.499
  232    H    GLY  34           H        GLY  34   5.879   2.810 -20.104
  233   1HA   GLY  34          1HA       GLY  34   5.146   4.737 -22.309
  234   2HA   GLY  34          2HA       GLY  34   4.387   4.653 -20.716
  235    H    GLY  35           H        GLY  35   2.526   3.609 -20.466
  236   1HA   GLY  35          1HA       GLY  35   0.558   3.220 -22.364
  237   2HA   GLY  35          2HA       GLY  35   1.439   1.702 -22.575
  238    H    ASP  36           H        ASP  36   2.156   0.945 -20.113
  239    HA   ASP  36           HA       ASP  36   0.353   0.925 -17.904
  240   1HB   ASP  36          1HB       ASP  36  -1.587   0.370 -19.112
  241   2HB   ASP  36          2HB       ASP  36  -1.092  -1.135 -18.372
  242    H    ILE  37           H        ILE  37   0.223  -1.554 -17.024
  243    HA   ILE  37           HA       ILE  37   2.907  -2.935 -17.428
  244    HB   ILE  37           HB       ILE  37   2.019  -2.488 -14.578
  245   1HG1  ILE  37          1HG1      ILE  37   3.408  -0.361 -16.262
  246   2HG1  ILE  37          2HG1      ILE  37   2.162  -0.182 -15.043
  247   1HG2  ILE  37          1HG2      ILE  37   4.379  -2.952 -14.040
  248   2HG2  ILE  37          2HG2      ILE  37   3.746  -4.223 -15.096
  249   3HG2  ILE  37          3HG2      ILE  37   4.817  -2.969 -15.766
  250   1HD1  ILE  37          1HD1      ILE  37   5.119  -0.777 -14.434
  251   2HD1  ILE  37          2HD1      ILE  37   4.239   0.741 -14.159
  252   3HD1  ILE  37          3HD1      ILE  37   3.825  -0.704 -13.208
  253    H    SER  38           H        SER  38   2.274  -4.802 -18.142
  254    HA   SER  38           HA       SER  38  -0.118  -6.311 -17.128
  255   1HB   SER  38          1HB       SER  38   0.899  -6.375 -19.541
  256   2HB   SER  38          2HB       SER  38   2.072  -7.517 -18.880
  257    HG   SER  38           HG       SER  38  -0.607  -7.795 -19.380
  258    H    THR  39           H        THR  39   0.472  -8.746 -16.641
  259    HA   THR  39           HA       THR  39   1.899  -8.789 -14.032
  260    HB   THR  39           HB       THR  39   1.437 -11.470 -14.562
  261    HG1  THR  39           HG1      THR  39  -0.514 -11.604 -15.530
  262   1HG2  THR  39          1HG2      THR  39  -0.538 -11.312 -13.111
  263   2HG2  THR  39          2HG2      THR  39   0.725 -10.234 -12.472
  264   3HG2  THR  39          3HG2      THR  39  -0.662  -9.555 -13.365
  265    H    LYS  40           H        LYS  40   2.583  -9.744 -17.345
  266    HA   LYS  40           HA       LYS  40   4.906 -11.415 -16.991
  267   1HB   LYS  40          1HB       LYS  40   4.626  -9.458 -19.316
  268   2HB   LYS  40          2HB       LYS  40   3.546 -10.822 -19.184
  269   1HG   LYS  40          1HG       LYS  40   5.589 -12.349 -19.276
  270   2HG   LYS  40          2HG       LYS  40   5.349 -11.378 -20.704
  271   1HD   LYS  40          1HD       LYS  40   7.226  -9.815 -19.980
  272   2HD   LYS  40          2HD       LYS  40   7.365 -10.726 -18.505
  273   1HE   LYS  40          1HE       LYS  40   7.660 -12.543 -20.805
  274   2HE   LYS  40          2HE       LYS  40   8.839 -11.240 -20.870
  275   1HZ   LYS  40          1HZ       LYS  40   8.406 -12.792 -18.371
  276   2HZ   LYS  40          2HZ       LYS  40   9.733 -11.911 -18.808
  277   3HZ   LYS  40          3HZ       LYS  40   9.409 -13.345 -19.562
  278    H    GLU  41           H        GLU  41   4.784  -7.902 -17.709
  279    HA   GLU  41           HA       GLU  41   7.650  -7.393 -17.314
  280   1HB   GLU  41          1HB       GLU  41   7.211  -5.066 -17.590
  281   2HB   GLU  41          2HB       GLU  41   5.536  -5.218 -17.107
  282   1HG   GLU  41          1HG       GLU  41   6.786  -5.641 -19.798
  283   2HG   GLU  41          2HG       GLU  41   5.625  -6.879 -19.369
  284    H    LEU  42           H        LEU  42   4.797  -7.147 -15.241
  285    HA   LEU  42           HA       LEU  42   5.728  -5.800 -12.911
  286   1HB   LEU  42          1HB       LEU  42   4.024  -8.361 -12.854
  287   2HB   LEU  42          2HB       LEU  42   3.393  -6.788 -13.291
  288    HG   LEU  42           HG       LEU  42   3.541  -5.926 -11.076
  289   1HD1  LEU  42          1HD1      LEU  42   2.397  -7.623  -9.627
  290   2HD1  LEU  42          2HD1      LEU  42   1.730  -7.622 -11.267
  291   3HD1  LEU  42          3HD1      LEU  42   2.844  -8.919 -10.766
  292   1HD2  LEU  42          1HD2      LEU  42   5.414  -8.255 -10.272
  293   2HD2  LEU  42          2HD2      LEU  42   5.903  -6.561 -10.526
  294   3HD2  LEU  42          3HD2      LEU  42   4.813  -6.972  -9.190
  295    H    GLY  43           H        GLY  43   6.124  -9.247 -13.738
  296   1HA   GLY  43          1HA       GLY  43   7.656 -10.951 -12.951
  297   2HA   GLY  43          2HA       GLY  43   7.482 -10.173 -11.374
  298    H    THR  44           H        THR  44   8.803  -8.700 -14.312
  299    HA   THR  44           HA       THR  44  11.587  -9.240 -14.057
  300    HB   THR  44           HB       THR  44  10.027  -7.119 -15.448
  301    HG1  THR  44           HG1      THR  44  11.487  -7.780 -17.074
  302   1HG2  THR  44          1HG2      THR  44  12.033  -5.797 -16.143
  303   2HG2  THR  44          2HG2      THR  44  11.693  -5.585 -14.413
  304   3HG2  THR  44          3HG2      THR  44  13.028  -6.644 -14.934
  305    H    VAL  45           H        VAL  45   9.970  -6.254 -12.925
  306    HA   VAL  45           HA       VAL  45  12.277  -5.161 -11.491
  307    HB   VAL  45           HB       VAL  45   9.477  -4.357 -11.891
  308   1HG1  VAL  45          1HG1      VAL  45   9.222  -2.910  -9.874
  309   2HG1  VAL  45          2HG1      VAL  45   9.264  -4.615  -9.407
  310   3HG1  VAL  45          3HG1      VAL  45  10.703  -3.600  -9.159
  311   1HG2  VAL  45          1HG2      VAL  45  12.009  -2.688 -11.291
  312   2HG2  VAL  45          2HG2      VAL  45  11.396  -3.102 -12.909
  313   3HG2  VAL  45          3HG2      VAL  45  10.442  -2.049 -11.854
  314    H    MET  46           H        MET  46   9.623  -7.307 -10.603
  315    HA   MET  46           HA       MET  46   9.787  -7.230  -7.705
  316   1HB   MET  46          1HB       MET  46   8.895  -9.737  -7.935
  317   2HB   MET  46          2HB       MET  46   8.768  -9.349  -9.641
  318   1HG   MET  46          1HG       MET  46   7.429  -7.162  -8.681
  319   2HG   MET  46          2HG       MET  46   6.634  -8.708  -9.020
  320   1HE   MET  46          1HE       MET  46   7.242  -5.979  -6.447
  321   2HE   MET  46          2HE       MET  46   7.431  -6.812  -4.876
  322   3HE   MET  46          3HE       MET  46   8.756  -6.863  -6.075
  323    NH1  ARG  47           NH1      ARG  47  18.745 -11.856  -9.522
  324    NH2  ARG  47           NH2      ARG  47  18.625 -14.113  -9.759
  325    H    ARG  47           H        ARG  47  11.652  -8.966 -10.135
  326    HA   ARG  47           HA       ARG  47  12.978 -10.979  -8.514
  327   1HB   ARG  47          1HB       ARG  47  14.440  -9.668 -10.846
  328   2HB   ARG  47          2HB       ARG  47  12.955 -10.563 -11.143
  329   1HG   ARG  47          1HG       ARG  47  14.458 -12.305  -9.452
  330   2HG   ARG  47          2HG       ARG  47  14.122 -12.491 -11.173
  331   1HD   ARG  47          1HD       ARG  47  16.213 -11.291 -11.799
  332   2HD   ARG  47          2HD       ARG  47  16.498 -10.832 -10.127
  333    HE   ARG  47           HE       ARG  47  16.467 -13.799 -10.756
  334   1HH1  ARG  47          1HH1      ARG  47  18.293 -10.946  -9.665
  335   2HH1  ARG  47          2HH1      ARG  47  19.665 -12.026  -9.101
  336   1HH2  ARG  47          1HH2      ARG  47  18.086 -14.925 -10.079
  337   2HH2  ARG  47          2HH2      ARG  47  19.554 -14.125  -9.322
  338    H    MET  48           H        MET  48  13.704  -7.583  -9.142
  339    HA   MET  48           HA       MET  48  16.413  -7.303  -8.267
  340   1HB   MET  48          1HB       MET  48  14.680  -5.458  -9.138
  341   2HB   MET  48          2HB       MET  48  16.135  -5.041  -8.253
  342   1HG   MET  48          1HG       MET  48  13.420  -4.353  -7.580
  343   2HG   MET  48          2HG       MET  48  13.967  -5.462  -6.312
  344   1HE   MET  48          1HE       MET  48  13.243  -2.415  -5.631
  345   2HE   MET  48          2HE       MET  48  14.563  -1.226  -5.824
  346   3HE   MET  48          3HE       MET  48  13.719  -1.862  -7.266
  347    H    LEU  49           H        LEU  49  13.465  -7.662  -6.371
  348    HA   LEU  49           HA       LEU  49  14.237  -6.980  -3.714
  349   1HB   LEU  49          1HB       LEU  49  12.697  -9.574  -4.112
  350   2HB   LEU  49          2HB       LEU  49  11.989  -8.096  -4.725
  351    HG   LEU  49           HG       LEU  49  12.914  -8.269  -1.805
  352   1HD1  LEU  49          1HD1      LEU  49  10.109  -9.068  -2.804
  353   2HD1  LEU  49          2HD1      LEU  49  11.355 -10.224  -2.300
  354   3HD1  LEU  49          3HD1      LEU  49  10.687  -9.071  -1.118
  355   1HD2  LEU  49          1HD2      LEU  49  11.293  -6.463  -1.403
  356   2HD2  LEU  49          2HD2      LEU  49  12.279  -5.982  -2.806
  357   3HD2  LEU  49          3HD2      LEU  49  10.639  -6.599  -3.055
  358    H    GLY  50           H        GLY  50  14.339 -10.337  -4.948
  359   1HA   GLY  50          1HA       GLY  50  17.113 -10.975  -4.452
  360   2HA   GLY  50          2HA       GLY  50  16.291 -11.289  -2.918
  361    H    GLN  51           H        GLN  51  13.807 -12.152  -3.837
  362    HA   GLN  51           HA       GLN  51  14.387 -15.014  -4.594
  363   1HB   GLN  51          1HB       GLN  51  12.407 -13.767  -3.018
  364   2HB   GLN  51          2HB       GLN  51  11.531 -14.216  -4.469
  365   1HG   GLN  51          1HG       GLN  51  12.831 -15.999  -2.394
  366   2HG   GLN  51          2HG       GLN  51  12.837 -16.598  -4.038
  367   1HE2  GLN  51          1HE2      GLN  51   9.412 -16.847  -1.857
  368   2HE2  GLN  51          2HE2      GLN  51  11.083 -16.485  -1.192
  369    H    ASN  52           H        ASN  52  12.412 -15.796  -6.161
  370    HA   ASN  52           HA       ASN  52  11.933 -13.958  -8.470
  371   1HB   ASN  52          1HB       ASN  52  13.358 -16.570  -9.165
  372   2HB   ASN  52          2HB       ASN  52  14.292 -15.157  -8.726
  373   1HD2  ASN  52          1HD2      ASN  52  14.073 -14.898 -12.404
  374   2HD2  ASN  52          2HD2      ASN  52  15.058 -15.567 -11.007
  375    HA   PRO  53           HA       PRO  53   8.478 -17.133  -7.828
  376   1HB   PRO  53          1HB       PRO  53   6.302 -15.468  -8.136
  377   2HB   PRO  53          2HB       PRO  53   7.279 -15.560  -6.663
  378   1HG   PRO  53          1HG       PRO  53   7.421 -13.460  -8.874
  379   2HG   PRO  53          2HG       PRO  53   7.448 -13.204  -7.114
  380   1HD   PRO  53          1HD       PRO  53   9.792 -13.671  -7.003
  381   2HD   PRO  53          2HD       PRO  53   9.754 -13.310  -8.755
  382    H    THR  54           H        THR  54   6.384 -17.448  -9.301
  383    HA   THR  54           HA       THR  54   7.318 -17.522 -12.197
  384    HB   THR  54           HB       THR  54   6.411 -19.603 -10.709
  385    HG1  THR  54           HG1      THR  54   5.609 -19.785 -13.305
  386   1HG2  THR  54          1HG2      THR  54   4.154 -20.304 -11.437
  387   2HG2  THR  54          2HG2      THR  54   4.043 -18.788 -10.513
  388   3HG2  THR  54          3HG2      THR  54   3.901 -18.762 -12.290
  389    H    LYS  55           H        LYS  55   5.843 -17.010 -13.875
  390    HA   LYS  55           HA       LYS  55   4.619 -14.386 -13.550
  391   1HB   LYS  55          1HB       LYS  55   5.570 -15.172 -15.718
  392   2HB   LYS  55          2HB       LYS  55   3.953 -14.524 -15.894
  393   1HG   LYS  55          1HG       LYS  55   4.473 -16.573 -17.280
  394   2HG   LYS  55          2HG       LYS  55   4.588 -17.535 -15.817
  395   1HD   LYS  55          1HD       LYS  55   2.287 -17.391 -17.266
  396   2HD   LYS  55          2HD       LYS  55   2.285 -17.630 -15.526
  397   1HE   LYS  55          1HE       LYS  55   1.418 -15.544 -15.053
  398   2HE   LYS  55          2HE       LYS  55   2.268 -14.730 -16.364
  399   1HZ   LYS  55          1HZ       LYS  55   0.495 -15.011 -17.710
  400   2HZ   LYS  55          2HZ       LYS  55  -0.368 -15.390 -16.354
  401   3HZ   LYS  55          3HZ       LYS  55   0.256 -16.593 -17.298
  402    H    GLU  56           H        GLU  56   3.356 -17.671 -13.465
  403    HA   GLU  56           HA       GLU  56   0.478 -17.030 -13.679
  404   1HB   GLU  56          1HB       GLU  56   1.093 -19.544 -12.235
  405   2HB   GLU  56          2HB       GLU  56   2.013 -19.392 -13.718
  406   1HG   GLU  56          1HG       GLU  56  -0.049 -19.193 -15.069
  407   2HG   GLU  56          2HG       GLU  56  -0.135 -20.624 -14.057
  408    H    GLU  57           H        GLU  57   2.815 -17.395 -11.058
  409    HA   GLU  57           HA       GLU  57   0.973 -17.208  -8.751
  410   1HB   GLU  57          1HB       GLU  57   3.206 -16.281  -7.613
  411   2HB   GLU  57          2HB       GLU  57   3.960 -16.881  -9.075
  412   1HG   GLU  57          1HG       GLU  57   2.127 -18.790  -7.538
  413   2HG   GLU  57          2HG       GLU  57   3.508 -19.173  -8.559
  414    H    LEU  58           H        LEU  58   2.662 -14.904 -10.825
  415    HA   LEU  58           HA       LEU  58   2.086 -12.448  -9.350
  416   1HB   LEU  58          1HB       LEU  58   2.871 -13.054 -12.236
  417   2HB   LEU  58          2HB       LEU  58   2.405 -11.426 -11.786
  418    HG   LEU  58           HG       LEU  58   4.370 -12.472  -9.844
  419   1HD1  LEU  58          1HD1      LEU  58   4.738 -10.203 -11.911
  420   2HD1  LEU  58          2HD1      LEU  58   3.892  -9.987 -10.371
  421   3HD1  LEU  58          3HD1      LEU  58   5.620 -10.418 -10.377
  422   1HD2  LEU  58          1HD2      LEU  58   6.311 -12.847 -11.320
  423   2HD2  LEU  58          2HD2      LEU  58   5.010 -13.962 -11.806
  424   3HD2  LEU  58          3HD2      LEU  58   5.335 -12.511 -12.773
  425    H    ASP  59           H        ASP  59   0.348 -14.325 -11.781
  426    HA   ASP  59           HA       ASP  59  -1.703 -12.542 -12.659
  427   1HB   ASP  59          1HB       ASP  59  -1.378 -14.811 -13.636
  428   2HB   ASP  59          2HB       ASP  59  -2.011 -15.559 -12.188
  429    H    ALA  60           H        ALA  60  -1.407 -14.323  -9.639
  430    HA   ALA  60           HA       ALA  60  -4.096 -13.704  -8.551
  431   1HB   ALA  60          1HB       ALA  60  -3.196 -14.592  -6.406
  432   2HB   ALA  60          2HB       ALA  60  -2.826 -15.675  -7.762
  433   3HB   ALA  60          3HB       ALA  60  -1.549 -14.636  -7.079
  434    H    ILE  61           H        ILE  61  -0.809 -12.425  -7.995
  435    HA   ILE  61           HA       ILE  61  -1.158 -10.397  -6.068
  436    HB   ILE  61           HB       ILE  61   0.660 -10.415  -8.505
  437   1HG1  ILE  61          1HG1      ILE  61   2.390 -10.953  -6.816
  438   2HG1  ILE  61          2HG1      ILE  61   1.259 -10.711  -5.491
  439   1HG2  ILE  61          1HG2      ILE  61   1.957  -8.512  -7.504
  440   2HG2  ILE  61          2HG2      ILE  61   0.340  -7.993  -7.976
  441   3HG2  ILE  61          3HG2      ILE  61   0.701  -8.294  -6.260
  442   1HD1  ILE  61          1HD1      ILE  61   1.113 -13.034  -7.491
  443   2HD1  ILE  61          2HD1      ILE  61   1.590 -13.102  -5.781
  444   3HD1  ILE  61          3HD1      ILE  61  -0.089 -12.703  -6.213
  445    H    ILE  62           H        ILE  62  -1.984 -10.314  -9.524
  446    HA   ILE  62           HA       ILE  62  -2.926  -7.455  -9.479
  447    HB   ILE  62           HB       ILE  62  -2.747  -9.553 -11.679
  448   1HG1  ILE  62          1HG1      ILE  62  -1.359  -6.869 -11.118
  449   2HG1  ILE  62          2HG1      ILE  62  -0.631  -8.447 -11.327
  450   1HG2  ILE  62          1HG2      ILE  62  -3.731  -7.926 -13.319
  451   2HG2  ILE  62          2HG2      ILE  62  -4.923  -8.357 -12.095
  452   3HG2  ILE  62          3HG2      ILE  62  -4.095  -6.786 -12.000
  453   1HD1  ILE  62          1HD1      ILE  62  -1.880  -6.805 -13.610
  454   2HD1  ILE  62          2HD1      ILE  62  -0.158  -7.127 -13.315
  455   3HD1  ILE  62          3HD1      ILE  62  -1.238  -8.463 -13.780
  456    H    GLU  63           H        GLU  63  -4.213 -10.744  -9.486
  457    HA   GLU  63           HA       GLU  63  -6.990 -10.454  -9.889
  458   1HB   GLU  63          1HB       GLU  63  -6.143 -12.163  -7.534
  459   2HB   GLU  63          2HB       GLU  63  -5.495 -12.549  -9.116
  460   1HG   GLU  63          1HG       GLU  63  -7.739 -13.700  -8.242
  461   2HG   GLU  63          2HG       GLU  63  -8.524 -12.213  -8.746
  462    H    GLU  64           H        GLU  64  -5.073  -9.421  -7.131
  463    HA   GLU  64           HA       GLU  64  -7.195  -8.800  -5.228
  464   1HB   GLU  64          1HB       GLU  64  -5.160  -8.868  -4.173
  465   2HB   GLU  64          2HB       GLU  64  -4.285  -8.100  -5.483
  466   1HG   GLU  64          1HG       GLU  64  -5.533  -5.873  -4.749
  467   2HG   GLU  64          2HG       GLU  64  -4.171  -6.457  -3.808
  468    H    VAL  65           H        VAL  65  -5.221  -6.388  -6.984
  469    HA   VAL  65           HA       VAL  65  -7.655  -4.531  -7.131
  470    HB   VAL  65           HB       VAL  65  -5.991  -3.614  -5.647
  471   1HG1  VAL  65          1HG1      VAL  65  -5.814  -1.981  -8.261
  472   2HG1  VAL  65          2HG1      VAL  65  -7.256  -2.035  -7.230
  473   3HG1  VAL  65          3HG1      VAL  65  -5.734  -1.369  -6.590
  474   1HG2  VAL  65          1HG2      VAL  65  -3.666  -3.085  -6.194
  475   2HG2  VAL  65          2HG2      VAL  65  -3.910  -4.791  -6.638
  476   3HG2  VAL  65          3HG2      VAL  65  -3.878  -3.551  -7.899
  477    H    ASP  66           H        ASP  66  -8.441  -5.187  -9.084
  478    HA   ASP  66           HA       ASP  66  -7.581  -3.979 -11.531
  479   1HB   ASP  66          1HB       ASP  66  -6.861  -6.708 -12.283
  480   2HB   ASP  66          2HB       ASP  66  -5.850  -6.210 -10.946
  481    H    GLU  67           H        GLU  67  -9.909  -4.318 -10.276
  482    HA   GLU  67           HA       GLU  67 -11.514  -6.610 -11.381
  483   1HB   GLU  67          1HB       GLU  67 -11.734  -5.645  -9.008
  484   2HB   GLU  67          2HB       GLU  67 -13.203  -6.049  -9.877
  485   1HG   GLU  67          1HG       GLU  67 -13.975  -3.969  -9.341
  486   2HG   GLU  67          2HG       GLU  67 -12.850  -3.310 -10.516
  487    H    ASP  68           H        ASP  68 -10.321  -4.485 -13.169
  488    HA   ASP  68           HA       ASP  68 -12.859  -3.330 -14.423
  489   1HB   ASP  68          1HB       ASP  68 -10.776  -1.968 -15.681
  490   2HB   ASP  68          2HB       ASP  68 -11.795  -1.368 -14.393
  491    H    GLY  69           H        GLY  69 -11.760  -6.073 -14.706
  492   1HA   GLY  69          1HA       GLY  69 -11.256  -7.719 -16.429
  493   2HA   GLY  69          2HA       GLY  69 -12.411  -6.750 -17.350
  494    H    SER  70           H        SER  70  -9.284  -5.584 -16.207
  495    HA   SER  70           HA       SER  70  -8.500  -4.868 -19.056
  496   1HB   SER  70          1HB       SER  70  -8.486  -2.972 -17.606
  497   2HB   SER  70          2HB       SER  70  -6.793  -3.364 -17.920
  498    HG   SER  70           HG       SER  70  -6.524  -3.903 -15.922
  499    H    GLY  71           H        GLY  71  -6.843  -6.046 -16.094
  500   1HA   GLY  71          1HA       GLY  71  -5.281  -7.945 -15.864
  501   2HA   GLY  71          2HA       GLY  71  -5.341  -8.169 -17.617
  502    H    THR  72           H        THR  72  -4.772  -5.039 -16.148
  503    HA   THR  72           HA       THR  72  -1.787  -5.178 -16.331
  504    HB   THR  72           HB       THR  72  -1.515  -3.222 -17.866
  505    HG1  THR  72           HG1      THR  72  -3.341  -2.240 -18.071
  506   1HG2  THR  72          1HG2      THR  72  -1.794  -4.376 -20.020
  507   2HG2  THR  72          2HG2      THR  72  -1.156  -5.531 -18.830
  508   3HG2  THR  72          3HG2      THR  72  -2.873  -5.596 -19.306
  509    H    ILE  73           H        ILE  73  -1.128  -2.580 -16.120
  510    HA   ILE  73           HA       ILE  73  -2.824  -1.292 -13.950
  511    HB   ILE  73           HB       ILE  73   0.119  -2.006 -13.488
  512   1HG1  ILE  73          1HG1      ILE  73  -2.208  -2.903 -11.699
  513   2HG1  ILE  73          2HG1      ILE  73  -1.825  -3.818 -13.142
  514   1HG2  ILE  73          1HG2      ILE  73  -0.071  -0.871 -11.279
  515   2HG2  ILE  73          2HG2      ILE  73  -0.453   0.279 -12.568
  516   3HG2  ILE  73          3HG2      ILE  73  -1.765  -0.430 -11.596
  517   1HD1  ILE  73          1HD1      ILE  73   0.138  -3.359 -10.820
  518   2HD1  ILE  73          2HD1      ILE  73  -0.703  -4.863 -11.249
  519   3HD1  ILE  73          3HD1      ILE  73   0.537  -4.203 -12.342
  520    H    ASP  74           H        ASP  74  -3.298   0.280 -15.416
  521    HA   ASP  74           HA       ASP  74  -1.397   1.683 -17.164
  522   1HB   ASP  74          1HB       ASP  74  -3.143   2.999 -17.897
  523   2HB   ASP  74          2HB       ASP  74  -3.833   3.215 -16.305
  524    H    PHE  75           H        PHE  75  -1.368   4.239 -16.877
  525    HA   PHE  75           HA       PHE  75   0.319   4.869 -14.538
  526   1HB   PHE  75          1HB       PHE  75  -0.945   6.811 -16.567
  527   2HB   PHE  75          2HB       PHE  75   0.555   5.958 -16.814
  528    HD1  PHE  75           HD1      PHE  75  -0.582   7.547 -13.567
  529    HD2  PHE  75           HD2      PHE  75   2.115   7.789 -16.912
  530    HE1  PHE  75           HE1      PHE  75   0.629   9.388 -12.471
  531    HE2  PHE  75           HE2      PHE  75   3.312   9.631 -15.799
  532    HZ   PHE  75           HZ       PHE  75   2.573  10.434 -13.584
  533    H    GLU  76           H        GLU  76  -3.023   5.582 -15.501
  534    HA   GLU  76           HA       GLU  76  -3.700   7.370 -13.261
  535   1HB   GLU  76          1HB       GLU  76  -5.702   7.681 -14.233
  536   2HB   GLU  76          2HB       GLU  76  -6.019   5.972 -14.437
  537   1HG   GLU  76          1HG       GLU  76  -4.128   6.289 -16.424
  538   2HG   GLU  76          2HG       GLU  76  -5.857   6.427 -16.660
  539    H    GLU  77           H        GLU  77  -3.901   3.901 -13.810
  540    HA   GLU  77           HA       GLU  77  -5.481   3.276 -11.344
  541   1HB   GLU  77          1HB       GLU  77  -5.783   1.818 -13.242
  542   2HB   GLU  77          2HB       GLU  77  -4.071   1.487 -13.370
  543   1HG   GLU  77          1HG       GLU  77  -5.677   0.662 -10.878
  544   2HG   GLU  77          2HG       GLU  77  -4.070   0.110 -11.336
  545    H    PHE  78           H        PHE  78  -2.111   3.442 -12.288
  546    HA   PHE  78           HA       PHE  78  -0.869   1.994 -10.100
  547   1HB   PHE  78          1HB       PHE  78   0.283   4.413 -11.626
  548   2HB   PHE  78          2HB       PHE  78   0.326   2.769 -12.210
  549    HD1  PHE  78           HD1      PHE  78   2.069   1.224 -11.374
  550    HD2  PHE  78           HD2      PHE  78   1.600   5.092  -9.551
  551    HE1  PHE  78           HE1      PHE  78   4.172   0.907 -10.134
  552    HE2  PHE  78           HE2      PHE  78   3.701   4.755  -8.315
  553    HZ   PHE  78           HZ       PHE  78   4.994   2.670  -8.609
  554    H    LEU  79           H        LEU  79  -1.568   5.476 -10.477
  555    HA   LEU  79           HA       LEU  79  -0.563   6.382  -7.897
  556   1HB   LEU  79          1HB       LEU  79  -2.537   8.246  -8.423
  557   2HB   LEU  79          2HB       LEU  79  -2.353   7.559 -10.023
  558    HG   LEU  79           HG       LEU  79   0.213   8.356  -8.617
  559   1HD1  LEU  79          1HD1      LEU  79   0.875   9.039 -10.926
  560   2HD1  LEU  79          2HD1      LEU  79   0.278   7.369 -10.914
  561   3HD1  LEU  79          3HD1      LEU  79  -0.762   8.677 -11.531
  562   1HD2  LEU  79          1HD2      LEU  79  -1.730  10.469  -9.772
  563   2HD2  LEU  79          2HD2      LEU  79  -1.224  10.328  -8.070
  564   3HD2  LEU  79          3HD2      LEU  79  -0.036  10.764  -9.307
  565    H    VAL  80           H        VAL  80  -3.712   5.158  -8.936
  566    HA   VAL  80           HA       VAL  80  -5.231   5.740  -6.480
  567    HB   VAL  80           HB       VAL  80  -5.739   4.135  -8.953
  568   1HG1  VAL  80          1HG1      VAL  80  -7.663   5.916  -7.332
  569   2HG1  VAL  80          2HG1      VAL  80  -6.546   6.557  -8.545
  570   3HG1  VAL  80          3HG1      VAL  80  -7.812   5.408  -9.035
  571   1HG2  VAL  80          1HG2      VAL  80  -7.702   2.928  -8.118
  572   2HG2  VAL  80          2HG2      VAL  80  -6.321   2.432  -7.112
  573   3HG2  VAL  80          3HG2      VAL  80  -7.498   3.591  -6.478
  574    H    MET  81           H        MET  81  -3.185   3.095  -7.598
  575    HA   MET  81           HA       MET  81  -3.762   1.035  -5.596
  576   1HB   MET  81          1HB       MET  81  -0.916   1.301  -6.593
  577   2HB   MET  81          2HB       MET  81  -2.163   1.068  -7.805
  578   1HG   MET  81          1HG       MET  81  -2.147  -0.831  -5.413
  579   2HG   MET  81          2HG       MET  81  -2.710  -1.116  -7.068
  580   1HE   MET  81          1HE       MET  81  -1.280  -1.712  -9.107
  581   2HE   MET  81          2HE       MET  81   0.159  -2.733  -8.809
  582   3HE   MET  81          3HE       MET  81  -1.401  -3.150  -8.044
  583    H    MET  82           H        MET  82  -1.021   3.333  -5.733
  584    HA   MET  82           HA       MET  82  -0.029   2.772  -3.032
  585   1HB   MET  82          1HB       MET  82   1.109   5.184  -3.455
  586   2HB   MET  82          2HB       MET  82   0.568   4.913  -5.101
  587   1HG   MET  82          1HG       MET  82   2.703   3.962  -5.209
  588   2HG   MET  82          2HG       MET  82   1.764   2.518  -4.809
  589   1HE   MET  82          1HE       MET  82   5.428   3.604  -2.656
  590   2HE   MET  82          2HE       MET  82   4.760   4.606  -3.978
  591   3HE   MET  82          3HE       MET  82   5.023   2.856  -4.234
  592    H    VAL  83           H        VAL  83  -2.471   4.942  -4.285
  593    HA   VAL  83           HA       VAL  83  -2.559   6.934  -2.150
  594    HB   VAL  83           HB       VAL  83  -4.067   6.426  -4.565
  595   1HG1  VAL  83          1HG1      VAL  83  -6.344   7.209  -3.900
  596   2HG1  VAL  83          2HG1      VAL  83  -5.974   5.655  -3.138
  597   3HG1  VAL  83          3HG1      VAL  83  -5.888   7.150  -2.177
  598   1HG2  VAL  83          1HG2      VAL  83  -4.001   8.939  -2.766
  599   2HG2  VAL  83          2HG2      VAL  83  -2.877   8.586  -4.099
  600   3HG2  VAL  83          3HG2      VAL  83  -4.589   8.868  -4.448
  601    NH1  ARG  84           NH1      ARG  84  -9.561  -0.113  -3.985
  602    NH2  ARG  84           NH2      ARG  84  -8.908  -1.544  -2.347
  603    H    ARG  84           H        ARG  84  -4.160   3.812  -2.649
  604    HA   ARG  84           HA       ARG  84  -6.103   3.923  -0.423
  605   1HB   ARG  84          1HB       ARG  84  -4.948   1.617  -2.081
  606   2HB   ARG  84          2HB       ARG  84  -5.964   1.306  -0.681
  607   1HG   ARG  84          1HG       ARG  84  -7.911   2.053  -1.680
  608   2HG   ARG  84          2HG       ARG  84  -7.110   3.321  -2.611
  609   1HD   ARG  84          1HD       ARG  84  -7.802   1.749  -4.272
  610   2HD   ARG  84          2HD       ARG  84  -6.075   1.428  -4.095
  611    HE   ARG  84           HE       ARG  84  -6.619  -0.712  -2.989
  612   1HH1  ARG  84          1HH1      ARG  84  -9.298   0.626  -4.646
  613   2HH1  ARG  84          2HH1      ARG  84 -10.487  -0.543  -3.881
  614   1HH2  ARG  84          1HH2      ARG  84  -8.143  -1.905  -1.766
  615   2HH2  ARG  84          2HH2      ARG  84  -9.883  -1.864  -2.347
  616    H    GLN  85           H        GLN  85  -2.795   2.664  -0.782
  617    HA   GLN  85           HA       GLN  85  -2.612   1.354   1.869
  618   1HB   GLN  85          1HB       GLN  85  -0.465   2.153  -0.171
  619   2HB   GLN  85          2HB       GLN  85  -0.081   1.392   1.362
  620   1HG   GLN  85          1HG       GLN  85  -0.501   0.000  -0.949
  621   2HG   GLN  85          2HG       GLN  85  -2.153   0.000  -0.374
  622   1HE2  GLN  85          1HE2      GLN  85  -0.758  -1.746   2.803
  623   2HE2  GLN  85          2HE2      GLN  85  -1.518  -0.107   2.484
  624    H    MET  86           H        MET  86  -1.926   4.557   0.581
  625    HA   MET  86           HA       MET  86  -0.268   5.620   2.762
  626   1HB   MET  86          1HB       MET  86  -0.041   7.398   1.412
  627   2HB   MET  86          2HB       MET  86  -1.015   6.529   0.240
  628   1HG   MET  86          1HG       MET  86  -3.063   7.648   0.819
  629   2HG   MET  86          2HG       MET  86  -2.411   8.277   2.338
  630   1HE   MET  86          1HE       MET  86  -3.739   9.604  -0.676
  631   2HE   MET  86          2HE       MET  86  -2.473  10.454  -1.611
  632   3HE   MET  86          3HE       MET  86  -2.538   8.667  -1.619
  633    H    LYS  87           H        LYS  87  -3.748   5.772   2.026
  634    HA   LYS  87           HA       LYS  87  -4.437   7.127   4.655
  635   1HB   LYS  87          1HB       LYS  87  -6.576   7.518   3.831
  636   2HB   LYS  87          2HB       LYS  87  -5.638   7.545   2.345
  637   1HG   LYS  87          1HG       LYS  87  -7.124   5.038   3.311
  638   2HG   LYS  87          2HG       LYS  87  -6.325   5.235   1.759
  639   1HD   LYS  87          1HD       LYS  87  -7.998   6.879   1.017
  640   2HD   LYS  87          2HD       LYS  87  -8.801   5.433   1.619
  641   1HE   LYS  87          1HE       LYS  87  -8.845   6.895   3.956
  642   2HE   LYS  87          2HE       LYS  87  -8.805   8.236   2.804
  643   1HZ   LYS  87          1HZ       LYS  87 -10.717   7.059   1.651
  644   2HZ   LYS  87          2HZ       LYS  87 -11.057   7.706   3.133
  645   3HZ   LYS  87          3HZ       LYS  87 -10.833   6.077   2.975
  646    H    GLU  88           H        GLU  88  -6.607   6.015   5.555
  647    HA   GLU  88           HA       GLU  88  -7.542   4.227   6.851
  648   1HB   GLU  88          1HB       GLU  88  -6.870   1.808   5.912
  649   2HB   GLU  88          2HB       GLU  88  -6.315   2.718   4.521
  650   1HG   GLU  88          1HG       GLU  88  -8.613   3.682   4.195
  651   2HG   GLU  88          2HG       GLU  88  -8.614   1.928   4.142
  652    H    ASP  89           H        ASP  89  -4.757   2.284   5.995
  653    HA   ASP  89           HA       ASP  89  -2.855   1.479   7.232
  654   1HB   ASP  89          1HB       ASP  89  -2.151   3.207   9.223
  655   2HB   ASP  89          2HB       ASP  89  -3.117   4.306   8.265
  656    H    ALA  90           H        ALA  90  -4.582  -0.056   7.831
  657    HA   ALA  90           HA       ALA  90  -5.390   0.040  10.788
  658   1HB   ALA  90          1HB       ALA  90  -7.075  -1.731  10.227
  659   2HB   ALA  90          2HB       ALA  90  -7.320  -0.290   9.221
  660   3HB   ALA  90          3HB       ALA  90  -6.548  -1.736   8.525
   
  Start of MODEL          17
 Raw file had  660 H/Q atoms
  Start of MODEL   17
    1   1H    ALA   1          1H        ALA   1 -23.696   7.649 -22.069
    2   2H    ALA   1          2H        ALA   1 -23.297   8.695 -20.815
    3   3H    ALA   1          3H        ALA   1 -22.108   8.169 -21.881
    4    HA   ALA   1           HA       ALA   1 -23.525   6.678 -19.775
    5   1HB   ALA   1          1HB       ALA   1 -23.365   5.538 -22.218
    6   2HB   ALA   1          2HB       ALA   1 -23.087   4.588 -20.746
    7   3HB   ALA   1          3HB       ALA   1 -21.701   5.170 -21.704
    8    H    SER   2           H        SER   2 -22.130   6.051 -18.162
    9    HA   SER   2           HA       SER   2 -19.299   7.243 -18.201
   10   1HB   SER   2          1HB       SER   2 -19.842   7.401 -15.561
   11   2HB   SER   2          2HB       SER   2 -20.225   8.696 -16.699
   12    HG   SER   2           HG       SER   2 -21.896   7.812 -15.193
   13    H    MET   3           H        MET   3 -18.068   6.277 -16.210
   14    HA   MET   3           HA       MET   3 -18.519   3.282 -15.899
   15   1HB   MET   3          1HB       MET   3 -15.724   4.206 -16.674
   16   2HB   MET   3          2HB       MET   3 -16.417   2.596 -16.739
   17   1HG   MET   3          1HG       MET   3 -17.612   3.046 -18.779
   18   2HG   MET   3          2HG       MET   3 -17.540   4.798 -18.551
   19   1HE   MET   3          1HE       MET   3 -15.175   3.099 -21.638
   20   2HE   MET   3          2HE       MET   3 -16.896   3.180 -21.160
   21   3HE   MET   3          3HE       MET   3 -15.864   1.854 -20.550
   22    H    THR   4           H        THR   4 -16.439   2.525 -14.508
   23    HA   THR   4           HA       THR   4 -16.708   3.463 -11.848
   24    HB   THR   4           HB       THR   4 -14.063   2.294 -12.724
   25    HG1  THR   4           HG1      THR   4 -16.617   1.123 -12.656
   26   1HG2  THR   4          1HG2      THR   4 -14.682   2.765 -10.174
   27   2HG2  THR   4          2HG2      THR   4 -13.941   1.214 -10.628
   28   3HG2  THR   4          3HG2      THR   4 -15.696   1.314 -10.333
   29    H    ASP   5           H        ASP   5 -16.157   5.231 -10.816
   30    HA   ASP   5           HA       ASP   5 -14.312   7.306 -12.000
   31   1HB   ASP   5          1HB       ASP   5 -15.013   8.466  -9.646
   32   2HB   ASP   5          2HB       ASP   5 -16.326   7.314  -9.735
   33    H    GLN   6           H        GLN   6 -12.934   5.027 -11.472
   34    HA   GLN   6           HA       GLN   6 -11.652   5.058  -8.731
   35   1HB   GLN   6          1HB       GLN   6 -10.797   2.970  -9.197
   36   2HB   GLN   6          2HB       GLN   6 -12.231   2.951 -10.206
   37   1HG   GLN   6          1HG       GLN   6  -9.379   3.542 -11.206
   38   2HG   GLN   6          2HG       GLN   6 -10.803   3.586 -12.222
   39   1HE2  GLN   6          1HE2      GLN   6  -8.953   0.038 -11.641
   40   2HE2  GLN   6          2HE2      GLN   6  -8.319   1.631 -10.987
   41    H    GLN   7           H        GLN   7 -10.721   5.523 -12.147
   42    HA   GLN   7           HA       GLN   7  -7.944   6.442 -11.640
   43   1HB   GLN   7          1HB       GLN   7  -9.359   7.338 -14.170
   44   2HB   GLN   7          2HB       GLN   7  -7.719   6.756 -13.924
   45   1HG   GLN   7          1HG       GLN   7  -8.235   4.600 -14.409
   46   2HG   GLN   7          2HG       GLN   7  -9.657   4.580 -13.377
   47   1HE2  GLN   7          1HE2      GLN   7 -10.582   4.294 -17.115
   48   2HE2  GLN   7          2HE2      GLN   7  -9.371   3.440 -16.032
   49    H    ALA   8           H        ALA   8 -11.110   7.970 -11.893
   50    HA   ALA   8           HA       ALA   8 -10.343  10.766 -12.156
   51   1HB   ALA   8          1HB       ALA   8 -12.634  11.284 -11.328
   52   2HB   ALA   8          2HB       ALA   8 -12.662   9.988 -12.539
   53   3HB   ALA   8          3HB       ALA   8 -12.864   9.596 -10.812
   54    H    GLU   9           H        GLU   9 -10.670   8.628  -9.358
   55    HA   GLU   9           HA       GLU   9 -10.489  10.688  -7.245
   56   1HB   GLU   9          1HB       GLU   9 -10.175   7.634  -7.155
   57   2HB   GLU   9          2HB       GLU   9  -9.858   8.635  -5.744
   58   1HG   GLU   9          1HG       GLU   9 -12.530   8.097  -7.102
   59   2HG   GLU   9          2HG       GLU   9 -12.334   9.637  -6.274
   60    H    ALA  10           H        ALA  10  -8.148   8.298  -8.513
   61    HA   ALA  10           HA       ALA  10  -5.841   9.138  -6.895
   62   1HB   ALA  10          1HB       ALA  10  -4.495   7.752  -8.465
   63   2HB   ALA  10          2HB       ALA  10  -5.958   6.896  -7.942
   64   3HB   ALA  10          3HB       ALA  10  -5.879   7.607  -9.574
   65    NH1  ARG  11           NH1      ARG  11  -7.519  14.139 -16.915
   66    NH2  ARG  11           NH2      ARG  11  -8.294  16.089 -16.046
   67    H    ARG  11           H        ARG  11  -7.235  10.230  -9.918
   68    HA   ARG  11           HA       ARG  11  -4.883  11.730 -10.977
   69   1HB   ARG  11          1HB       ARG  11  -6.317  11.139 -12.723
   70   2HB   ARG  11          2HB       ARG  11  -7.773  11.375 -11.768
   71   1HG   ARG  11          1HG       ARG  11  -7.894  13.690 -12.154
   72   2HG   ARG  11          2HG       ARG  11  -6.162  13.867 -12.449
   73   1HD   ARG  11          1HD       ARG  11  -6.293  13.121 -14.688
   74   2HD   ARG  11          2HD       ARG  11  -7.732  12.137 -14.417
   75    HE   ARG  11           HE       ARG  11  -8.872  14.606 -14.099
   76   1HH1  ARG  11          1HH1      ARG  11  -8.661  16.588 -15.229
   77   2HH1  ARG  11          2HH1      ARG  11  -8.167  16.467 -16.991
   78   1HH2  ARG  11          1HH2      ARG  11  -7.199  13.180 -16.742
   79   2HH2  ARG  11          2HH2      ARG  11  -7.534  14.628 -17.818
   80    H    ALA  12           H        ALA  12  -7.810  12.492  -9.125
   81    HA   ALA  12           HA       ALA  12  -7.483  15.451  -9.161
   82   1HB   ALA  12          1HB       ALA  12  -9.363  15.470  -7.533
   83   2HB   ALA  12          2HB       ALA  12  -9.727  14.432  -8.926
   84   3HB   ALA  12          3HB       ALA  12  -9.277  13.700  -7.365
   85    H    PHE  13           H        PHE  13  -6.539  12.787  -7.056
   86    HA   PHE  13           HA       PHE  13  -5.727  14.418  -4.723
   87   1HB   PHE  13          1HB       PHE  13  -6.466  11.955  -4.725
   88   2HB   PHE  13          2HB       PHE  13  -4.894  11.526  -5.346
   89    HD1  PHE  13           HD1      PHE  13  -4.269  10.194  -3.362
   90    HD2  PHE  13           HD2      PHE  13  -5.383  14.322  -2.870
   91    HE1  PHE  13           HE1      PHE  13  -3.450  10.150  -1.041
   92    HE2  PHE  13           HE2      PHE  13  -4.554  14.260  -0.555
   93    HZ   PHE  13           HZ       PHE  13  -3.591  12.179   0.365
   94    H    LEU  14           H        LEU  14  -4.093  12.898  -7.484
   95    HA   LEU  14           HA       LEU  14  -1.361  13.994  -6.657
   96   1HB   LEU  14          1HB       LEU  14  -0.346  12.447  -8.165
   97   2HB   LEU  14          2HB       LEU  14  -1.822  12.175  -9.066
   98    HG   LEU  14           HG       LEU  14  -2.705  11.123  -6.739
   99   1HD1  LEU  14          1HD1      LEU  14   0.332  10.658  -6.476
  100   2HD1  LEU  14          2HD1      LEU  14  -0.595  11.786  -5.470
  101   3HD1  LEU  14          3HD1      LEU  14  -0.944  10.040  -5.396
  102   1HD2  LEU  14          1HD2      LEU  14  -2.088   8.881  -7.541
  103   2HD2  LEU  14          2HD2      LEU  14  -2.388   9.891  -8.977
  104   3HD2  LEU  14          3HD2      LEU  14  -0.725   9.528  -8.490
  105    H    SER  15           H        SER  15  -1.004  15.955  -7.338
  106    HA   SER  15           HA       SER  15  -2.329  17.369  -9.530
  107   1HB   SER  15          1HB       SER  15  -1.005  19.222  -8.987
  108   2HB   SER  15          2HB       SER  15   0.402  18.255  -8.536
  109    HG   SER  15           HG       SER  15  -2.008  18.669  -7.135
  110    H    GLU  16           H        GLU  16  -0.834  18.472 -11.247
  111    HA   GLU  16           HA       GLU  16   0.016  16.413 -13.166
  112   1HB   GLU  16          1HB       GLU  16   0.564  19.414 -13.408
  113   2HB   GLU  16          2HB       GLU  16  -1.018  18.714 -13.687
  114   1HG   GLU  16          1HG       GLU  16   0.519  17.119 -15.377
  115   2HG   GLU  16          2HG       GLU  16  -0.353  18.560 -15.871
  116    H    GLU  17           H        GLU  17   1.664  18.544 -10.914
  117    HA   GLU  17           HA       GLU  17   4.420  18.111 -11.999
  118   1HB   GLU  17          1HB       GLU  17   4.230  19.144  -9.205
  119   2HB   GLU  17          2HB       GLU  17   3.313  20.075 -10.373
  120   1HG   GLU  17          1HG       GLU  17   5.829  20.720  -9.856
  121   2HG   GLU  17          2HG       GLU  17   6.262  19.371 -10.892
  122    H    MET  18           H        MET  18   2.400  16.847  -9.391
  123    HA   MET  18           HA       MET  18   4.402  15.204  -8.001
  124   1HB   MET  18          1HB       MET  18   1.953  13.875  -7.567
  125   2HB   MET  18          2HB       MET  18   1.450  15.527  -7.877
  126   1HG   MET  18          1HG       MET  18   3.339  14.566  -5.648
  127   2HG   MET  18          2HG       MET  18   1.745  15.321  -5.481
  128   1HE   MET  18          1HE       MET  18   1.276  17.870  -6.702
  129   2HE   MET  18          2HE       MET  18   2.629  18.928  -7.199
  130   3HE   MET  18          3HE       MET  18   2.267  17.447  -8.133
  131    H    ILE  19           H        ILE  19   2.322  14.716 -10.797
  132    HA   ILE  19           HA       ILE  19   2.493  11.812 -11.050
  133    HB   ILE  19           HB       ILE  19   1.660  14.038 -12.890
  134   1HG1  ILE  19          1HG1      ILE  19  -0.452  12.914 -12.940
  135   2HG1  ILE  19          2HG1      ILE  19   0.236  11.353 -12.545
  136   1HG2  ILE  19          1HG2      ILE  19   1.428  12.540 -14.887
  137   2HG2  ILE  19          2HG2      ILE  19   3.127  12.705 -14.445
  138   3HG2  ILE  19          3HG2      ILE  19   2.249  11.218 -14.020
  139   1HD1  ILE  19          1HD1      ILE  19  -0.106  13.651 -10.528
  140   2HD1  ILE  19          2HD1      ILE  19  -1.025  12.134 -10.616
  141   3HD1  ILE  19          3HD1      ILE  19   0.699  12.098 -10.174
  142    H    ALA  20           H        ALA  20   4.534  14.490 -12.130
  143    HA   ALA  20           HA       ALA  20   6.296  13.231 -14.000
  144   1HB   ALA  20          1HB       ALA  20   7.949  15.009 -13.432
  145   2HB   ALA  20          2HB       ALA  20   6.310  15.672 -13.582
  146   3HB   ALA  20          3HB       ALA  20   7.031  15.438 -11.970
  147    H    GLU  21           H        GLU  21   6.220  13.022 -10.493
  148    HA   GLU  21           HA       GLU  21   8.811  11.844  -9.931
  149   1HB   GLU  21          1HB       GLU  21   6.142  11.633  -8.463
  150   2HB   GLU  21          2HB       GLU  21   7.566  10.788  -7.890
  151   1HG   GLU  21          1HG       GLU  21   7.669  13.816  -8.409
  152   2HG   GLU  21          2HG       GLU  21   6.951  13.191  -6.934
  153    H    PHE  22           H        PHE  22   5.642  10.294 -10.534
  154    HA   PHE  22           HA       PHE  22   6.936   7.591 -11.001
  155   1HB   PHE  22          1HB       PHE  22   3.926   8.196 -11.140
  156   2HB   PHE  22          2HB       PHE  22   4.702   6.644 -10.976
  157    HD1  PHE  22           HD1      PHE  22   5.744   5.917  -8.793
  158    HD2  PHE  22           HD2      PHE  22   3.668   9.674  -9.119
  159    HE1  PHE  22           HE1      PHE  22   5.438   5.971  -6.355
  160    HE2  PHE  22           HE2      PHE  22   3.372   9.709  -6.676
  161    HZ   PHE  22           HZ       PHE  22   4.215   7.840  -5.295
  162    H    LYS  23           H        LYS  23   7.123  10.016 -12.846
  163    HA   LYS  23           HA       LYS  23   5.850   9.048 -15.430
  164   1HB   LYS  23          1HB       LYS  23   6.502  11.610 -14.552
  165   2HB   LYS  23          2HB       LYS  23   7.901  11.245 -15.537
  166   1HG   LYS  23          1HG       LYS  23   6.576  12.207 -17.162
  167   2HG   LYS  23          2HG       LYS  23   6.099  10.531 -17.372
  168   1HD   LYS  23          1HD       LYS  23   3.977  11.448 -17.299
  169   2HD   LYS  23          2HD       LYS  23   4.177  11.150 -15.569
  170   1HE   LYS  23          1HE       LYS  23   3.324  13.531 -16.302
  171   2HE   LYS  23          2HE       LYS  23   4.586  13.463 -15.063
  172   1HZ   LYS  23          1HZ       LYS  23   5.458  13.616 -17.865
  173   2HZ   LYS  23          2HZ       LYS  23   6.145  14.271 -16.512
  174   3HZ   LYS  23          3HZ       LYS  23   4.813  14.978 -17.188
  175    H    ALA  24           H        ALA  24   9.079   9.552 -13.993
  176    HA   ALA  24           HA       ALA  24  10.641   8.489 -16.268
  177   1HB   ALA  24          1HB       ALA  24  12.574   8.560 -14.705
  178   2HB   ALA  24          2HB       ALA  24  11.647  10.071 -14.651
  179   3HB   ALA  24          3HB       ALA  24  11.491   8.885 -13.331
  180    H    ALA  25           H        ALA  25   9.996   7.188 -12.990
  181    HA   ALA  25           HA       ALA  25  11.198   4.580 -13.314
  182   1HB   ALA  25          1HB       ALA  25   9.919   3.917 -11.286
  183   2HB   ALA  25          2HB       ALA  25  10.643   5.524 -11.092
  184   3HB   ALA  25          3HB       ALA  25   8.897   5.368 -11.416
  185    H    PHE  26           H        PHE  26   8.008   5.792 -14.142
  186    HA   PHE  26           HA       PHE  26   6.412   3.465 -14.546
  187   1HB   PHE  26          1HB       PHE  26   5.484   5.710 -14.942
  188   2HB   PHE  26          2HB       PHE  26   6.486   5.958 -16.346
  189    HD1  PHE  26           HD1      PHE  26   5.993   4.600 -18.481
  190    HD2  PHE  26           HD2      PHE  26   3.432   4.357 -15.033
  191    HE1  PHE  26           HE1      PHE  26   4.199   3.641 -19.868
  192    HE2  PHE  26           HE2      PHE  26   1.647   3.406 -16.438
  193    HZ   PHE  26           HZ       PHE  26   2.033   3.028 -18.848
  194    H    ASP  27           H        ASP  27   8.552   4.982 -16.989
  195    HA   ASP  27           HA       ASP  27   8.238   2.929 -19.048
  196   1HB   ASP  27          1HB       ASP  27  10.761   4.638 -18.894
  197   2HB   ASP  27          2HB       ASP  27   9.959   3.983 -20.303
  198    H    MET  28           H        MET  28  10.437   3.319 -16.330
  199    HA   MET  28           HA       MET  28  12.506   1.365 -17.027
  200   1HB   MET  28          1HB       MET  28  12.459   3.111 -15.024
  201   2HB   MET  28          2HB       MET  28  11.687   1.816 -14.126
  202   1HG   MET  28          1HG       MET  28  13.691   0.300 -14.639
  203   2HG   MET  28          2HG       MET  28  14.482   1.681 -15.417
  204   1HE   MET  28          1HE       MET  28  12.727   0.467 -12.020
  205   2HE   MET  28          2HE       MET  28  13.096   1.850 -10.947
  206   3HE   MET  28          3HE       MET  28  11.985   2.068 -12.332
  207    H    PHE  29           H        PHE  29   9.319   1.110 -15.543
  208    HA   PHE  29           HA       PHE  29   9.562  -1.710 -14.633
  209   1HB   PHE  29          1HB       PHE  29   7.966   0.049 -13.639
  210   2HB   PHE  29          2HB       PHE  29   6.966  -0.117 -15.057
  211    HD1  PHE  29           HD1      PHE  29   4.988  -1.254 -14.433
  212    HD2  PHE  29           HD2      PHE  29   8.742  -2.777 -12.977
  213    HE1  PHE  29           HE1      PHE  29   3.819  -3.123 -13.337
  214    HE2  PHE  29           HE2      PHE  29   7.552  -4.632 -11.883
  215    HZ   PHE  29           HZ       PHE  29   5.095  -4.807 -12.056
  216    H    ASP  30           H        ASP  30   8.183  -0.010 -17.428
  217    HA   ASP  30           HA       ASP  30   7.154  -2.407 -18.837
  218   1HB   ASP  30          1HB       ASP  30   6.554   0.180 -19.195
  219   2HB   ASP  30          2HB       ASP  30   7.872   0.135 -20.344
  220    H    ALA  31           H        ALA  31   8.045  -3.423 -20.645
  221    HA   ALA  31           HA       ALA  31  11.103  -3.467 -20.729
  222   1HB   ALA  31          1HB       ALA  31  10.865  -5.778 -21.647
  223   2HB   ALA  31          2HB       ALA  31  10.054  -5.606 -20.078
  224   3HB   ALA  31          3HB       ALA  31   9.091  -5.653 -21.577
  225    H    ASP  32           H        ASP  32   8.171  -3.255 -22.694
  226    HA   ASP  32           HA       ASP  32   9.675  -3.044 -25.315
  227   1HB   ASP  32          1HB       ASP  32   7.337  -4.270 -24.919
  228   2HB   ASP  32          2HB       ASP  32   7.744  -3.500 -26.435
  229    H    GLY  33           H        GLY  33   7.406  -1.096 -23.347
  230   1HA   GLY  33          1HA       GLY  33   7.577   1.318 -22.819
  231   2HA   GLY  33          2HA       GLY  33   8.918   1.428 -23.937
  232    H    GLY  34           H        GLY  34   5.737   2.203 -23.406
  233   1HA   GLY  34          1HA       GLY  34   4.288   2.110 -25.883
  234   2HA   GLY  34          2HA       GLY  34   5.382   3.486 -26.076
  235    H    GLY  35           H        GLY  35   3.076   2.123 -23.726
  236   1HA   GLY  35          1HA       GLY  35   2.627   4.482 -22.081
  237   2HA   GLY  35          2HA       GLY  35   1.468   4.579 -23.414
  238    H    ASP  36           H        ASP  36   2.715   1.665 -21.822
  239    HA   ASP  36           HA       ASP  36   0.577   0.972 -20.030
  240   1HB   ASP  36          1HB       ASP  36  -1.211   0.807 -21.429
  241   2HB   ASP  36          2HB       ASP  36  -0.583  -0.806 -21.672
  242    H    ILE  37           H        ILE  37   1.181  -0.768 -18.950
  243    HA   ILE  37           HA       ILE  37   3.530  -2.425 -19.910
  244    HB   ILE  37           HB       ILE  37   2.468  -3.180 -17.266
  245   1HG1  ILE  37          1HG1      ILE  37   2.650  -0.300 -17.693
  246   2HG1  ILE  37          2HG1      ILE  37   2.196  -1.187 -16.251
  247   1HG2  ILE  37          1HG2      ILE  37   4.854  -3.220 -16.653
  248   2HG2  ILE  37          2HG2      ILE  37   4.627  -4.005 -18.222
  249   3HG2  ILE  37          3HG2      ILE  37   5.301  -2.359 -18.146
  250   1HD1  ILE  37          1HD1      ILE  37   5.083  -0.403 -16.975
  251   2HD1  ILE  37          2HD1      ILE  37   4.061   0.283 -15.693
  252   3HD1  ILE  37          3HD1      ILE  37   4.624  -1.400 -15.568
  253    H    SER  38           H        SER  38   2.978  -4.775 -18.463
  254    HA   SER  38           HA       SER  38   0.340  -5.914 -19.283
  255   1HB   SER  38          1HB       SER  38   0.851  -7.187 -21.117
  256   2HB   SER  38          2HB       SER  38   1.999  -5.875 -21.397
  257    HG   SER  38           HG       SER  38   2.898  -7.971 -21.537
  258    H    THR  39           H        THR  39   1.027  -8.587 -19.278
  259    HA   THR  39           HA       THR  39   1.516  -9.117 -16.376
  260    HB   THR  39           HB       THR  39   1.392 -11.642 -17.422
  261    HG1  THR  39           HG1      THR  39  -0.278 -10.062 -19.061
  262   1HG2  THR  39          1HG2      THR  39  -0.992 -11.712 -16.838
  263   2HG2  THR  39          2HG2      THR  39  -0.139 -10.724 -15.630
  264   3HG2  THR  39          3HG2      THR  39  -1.122  -9.939 -16.894
  265    H    LYS  40           H        LYS  40   2.939 -10.641 -19.294
  266    HA   LYS  40           HA       LYS  40   5.296 -11.738 -18.171
  267   1HB   LYS  40          1HB       LYS  40   5.767 -12.361 -20.245
  268   2HB   LYS  40          2HB       LYS  40   6.011 -10.737 -20.828
  269   1HG   LYS  40          1HG       LYS  40   3.455 -10.624 -21.207
  270   2HG   LYS  40          2HG       LYS  40   4.336 -11.753 -22.202
  271   1HD   LYS  40          1HD       LYS  40   3.117 -12.973 -19.705
  272   2HD   LYS  40          2HD       LYS  40   2.004 -12.265 -20.839
  273   1HE   LYS  40          1HE       LYS  40   4.043 -14.364 -21.725
  274   2HE   LYS  40          2HE       LYS  40   2.415 -14.769 -21.197
  275   1HZ   LYS  40          1HZ       LYS  40   2.839 -14.463 -23.677
  276   2HZ   LYS  40          2HZ       LYS  40   2.890 -12.834 -23.408
  277   3HZ   LYS  40          3HZ       LYS  40   1.512 -13.683 -23.078
  278    H    GLU  41           H        GLU  41   4.819  -8.461 -19.510
  279    HA   GLU  41           HA       GLU  41   7.558  -7.465 -19.193
  280   1HB   GLU  41          1HB       GLU  41   6.833  -5.381 -19.877
  281   2HB   GLU  41          2HB       GLU  41   5.286  -5.498 -19.066
  282   1HG   GLU  41          1HG       GLU  41   5.901  -7.207 -21.548
  283   2HG   GLU  41          2HG       GLU  41   4.341  -6.892 -20.820
  284    H    LEU  42           H        LEU  42   4.697  -7.449 -17.111
  285    HA   LEU  42           HA       LEU  42   5.640  -5.675 -14.985
  286   1HB   LEU  42          1HB       LEU  42   3.428  -7.684 -15.286
  287   2HB   LEU  42          2HB       LEU  42   3.980  -7.471 -13.639
  288    HG   LEU  42           HG       LEU  42   3.219  -5.248 -13.481
  289   1HD1  LEU  42          1HD1      LEU  42   1.235  -6.395 -15.542
  290   2HD1  LEU  42          2HD1      LEU  42   1.302  -6.910 -13.850
  291   3HD1  LEU  42          3HD1      LEU  42   0.888  -5.223 -14.245
  292   1HD2  LEU  42          1HD2      LEU  42   2.810  -3.675 -15.340
  293   2HD2  LEU  42          2HD2      LEU  42   4.427  -4.384 -15.566
  294   3HD2  LEU  42          3HD2      LEU  42   3.070  -4.956 -16.552
  295    H    GLY  43           H        GLY  43   6.069  -9.107 -15.654
  296   1HA   GLY  43          1HA       GLY  43   7.251 -10.884 -14.488
  297   2HA   GLY  43          2HA       GLY  43   7.220  -9.872 -13.040
  298    H    THR  44           H        THR  44   8.526  -8.620 -16.029
  299    HA   THR  44           HA       THR  44  11.254  -9.518 -15.934
  300    HB   THR  44           HB       THR  44  10.223  -6.865 -17.059
  301    HG1  THR  44           HG1      THR  44  10.730  -9.412 -18.175
  302   1HG2  THR  44          1HG2      THR  44  12.253  -6.862 -18.519
  303   2HG2  THR  44          2HG2      THR  44  12.693  -6.684 -16.807
  304   3HG2  THR  44          3HG2      THR  44  12.915  -8.253 -17.624
  305    H    VAL  45           H        VAL  45  10.041  -6.329 -14.851
  306    HA   VAL  45           HA       VAL  45  12.539  -5.487 -13.558
  307    HB   VAL  45           HB       VAL  45   9.820  -4.339 -13.851
  308   1HG1  VAL  45          1HG1      VAL  45   9.996  -2.693 -11.984
  309   2HG1  VAL  45          2HG1      VAL  45   9.863  -4.335 -11.345
  310   3HG1  VAL  45          3HG1      VAL  45  11.443  -3.522 -11.353
  311   1HG2  VAL  45          1HG2      VAL  45  12.605  -3.006 -13.692
  312   2HG2  VAL  45          2HG2      VAL  45  11.760  -3.473 -15.186
  313   3HG2  VAL  45          3HG2      VAL  45  11.084  -2.201 -14.158
  314    H    MET  46           H        MET  46   9.594  -7.108 -12.459
  315    HA   MET  46           HA       MET  46   9.934  -7.003  -9.565
  316   1HB   MET  46          1HB       MET  46   8.656  -9.359  -9.722
  317   2HB   MET  46          2HB       MET  46   8.456  -8.917 -11.408
  318   1HG   MET  46          1HG       MET  46   7.705  -6.652  -9.629
  319   2HG   MET  46          2HG       MET  46   6.795  -7.411 -10.946
  320   1HE   MET  46          1HE       MET  46   6.898 -10.569 -10.005
  321   2HE   MET  46          2HE       MET  46   5.354 -10.688  -9.111
  322   3HE   MET  46          3HE       MET  46   5.416  -9.811 -10.667
  323    NH1  ARG  47           NH1      ARG  47  17.845  -9.963 -14.143
  324    NH2  ARG  47           NH2      ARG  47  16.556  -9.456 -15.945
  325    H    ARG  47           H        ARG  47  11.391  -8.984 -12.074
  326    HA   ARG  47           HA       ARG  47  12.405 -11.278 -10.747
  327   1HB   ARG  47          1HB       ARG  47  14.139  -9.717 -12.737
  328   2HB   ARG  47          2HB       ARG  47  12.679 -10.566 -13.229
  329   1HG   ARG  47          1HG       ARG  47  13.693 -12.600 -13.216
  330   2HG   ARG  47          2HG       ARG  47  14.329 -12.366 -11.587
  331   1HD   ARG  47          1HD       ARG  47  16.354 -11.261 -12.393
  332   2HD   ARG  47          2HD       ARG  47  16.120 -12.699 -13.375
  333    HE   ARG  47           HE       ARG  47  14.879 -10.910 -15.035
  334   1HH1  ARG  47          1HH1      ARG  47  17.937 -10.486 -13.265
  335   2HH1  ARG  47          2HH1      ARG  47  18.540  -9.334 -14.560
  336   1HH2  ARG  47          1HH2      ARG  47  15.668  -9.589 -16.443
  337   2HH2  ARG  47          2HH2      ARG  47  17.341  -8.863 -16.236
  338    H    MET  48           H        MET  48  13.734  -7.986 -10.766
  339    HA   MET  48           HA       MET  48  16.234  -8.236  -9.435
  340   1HB   MET  48          1HB       MET  48  15.535  -5.932  -8.276
  341   2HB   MET  48          2HB       MET  48  14.128  -6.038  -9.318
  342   1HG   MET  48          1HG       MET  48  17.057  -5.934 -10.263
  343   2HG   MET  48          2HG       MET  48  15.824  -4.660 -10.419
  344   1HE   MET  48          1HE       MET  48  16.187  -4.349 -13.035
  345   2HE   MET  48          2HE       MET  48  14.921  -5.169 -13.995
  346   3HE   MET  48          3HE       MET  48  14.475  -4.267 -12.517
  347    H    LEU  49           H        LEU  49  13.447  -7.095  -7.546
  348    HA   LEU  49           HA       LEU  49  14.351  -8.553  -5.060
  349   1HB   LEU  49          1HB       LEU  49  13.523  -6.454  -4.465
  350   2HB   LEU  49          2HB       LEU  49  12.180  -7.512  -4.089
  351    HG   LEU  49           HG       LEU  49  11.463  -6.776  -6.662
  352   1HD1  LEU  49          1HD1      LEU  49  12.816  -4.259  -5.505
  353   2HD1  LEU  49          2HD1      LEU  49  13.480  -5.227  -6.833
  354   3HD1  LEU  49          3HD1      LEU  49  11.925  -4.385  -7.043
  355   1HD2  LEU  49          1HD2      LEU  49   9.800  -5.274  -5.649
  356   2HD2  LEU  49          2HD2      LEU  49  10.049  -6.624  -4.515
  357   3HD2  LEU  49          3HD2      LEU  49  10.797  -5.054  -4.188
  358    H    GLY  50           H        GLY  50  14.183 -10.653  -6.028
  359   1HA   GLY  50          1HA       GLY  50  12.481 -12.650  -5.524
  360   2HA   GLY  50          2HA       GLY  50  11.337 -11.692  -6.482
  361    H    GLN  51           H        GLN  51  14.447 -13.368  -6.624
  362    HA   GLN  51           HA       GLN  51  14.579 -13.245  -9.653
  363   1HB   GLN  51          1HB       GLN  51  16.610 -12.771  -8.206
  364   2HB   GLN  51          2HB       GLN  51  16.835 -13.938  -9.495
  365   1HG   GLN  51          1HG       GLN  51  17.117 -14.288  -6.558
  366   2HG   GLN  51          2HG       GLN  51  16.140 -15.560  -7.259
  367   1HE2  GLN  51          1HE2      GLN  51  19.145 -17.272  -8.147
  368   2HE2  GLN  51          2HE2      GLN  51  17.531 -17.268  -7.274
  369    H    ASN  52           H        ASN  52  12.399 -14.659  -8.746
  370    HA   ASN  52           HA       ASN  52  12.963 -17.322 -10.031
  371   1HB   ASN  52          1HB       ASN  52  13.076 -17.416  -7.372
  372   2HB   ASN  52          2HB       ASN  52  11.328 -17.400  -7.444
  373   1HD2  ASN  52          1HD2      ASN  52  11.907 -21.001  -7.529
  374   2HD2  ASN  52          2HD2      ASN  52  11.347 -19.548  -6.558
  375    HA   PRO  53           HA       PRO  53   8.967 -15.188 -11.400
  376   1HB   PRO  53          1HB       PRO  53   9.954 -14.395 -13.364
  377   2HB   PRO  53          2HB       PRO  53   9.127 -15.779 -14.093
  378   1HG   PRO  53          1HG       PRO  53  11.010 -17.158 -14.163
  379   2HG   PRO  53          2HG       PRO  53  11.850 -15.597 -14.316
  380   1HD   PRO  53          1HD       PRO  53  12.629 -15.699 -12.051
  381   2HD   PRO  53          2HD       PRO  53  12.330 -17.453 -12.235
  382    H    THR  54           H        THR  54   7.045 -15.978 -12.704
  383    HA   THR  54           HA       THR  54   6.589 -18.861 -13.225
  384    HB   THR  54           HB       THR  54   6.584 -18.547 -10.586
  385    HG1  THR  54           HG1      THR  54   4.908 -20.207 -10.603
  386   1HG2  THR  54          1HG2      THR  54   4.325 -18.298  -9.612
  387   2HG2  THR  54          2HG2      THR  54   4.789 -16.796 -10.442
  388   3HG2  THR  54          3HG2      THR  54   3.631 -17.915 -11.206
  389    H    LYS  55           H        LYS  55   4.537 -19.247 -14.115
  390    HA   LYS  55           HA       LYS  55   3.481 -16.878 -15.615
  391   1HB   LYS  55          1HB       LYS  55   1.992 -18.720 -16.740
  392   2HB   LYS  55          2HB       LYS  55   2.894 -19.894 -15.803
  393   1HG   LYS  55          1HG       LYS  55   3.752 -19.732 -18.093
  394   2HG   LYS  55          2HG       LYS  55   4.045 -18.008 -17.941
  395   1HD   LYS  55          1HD       LYS  55   5.846 -18.442 -16.218
  396   2HD   LYS  55          2HD       LYS  55   6.167 -19.249 -17.745
  397   1HE   LYS  55          1HE       LYS  55   6.223 -20.454 -15.218
  398   2HE   LYS  55          2HE       LYS  55   4.660 -20.994 -15.826
  399   1HZ   LYS  55          1HZ       LYS  55   6.685 -22.400 -16.381
  400   2HZ   LYS  55          2HZ       LYS  55   7.138 -21.235 -17.462
  401   3HZ   LYS  55          3HZ       LYS  55   5.708 -22.038 -17.663
  402    H    GLU  56           H        GLU  56   2.456 -19.087 -13.072
  403    HA   GLU  56           HA       GLU  56  -0.413 -18.422 -13.070
  404   1HB   GLU  56          1HB       GLU  56  -0.194 -19.454 -10.615
  405   2HB   GLU  56          2HB       GLU  56   1.407 -19.923 -11.155
  406   1HG   GLU  56          1HG       GLU  56  -0.101 -20.853 -13.299
  407   2HG   GLU  56          2HG       GLU  56  -1.304 -20.951 -12.024
  408    H    GLU  57           H        GLU  57   2.447 -17.139 -11.465
  409    HA   GLU  57           HA       GLU  57   1.012 -15.506  -9.422
  410   1HB   GLU  57          1HB       GLU  57   3.338 -16.440  -9.104
  411   2HB   GLU  57          2HB       GLU  57   3.070 -14.779  -8.620
  412   1HG   GLU  57          1HG       GLU  57   4.508 -15.651 -11.217
  413   2HG   GLU  57          2HG       GLU  57   4.225 -13.976 -10.759
  414    H    LEU  58           H        LEU  58   2.336 -15.023 -12.650
  415    HA   LEU  58           HA       LEU  58   2.213 -12.065 -12.636
  416   1HB   LEU  58          1HB       LEU  58   3.058 -14.213 -14.522
  417   2HB   LEU  58          2HB       LEU  58   2.329 -12.841 -15.332
  418    HG   LEU  58           HG       LEU  58   4.723 -12.477 -15.265
  419   1HD1  LEU  58          1HD1      LEU  58   5.006 -10.359 -13.917
  420   2HD1  LEU  58          2HD1      LEU  58   3.477 -10.353 -14.808
  421   3HD1  LEU  58          3HD1      LEU  58   3.479 -10.691 -13.060
  422   1HD2  LEU  58          1HD2      LEU  58   4.652 -12.965 -12.215
  423   2HD2  LEU  58          2HD2      LEU  58   5.291 -14.088 -13.442
  424   3HD2  LEU  58          3HD2      LEU  58   6.089 -12.527 -13.175
  425    H    ASP  59           H        ASP  59   0.217 -14.703 -13.931
  426    HA   ASP  59           HA       ASP  59  -1.796 -12.992 -15.271
  427   1HB   ASP  59          1HB       ASP  59  -1.318 -15.374 -15.971
  428   2HB   ASP  59          2HB       ASP  59  -2.063 -15.950 -14.498
  429    H    ALA  60           H        ALA  60  -1.456 -14.515 -12.110
  430    HA   ALA  60           HA       ALA  60  -4.143 -13.794 -11.039
  431   1HB   ALA  60          1HB       ALA  60  -3.202 -14.481  -8.838
  432   2HB   ALA  60          2HB       ALA  60  -2.876 -15.697 -10.088
  433   3HB   ALA  60          3HB       ALA  60  -1.572 -14.614  -9.540
  434    H    ILE  61           H        ILE  61  -0.988 -12.287 -11.295
  435    HA   ILE  61           HA       ILE  61  -1.272 -10.223  -9.216
  436    HB   ILE  61           HB       ILE  61   0.713 -10.844 -11.339
  437   1HG1  ILE  61          1HG1      ILE  61   0.624 -10.717  -8.462
  438   2HG1  ILE  61          2HG1      ILE  61   1.947 -11.243  -9.482
  439   1HG2  ILE  61          1HG2      ILE  61   1.813  -8.587 -11.361
  440   2HG2  ILE  61          2HG2      ILE  61   0.205  -8.499 -12.076
  441   3HG2  ILE  61          3HG2      ILE  61   0.465  -7.900 -10.422
  442   1HD1  ILE  61          1HD1      ILE  61   1.572  -8.353  -8.495
  443   2HD1  ILE  61          2HD1      ILE  61   2.790  -9.534  -7.968
  444   3HD1  ILE  61          3HD1      ILE  61   2.847  -8.888  -9.624
  445    H    ILE  62           H        ILE  62  -2.042 -10.445 -12.658
  446    HA   ILE  62           HA       ILE  62  -2.884  -7.580 -12.928
  447    HB   ILE  62           HB       ILE  62  -2.809  -9.935 -14.847
  448   1HG1  ILE  62          1HG1      ILE  62  -0.683  -8.798 -14.715
  449   2HG1  ILE  62          2HG1      ILE  62  -1.415  -7.208 -14.668
  450   1HG2  ILE  62          1HG2      ILE  62  -3.839  -8.539 -16.663
  451   2HG2  ILE  62          2HG2      ILE  62  -4.999  -8.803 -15.363
  452   3HG2  ILE  62          3HG2      ILE  62  -4.173  -7.234 -15.498
  453   1HD1  ILE  62          1HD1      ILE  62  -2.051  -7.298 -17.063
  454   2HD1  ILE  62          2HD1      ILE  62  -0.321  -7.643 -16.861
  455   3HD1  ILE  62          3HD1      ILE  62  -1.454  -8.976 -17.183
  456    H    GLU  63           H        GLU  63  -4.343 -10.774 -12.529
  457    HA   GLU  63           HA       GLU  63  -7.166 -10.122 -12.925
  458   1HB   GLU  63          1HB       GLU  63  -6.440 -12.441 -12.879
  459   2HB   GLU  63          2HB       GLU  63  -5.859 -12.312 -11.230
  460   1HG   GLU  63          1HG       GLU  63  -8.054 -12.366 -10.299
  461   2HG   GLU  63          2HG       GLU  63  -8.814 -11.742 -11.753
  462    H    GLU  64           H        GLU  64  -4.933  -9.720 -10.236
  463    HA   GLU  64           HA       GLU  64  -6.627  -9.361  -7.977
  464   1HB   GLU  64          1HB       GLU  64  -3.916  -8.234  -8.700
  465   2HB   GLU  64          2HB       GLU  64  -4.353  -9.401  -7.468
  466   1HG   GLU  64          1HG       GLU  64  -5.559  -6.725  -6.924
  467   2HG   GLU  64          2HG       GLU  64  -3.816  -6.630  -7.109
  468    H    VAL  65           H        VAL  65  -5.601  -6.913 -10.365
  469    HA   VAL  65           HA       VAL  65  -8.012  -5.172  -9.643
  470    HB   VAL  65           HB       VAL  65  -6.553  -3.866  -8.513
  471   1HG1  VAL  65          1HG1      VAL  65  -4.092  -3.632  -8.889
  472   2HG1  VAL  65          2HG1      VAL  65  -4.547  -5.340  -8.740
  473   3HG1  VAL  65          3HG1      VAL  65  -4.188  -4.656 -10.344
  474   1HG2  VAL  65          1HG2      VAL  65  -5.922  -2.829 -11.362
  475   2HG2  VAL  65          2HG2      VAL  65  -7.315  -2.362 -10.357
  476   3HG2  VAL  65          3HG2      VAL  65  -5.678  -1.926  -9.847
  477    H    ASP  66           H        ASP  66  -9.199  -5.245 -11.417
  478    HA   ASP  66           HA       ASP  66  -8.233  -4.289 -14.050
  479   1HB   ASP  66          1HB       ASP  66  -9.280  -7.076 -14.450
  480   2HB   ASP  66          2HB       ASP  66  -7.687  -6.981 -13.734
  481    H    GLU  67           H        GLU  67 -10.087  -3.407 -12.284
  482    HA   GLU  67           HA       GLU  67 -12.834  -4.203 -12.434
  483   1HB   GLU  67          1HB       GLU  67 -11.550  -1.484 -12.066
  484   2HB   GLU  67          2HB       GLU  67 -13.278  -1.551 -12.352
  485   1HG   GLU  67          1HG       GLU  67 -13.312  -3.317 -10.347
  486   2HG   GLU  67          2HG       GLU  67 -13.220  -1.597 -10.013
  487    H    ASP  68           H        ASP  68 -10.835  -2.501 -14.780
  488    HA   ASP  68           HA       ASP  68 -13.084  -1.921 -16.691
  489   1HB   ASP  68          1HB       ASP  68 -10.884  -1.385 -18.221
  490   2HB   ASP  68          2HB       ASP  68 -11.668  -0.237 -17.160
  491    H    GLY  69           H        GLY  69 -10.334  -4.153 -16.394
  492   1HA   GLY  69          1HA       GLY  69 -10.213  -6.491 -17.169
  493   2HA   GLY  69          2HA       GLY  69 -11.764  -6.266 -17.990
  494    H    SER  70           H        SER  70  -8.638  -4.555 -18.195
  495    HA   SER  70           HA       SER  70  -8.772  -4.560 -21.233
  496   1HB   SER  70          1HB       SER  70  -8.315  -2.385 -20.601
  497   2HB   SER  70          2HB       SER  70  -6.674  -2.981 -20.863
  498    HG   SER  70           HG       SER  70  -7.750  -2.002 -18.669
  499    H    GLY  71           H        GLY  71  -6.892  -5.777 -18.509
  500   1HA   GLY  71          1HA       GLY  71  -5.514  -7.866 -20.184
  501   2HA   GLY  71          2HA       GLY  71  -5.379  -7.693 -18.429
  502    H    THR  72           H        THR  72  -4.761  -4.850 -18.525
  503    HA   THR  72           HA       THR  72  -1.794  -5.024 -18.866
  504    HB   THR  72           HB       THR  72  -1.528  -3.093 -20.388
  505    HG1  THR  72           HG1      THR  72  -3.623  -2.876 -21.711
  506   1HG2  THR  72          1HG2      THR  72  -2.059  -4.144 -22.550
  507   2HG2  THR  72          2HG2      THR  72  -1.422  -5.385 -21.449
  508   3HG2  THR  72          3HG2      THR  72  -3.171  -5.305 -21.791
  509    H    ILE  73           H        ILE  73  -0.730  -3.453 -17.703
  510    HA   ILE  73           HA       ILE  73  -2.407  -1.912 -15.680
  511    HB   ILE  73           HB       ILE  73   0.531  -2.747 -15.660
  512   1HG1  ILE  73          1HG1      ILE  73  -0.023  -4.148 -13.772
  513   2HG1  ILE  73          2HG1      ILE  73  -1.563  -3.358 -13.503
  514   1HG2  ILE  73          1HG2      ILE  73   0.839  -1.572 -13.485
  515   2HG2  ILE  73          2HG2      ILE  73   0.371  -0.402 -14.727
  516   3HG2  ILE  73          3HG2      ILE  73  -0.827  -0.951 -13.530
  517   1HD1  ILE  73          1HD1      ILE  73  -0.979  -5.237 -15.866
  518   2HD1  ILE  73          2HD1      ILE  73  -1.986  -5.567 -14.440
  519   3HD1  ILE  73          3HD1      ILE  73  -2.507  -4.346 -15.625
  520    H    ASP  74           H        ASP  74  -3.062  -0.444 -17.359
  521    HA   ASP  74           HA       ASP  74  -1.312   1.276 -18.914
  522   1HB   ASP  74          1HB       ASP  74  -3.170   2.501 -19.565
  523   2HB   ASP  74          2HB       ASP  74  -3.913   2.481 -17.982
  524    H    PHE  75           H        PHE  75  -1.556   3.811 -18.491
  525    HA   PHE  75           HA       PHE  75   0.228   4.414 -16.220
  526   1HB   PHE  75          1HB       PHE  75   0.205   5.654 -18.453
  527   2HB   PHE  75          2HB       PHE  75  -1.299   6.408 -18.000
  528    HD1  PHE  75           HD1      PHE  75   1.133   8.010 -18.679
  529    HD2  PHE  75           HD2      PHE  75  -0.096   6.451 -14.861
  530    HE1  PHE  75           HE1      PHE  75   2.313   9.843 -17.538
  531    HE2  PHE  75           HE2      PHE  75   1.081   8.301 -13.740
  532    HZ   PHE  75           HZ       PHE  75   2.272  10.005 -15.072
  533    H    GLU  76           H        GLU  76  -3.212   4.929 -16.926
  534    HA   GLU  76           HA       GLU  76  -3.900   6.501 -14.538
  535   1HB   GLU  76          1HB       GLU  76  -5.544   5.028 -16.612
  536   2HB   GLU  76          2HB       GLU  76  -6.316   5.533 -15.125
  537   1HG   GLU  76          1HG       GLU  76  -5.745   7.111 -17.500
  538   2HG   GLU  76          2HG       GLU  76  -6.715   7.526 -16.102
  539    H    GLU  77           H        GLU  77  -3.760   3.066 -15.276
  540    HA   GLU  77           HA       GLU  77  -5.093   2.110 -12.785
  541   1HB   GLU  77          1HB       GLU  77  -5.006   0.849 -15.015
  542   2HB   GLU  77          2HB       GLU  77  -3.343   0.449 -14.653
  543   1HG   GLU  77          1HG       GLU  77  -3.920  -1.226 -13.174
  544   2HG   GLU  77          2HG       GLU  77  -5.156  -0.251 -12.387
  545    H    PHE  78           H        PHE  78  -1.822   2.824 -13.814
  546    HA   PHE  78           HA       PHE  78  -0.364   1.482 -11.652
  547   1HB   PHE  78          1HB       PHE  78   0.509   3.916 -13.331
  548   2HB   PHE  78          2HB       PHE  78   0.692   2.253 -13.826
  549    HD1  PHE  78           HD1      PHE  78   1.528   1.228 -10.902
  550    HD2  PHE  78           HD2      PHE  78   2.864   4.495 -13.362
  551    HE1  PHE  78           HE1      PHE  78   3.743   1.144  -9.830
  552    HE2  PHE  78           HE2      PHE  78   5.071   4.398 -12.277
  553    HZ   PHE  78           HZ       PHE  78   5.517   2.721 -10.518
  554    H    LEU  79           H        LEU  79  -1.346   4.884 -12.132
  555    HA   LEU  79           HA       LEU  79  -0.351   5.905  -9.566
  556   1HB   LEU  79          1HB       LEU  79  -2.641   7.161 -11.178
  557   2HB   LEU  79          2HB       LEU  79  -1.583   7.960 -10.035
  558    HG   LEU  79           HG       LEU  79  -0.782   6.887 -12.808
  559   1HD1  LEU  79          1HD1      LEU  79  -0.407   9.291 -13.365
  560   2HD1  LEU  79          2HD1      LEU  79  -2.087   9.021 -12.865
  561   3HD1  LEU  79          3HD1      LEU  79  -0.938   9.780 -11.736
  562   1HD2  LEU  79          1HD2      LEU  79   1.037   8.262 -10.717
  563   2HD2  LEU  79          2HD2      LEU  79   1.169   6.576 -11.276
  564   3HD2  LEU  79          3HD2      LEU  79   1.484   7.903 -12.404
  565    H    VAL  80           H        VAL  80  -3.414   4.519 -10.622
  566    HA   VAL  80           HA       VAL  80  -5.027   5.167  -8.242
  567    HB   VAL  80           HB       VAL  80  -5.735   4.283 -10.680
  568   1HG1  VAL  80          1HG1      VAL  80  -6.621   1.942 -10.605
  569   2HG1  VAL  80          2HG1      VAL  80  -4.860   1.952 -10.447
  570   3HG1  VAL  80          3HG1      VAL  80  -5.871   1.690  -9.008
  571   1HG2  VAL  80          1HG2      VAL  80  -7.421   3.662  -8.166
  572   2HG2  VAL  80          2HG2      VAL  80  -7.353   5.236  -8.992
  573   3HG2  VAL  80          3HG2      VAL  80  -8.032   3.832  -9.830
  574    H    MET  81           H        MET  81  -2.990   2.434  -9.227
  575    HA   MET  81           HA       MET  81  -3.533   0.481  -7.153
  576   1HB   MET  81          1HB       MET  81  -0.672   0.874  -8.124
  577   2HB   MET  81          2HB       MET  81  -1.904   0.392  -9.277
  578   1HG   MET  81          1HG       MET  81  -0.818  -1.184  -6.904
  579   2HG   MET  81          2HG       MET  81  -2.469  -1.517  -7.452
  580   1HE   MET  81          1HE       MET  81  -1.849  -3.991  -8.029
  581   2HE   MET  81          2HE       MET  81  -0.574  -4.481  -9.186
  582   3HE   MET  81          3HE       MET  81  -0.120  -3.791  -7.601
  583    H    MET  82           H        MET  82  -1.062   3.071  -7.232
  584    HA   MET  82           HA       MET  82  -0.069   2.572  -4.489
  585   1HB   MET  82          1HB       MET  82   1.042   4.926  -4.889
  586   2HB   MET  82          2HB       MET  82   0.407   4.809  -6.520
  587   1HG   MET  82          1HG       MET  82   2.621   3.951  -6.720
  588   2HG   MET  82          2HG       MET  82   1.616   2.496  -6.698
  589   1HE   MET  82          1HE       MET  82   3.310   5.059  -4.116
  590   2HE   MET  82          2HE       MET  82   3.549   3.992  -2.700
  591   3HE   MET  82          3HE       MET  82   1.894   4.438  -3.208
  592    H    VAL  83           H        VAL  83  -2.520   4.637  -5.925
  593    HA   VAL  83           HA       VAL  83  -2.796   6.648  -3.814
  594    HB   VAL  83           HB       VAL  83  -3.903   6.335  -6.349
  595   1HG1  VAL  83          1HG1      VAL  83  -6.385   6.519  -6.100
  596   2HG1  VAL  83          2HG1      VAL  83  -5.816   4.945  -5.524
  597   3HG1  VAL  83          3HG1      VAL  83  -6.255   6.207  -4.350
  598   1HG2  VAL  83          1HG2      VAL  83  -4.755   8.407  -4.217
  599   2HG2  VAL  83          2HG2      VAL  83  -3.353   8.549  -5.303
  600   3HG2  VAL  83          3HG2      VAL  83  -4.988   8.560  -5.978
  601    NH1  ARG  84           NH1      ARG  84  -8.872   0.122  -6.541
  602    NH2  ARG  84           NH2      ARG  84 -10.129  -0.997  -5.015
  603    H    ARG  84           H        ARG  84  -4.157   3.441  -4.355
  604    HA   ARG  84           HA       ARG  84  -6.406   3.319  -2.578
  605   1HB   ARG  84          1HB       ARG  84  -4.590   1.327  -3.817
  606   2HB   ARG  84          2HB       ARG  84  -5.114   0.819  -2.219
  607   1HG   ARG  84          1HG       ARG  84  -7.382   0.666  -2.794
  608   2HG   ARG  84          2HG       ARG  84  -7.275   1.870  -4.081
  609   1HD   ARG  84          1HD       ARG  84  -5.732  -0.748  -4.412
  610   2HD   ARG  84          2HD       ARG  84  -6.355   0.324  -5.669
  611    HE   ARG  84           HE       ARG  84  -7.876  -1.845  -4.269
  612   1HH1  ARG  84          1HH1      ARG  84  -7.938   0.426  -6.839
  613   2HH1  ARG  84          2HH1      ARG  84  -9.762   0.319  -7.011
  614   1HH2  ARG  84          1HH2      ARG  84 -10.154  -1.559  -4.157
  615   2HH2  ARG  84          2HH2      ARG  84 -10.933  -0.699  -5.578
  616    H    GLN  85           H        GLN  85  -2.961   2.713  -1.834
  617    HA   GLN  85           HA       GLN  85  -3.441   2.251   1.081
  618   1HB   GLN  85          1HB       GLN  85  -0.790   2.384   1.082
  619   2HB   GLN  85          2HB       GLN  85  -0.946   2.367  -0.664
  620   1HG   GLN  85          1HG       GLN  85  -1.560   0.142  -0.763
  621   2HG   GLN  85          2HG       GLN  85  -2.532   0.207   0.691
  622   1HE2  GLN  85          1HE2      GLN  85   1.539  -0.159   1.491
  623   2HE2  GLN  85          2HE2      GLN  85   0.933   1.085   0.286
  624    H    MET  86           H        MET  86  -2.214   4.847  -0.988
  625    HA   MET  86           HA       MET  86  -1.054   6.661   0.903
  626   1HB   MET  86          1HB       MET  86  -1.926   6.852  -1.870
  627   2HB   MET  86          2HB       MET  86  -2.494   8.277  -1.019
  628   1HG   MET  86          1HG       MET  86   0.257   7.596  -1.858
  629   2HG   MET  86          2HG       MET  86   0.210   8.009  -0.136
  630   1HE   MET  86          1HE       MET  86  -2.487   9.298  -2.791
  631   2HE   MET  86          2HE       MET  86  -1.724  10.809  -3.366
  632   3HE   MET  86          3HE       MET  86  -1.006   9.229  -3.797
  633    H    LYS  87           H        LYS  87  -4.434   6.051   0.113
  634    HA   LYS  87           HA       LYS  87  -5.793   8.352   1.200
  635   1HB   LYS  87          1HB       LYS  87  -7.786   7.159   1.118
  636   2HB   LYS  87          2HB       LYS  87  -6.804   6.245  -0.017
  637   1HG   LYS  87          1HG       LYS  87  -6.293   4.527   1.732
  638   2HG   LYS  87          2HG       LYS  87  -7.246   5.408   2.916
  639   1HD   LYS  87          1HD       LYS  87  -8.225   3.953   0.389
  640   2HD   LYS  87          2HD       LYS  87  -8.561   3.562   2.072
  641   1HE   LYS  87          1HE       LYS  87  -9.644   6.123   1.989
  642   2HE   LYS  87          2HE       LYS  87  -9.892   5.635   0.307
  643   1HZ   LYS  87          1HZ       LYS  87 -10.776   3.453   1.471
  644   2HZ   LYS  87          2HZ       LYS  87 -11.749   4.775   1.282
  645   3HZ   LYS  87          3HZ       LYS  87 -11.039   4.474   2.743
  646    H    GLU  88           H        GLU  88  -4.945   5.282   2.838
  647    HA   GLU  88           HA       GLU  88  -4.846   4.677   5.170
  648   1HB   GLU  88          1HB       GLU  88  -3.421   7.362   4.998
  649   2HB   GLU  88          2HB       GLU  88  -2.729   5.752   5.043
  650   1HG   GLU  88          1HG       GLU  88  -3.625   7.528   7.304
  651   2HG   GLU  88          2HG       GLU  88  -4.052   5.839   7.517
  652    H    ASP  89           H        ASP  89  -7.298   4.988   4.837
  653    HA   ASP  89           HA       ASP  89  -8.762   7.349   5.714
  654   1HB   ASP  89          1HB       ASP  89 -10.226   4.818   6.243
  655   2HB   ASP  89          2HB       ASP  89  -9.499   4.844   4.652
  656    H    ALA  90           H        ALA  90  -8.950   8.210   7.620
  657    HA   ALA  90           HA       ALA  90  -8.579   6.538  10.171
  658   1HB   ALA  90          1HB       ALA  90  -7.951   8.669  11.335
  659   2HB   ALA  90          2HB       ALA  90  -6.856   8.350   9.975
  660   3HB   ALA  90          3HB       ALA  90  -8.128   9.585   9.817
   
  Start of MODEL          18
 Raw file had  660 H/Q atoms
  Start of MODEL   18
    1   1H    ALA   1          1H        ALA   1 -23.033   2.224 -14.738
    2   2H    ALA   1          2H        ALA   1 -21.810   1.238 -14.138
    3   3H    ALA   1          3H        ALA   1 -21.424   2.676 -14.922
    4    HA   ALA   1           HA       ALA   1 -22.330   0.113 -16.000
    5   1HB   ALA   1          1HB       ALA   1 -23.153   2.857 -17.013
    6   2HB   ALA   1          2HB       ALA   1 -24.050   1.327 -17.041
    7   3HB   ALA   1          3HB       ALA   1 -22.753   1.620 -18.228
    8    H    SER   2           H        SER   2 -20.715   3.210 -16.818
    9    HA   SER   2           HA       SER   2 -18.061   1.768 -17.262
   10   1HB   SER   2          1HB       SER   2 -18.689   1.749 -19.496
   11   2HB   SER   2          2HB       SER   2 -19.649   3.226 -19.386
   12    HG   SER   2           HG       SER   2 -17.634   3.430 -20.482
   13    H    MET   3           H        MET   3 -16.254   3.190 -17.204
   14    HA   MET   3           HA       MET   3 -14.942   5.093 -16.527
   15   1HB   MET   3          1HB       MET   3 -17.139   6.246 -17.714
   16   2HB   MET   3          2HB       MET   3 -17.321   6.891 -16.093
   17   1HG   MET   3          1HG       MET   3 -15.557   8.355 -16.349
   18   2HG   MET   3          2HG       MET   3 -14.512   7.130 -17.081
   19   1HE   MET   3          1HE       MET   3 -18.225   7.905 -18.948
   20   2HE   MET   3          2HE       MET   3 -17.775   9.603 -19.284
   21   3HE   MET   3          3HE       MET   3 -17.832   9.015 -17.597
   22    H    THR   4           H        THR   4 -14.435   3.957 -14.644
   23    HA   THR   4           HA       THR   4 -16.055   4.208 -12.154
   24    HB   THR   4           HB       THR   4 -15.014   2.141 -12.386
   25    HG1  THR   4           HG1      THR   4 -14.924   3.428 -10.351
   26   1HG2  THR   4          1HG2      THR   4 -12.768   3.277 -13.640
   27   2HG2  THR   4          2HG2      THR   4 -12.907   1.591 -13.094
   28   3HG2  THR   4          3HG2      THR   4 -12.128   2.808 -12.050
   29    H    ASP   5           H        ASP   5 -15.515   5.364 -10.316
   30    HA   ASP   5           HA       ASP   5 -13.876   7.872 -10.674
   31   1HB   ASP   5          1HB       ASP   5 -16.162   7.963  -9.600
   32   2HB   ASP   5          2HB       ASP   5 -14.879   8.733  -8.694
   33    H    GLN   6           H        GLN   6 -12.285   5.665 -10.815
   34    HA   GLN   6           HA       GLN   6 -10.826   5.254  -8.194
   35   1HB   GLN   6          1HB       GLN   6  -9.155   4.096  -9.996
   36   2HB   GLN   6          2HB       GLN   6 -10.606   4.095 -10.980
   37   1HG   GLN   6          1HG       GLN   6 -11.696   2.501  -9.686
   38   2HG   GLN   6          2HG       GLN   6 -10.996   3.046  -8.178
   39   1HE2  GLN   6          1HE2      GLN   6  -8.132   0.912 -10.237
   40   2HE2  GLN   6          2HE2      GLN   6  -8.927   2.393 -10.974
   41    H    GLN   7           H        GLN   7  -9.603   6.106 -11.430
   42    HA   GLN   7           HA       GLN   7  -7.214   7.543 -10.521
   43   1HB   GLN   7          1HB       GLN   7  -6.751   8.018 -12.770
   44   2HB   GLN   7          2HB       GLN   7  -8.434   8.336 -13.166
   45   1HG   GLN   7          1HG       GLN   7  -6.986   5.986 -13.787
   46   2HG   GLN   7          2HG       GLN   7  -8.037   5.468 -12.478
   47   1HE2  GLN   7          1HE2      GLN   7 -10.609   5.075 -14.959
   48   2HE2  GLN   7          2HE2      GLN   7  -9.593   4.351 -13.613
   49    H    ALA   8           H        ALA   8 -10.546   8.513 -11.086
   50    HA   ALA   8           HA       ALA   8 -10.400  11.363 -11.301
   51   1HB   ALA   8          1HB       ALA   8 -12.711  11.415 -10.376
   52   2HB   ALA   8          2HB       ALA   8 -12.515  10.105 -11.556
   53   3HB   ALA   8          3HB       ALA   8 -12.559   9.733  -9.814
   54    H    GLU   9           H        GLU   9 -10.997   9.555  -8.264
   55    HA   GLU   9           HA       GLU   9 -10.629  11.865  -6.481
   56   1HB   GLU   9          1HB       GLU   9 -10.661  10.216  -4.583
   57   2HB   GLU   9          2HB       GLU   9 -12.045  10.127  -5.662
   58   1HG   GLU   9          1HG       GLU   9 -11.653   7.953  -6.261
   59   2HG   GLU   9          2HG       GLU   9  -9.926   8.195  -6.500
   60    H    ALA  10           H        ALA  10  -8.529   9.130  -7.378
   61    HA   ALA  10           HA       ALA  10  -6.357   9.565  -5.496
   62   1HB   ALA  10          1HB       ALA  10  -4.995   8.130  -7.008
   63   2HB   ALA  10          2HB       ALA  10  -6.615   7.450  -6.760
   64   3HB   ALA  10          3HB       ALA  10  -6.219   8.268  -8.293
   65    NH1  ARG  11           NH1      ARG  11  -8.544  12.971 -14.636
   66    NH2  ARG  11           NH2      ARG  11  -8.018  10.875 -13.935
   67    H    ARG  11           H        ARG  11  -7.142  11.047  -8.579
   68    HA   ARG  11           HA       ARG  11  -4.451  12.310  -9.081
   69   1HB   ARG  11          1HB       ARG  11  -5.263  12.250 -11.189
   70   2HB   ARG  11          2HB       ARG  11  -6.869  11.826 -10.618
   71   1HG   ARG  11          1HG       ARG  11  -7.551  14.156 -10.378
   72   2HG   ARG  11          2HG       ARG  11  -5.907  14.747 -10.633
   73   1HD   ARG  11          1HD       ARG  11  -7.857  14.488 -12.631
   74   2HD   ARG  11          2HD       ARG  11  -6.130  14.701 -12.926
   75    HE   ARG  11           HE       ARG  11  -6.020  12.069 -12.970
   76   1HH1  ARG  11          1HH1      ARG  11  -7.431  10.283 -13.337
   77   2HH1  ARG  11          2HH1      ARG  11  -8.748  10.562 -14.584
   78   1HH2  ARG  11          1HH2      ARG  11  -8.401  13.981 -14.531
   79   2HH2  ARG  11          2HH2      ARG  11  -9.195  12.506 -15.279
   80    H    ALA  12           H        ALA  12  -7.759  13.524  -8.446
   81    HA   ALA  12           HA       ALA  12  -7.338  16.277  -7.948
   82   1HB   ALA  12          1HB       ALA  12  -9.312  16.235  -6.437
   83   2HB   ALA  12          2HB       ALA  12  -9.589  15.250  -7.886
   84   3HB   ALA  12          3HB       ALA  12  -9.232  14.460  -6.330
   85    H    PHE  13           H        PHE  13  -6.524  13.537  -5.885
   86    HA   PHE  13           HA       PHE  13  -5.947  14.960  -3.399
   87   1HB   PHE  13          1HB       PHE  13  -6.403  12.527  -3.515
   88   2HB   PHE  13          2HB       PHE  13  -4.927  12.236  -4.398
   89    HD1  PHE  13           HD1      PHE  13  -2.678  12.502  -3.175
   90    HD2  PHE  13           HD2      PHE  13  -6.420  12.891  -1.084
   91    HE1  PHE  13           HE1      PHE  13  -1.525  12.172  -1.026
   92    HE2  PHE  13           HE2      PHE  13  -5.249  12.563   1.053
   93    HZ   PHE  13           HZ       PHE  13  -2.806  12.193   1.088
   94    H    LEU  14           H        LEU  14  -3.672  13.470  -5.735
   95    HA   LEU  14           HA       LEU  14  -1.502  15.502  -4.970
   96   1HB   LEU  14          1HB       LEU  14  -0.072  13.619  -6.308
   97   2HB   LEU  14          2HB       LEU  14  -0.313  13.611  -4.575
   98    HG   LEU  14           HG       LEU  14  -2.320  12.019  -4.932
   99   1HD1  LEU  14          1HD1      LEU  14  -2.446  10.774  -7.093
  100   2HD1  LEU  14          2HD1      LEU  14  -2.755  12.501  -7.346
  101   3HD1  LEU  14          3HD1      LEU  14  -1.177  11.809  -7.795
  102   1HD2  LEU  14          1HD2      LEU  14   0.464  11.000  -5.818
  103   2HD2  LEU  14          2HD2      LEU  14  -0.122  11.125  -4.141
  104   3HD2  LEU  14          3HD2      LEU  14  -0.884   9.980  -5.254
  105    H    SER  15           H        SER  15  -1.323  17.065  -6.359
  106    HA   SER  15           HA       SER  15  -2.587  17.220  -8.991
  107   1HB   SER  15          1HB       SER  15  -1.001  19.319  -9.213
  108   2HB   SER  15          2HB       SER  15  -2.315  19.316  -8.034
  109    HG   SER  15           HG       SER  15   0.412  19.246  -7.681
  110    H    GLU  16           H        GLU  16  -0.852  18.228 -10.760
  111    HA   GLU  16           HA       GLU  16   0.447  15.893 -11.954
  112   1HB   GLU  16          1HB       GLU  16  -0.518  17.722 -13.305
  113   2HB   GLU  16          2HB       GLU  16   0.687  18.854 -12.721
  114   1HG   GLU  16          1HG       GLU  16   0.848  17.332 -15.075
  115   2HG   GLU  16          2HG       GLU  16   1.859  16.391 -13.993
  116    H    GLU  17           H        GLU  17   1.567  18.586 -10.005
  117    HA   GLU  17           HA       GLU  17   4.448  18.377 -10.447
  118   1HB   GLU  17          1HB       GLU  17   3.059  20.243  -9.177
  119   2HB   GLU  17          2HB       GLU  17   3.397  19.294  -7.742
  120   1HG   GLU  17          1HG       GLU  17   5.736  19.745  -7.817
  121   2HG   GLU  17          2HG       GLU  17   5.747  20.028  -9.549
  122    H    MET  18           H        MET  18   2.391  17.032  -7.849
  123    HA   MET  18           HA       MET  18   4.490  15.455  -6.483
  124   1HB   MET  18          1HB       MET  18   2.582  14.243  -5.365
  125   2HB   MET  18          2HB       MET  18   1.444  15.072  -6.412
  126   1HG   MET  18          1HG       MET  18   1.776  17.198  -5.349
  127   2HG   MET  18          2HG       MET  18   3.335  16.725  -4.655
  128   1HE   MET  18          1HE       MET  18   1.237  18.115  -2.794
  129   2HE   MET  18          2HE       MET  18   1.250  17.047  -1.360
  130   3HE   MET  18          3HE       MET  18   2.784  17.443  -2.190
  131    H    ILE  19           H        ILE  19   2.224  14.901  -9.124
  132    HA   ILE  19           HA       ILE  19   2.385  11.993  -9.322
  133    HB   ILE  19           HB       ILE  19   1.374  14.177 -11.097
  134   1HG1  ILE  19          1HG1      ILE  19   0.197  12.271  -9.406
  135   2HG1  ILE  19          2HG1      ILE  19  -0.015  11.510 -10.968
  136   1HG2  ILE  19          1HG2      ILE  19   1.095  12.718 -13.117
  137   2HG2  ILE  19          2HG2      ILE  19   2.807  12.958 -12.772
  138   3HG2  ILE  19          3HG2      ILE  19   2.030  11.419 -12.337
  139   1HD1  ILE  19          1HD1      ILE  19  -1.276  13.442 -11.875
  140   2HD1  ILE  19          2HD1      ILE  19  -1.996  12.885 -10.350
  141   3HD1  ILE  19          3HD1      ILE  19  -1.000  14.360 -10.369
  142    H    ALA  20           H        ALA  20   4.411  14.631 -10.492
  143    HA   ALA  20           HA       ALA  20   6.007  13.428 -12.520
  144   1HB   ALA  20          1HB       ALA  20   7.776  15.085 -11.939
  145   2HB   ALA  20          2HB       ALA  20   6.165  15.828 -11.940
  146   3HB   ALA  20          3HB       ALA  20   6.969  15.449 -10.395
  147    H    GLU  21           H        GLU  21   6.239  13.086  -9.009
  148    HA   GLU  21           HA       GLU  21   8.905  11.903  -8.796
  149   1HB   GLU  21          1HB       GLU  21   6.497  11.703  -6.914
  150   2HB   GLU  21          2HB       GLU  21   8.068  11.023  -6.537
  151   1HG   GLU  21          1HG       GLU  21   7.910  13.985  -7.288
  152   2HG   GLU  21          2HG       GLU  21   9.093  13.168  -6.281
  153    H    PHE  22           H        PHE  22   5.648  10.516  -9.114
  154    HA   PHE  22           HA       PHE  22   6.513   7.671  -9.130
  155   1HB   PHE  22          1HB       PHE  22   3.804   8.672 -10.167
  156   2HB   PHE  22          2HB       PHE  22   4.209   7.100  -9.534
  157    HD1  PHE  22           HD1      PHE  22   3.712  10.676  -8.488
  158    HD2  PHE  22           HD2      PHE  22   4.183   6.612  -7.149
  159    HE1  PHE  22           HE1      PHE  22   3.044  11.337  -6.216
  160    HE2  PHE  22           HE2      PHE  22   3.523   7.296  -4.879
  161    HZ   PHE  22           HZ       PHE  22   2.927   9.649  -4.413
  162    H    LYS  23           H        LYS  23   6.195  10.199 -11.504
  163    HA   LYS  23           HA       LYS  23   5.775   8.728 -13.978
  164   1HB   LYS  23          1HB       LYS  23   6.891  11.439 -13.285
  165   2HB   LYS  23          2HB       LYS  23   7.459  10.780 -14.803
  166   1HG   LYS  23          1HG       LYS  23   5.115  10.560 -15.643
  167   2HG   LYS  23          2HG       LYS  23   4.491  11.062 -14.081
  168   1HD   LYS  23          1HD       LYS  23   6.381  12.935 -15.594
  169   2HD   LYS  23          2HD       LYS  23   5.204  13.341 -14.340
  170   1HE   LYS  23          1HE       LYS  23   4.744  12.856 -17.305
  171   2HE   LYS  23          2HE       LYS  23   3.458  12.318 -16.216
  172   1HZ   LYS  23          1HZ       LYS  23   4.594  15.042 -15.947
  173   2HZ   LYS  23          2HZ       LYS  23   3.115  14.488 -15.461
  174   3HZ   LYS  23          3HZ       LYS  23   3.423  14.722 -17.067
  175    H    ALA  24           H        ALA  24   8.704   9.445 -12.112
  176    HA   ALA  24           HA       ALA  24  10.698   8.526 -14.042
  177   1HB   ALA  24          1HB       ALA  24  12.285   8.541 -12.128
  178   2HB   ALA  24          2HB       ALA  24  11.288  10.007 -12.145
  179   3HB   ALA  24          3HB       ALA  24  10.942   8.711 -10.973
  180    H    ALA  25           H        ALA  25   9.904   6.942 -10.935
  181    HA   ALA  25           HA       ALA  25  11.134   4.372 -11.459
  182   1HB   ALA  25          1HB       ALA  25   9.816   3.538  -9.521
  183   2HB   ALA  25          2HB       ALA  25  10.529   5.125  -9.177
  184   3HB   ALA  25          3HB       ALA  25   8.791   4.993  -9.549
  185    H    PHE  26           H        PHE  26   8.038   5.688 -12.397
  186    HA   PHE  26           HA       PHE  26   6.417   3.303 -12.769
  187   1HB   PHE  26          1HB       PHE  26   5.362   5.503 -12.911
  188   2HB   PHE  26          2HB       PHE  26   6.300   5.961 -14.307
  189    HD1  PHE  26           HD1      PHE  26   3.800   3.334 -13.171
  190    HD2  PHE  26           HD2      PHE  26   5.361   5.579 -16.492
  191    HE1  PHE  26           HE1      PHE  26   2.021   2.445 -14.622
  192    HE2  PHE  26           HE2      PHE  26   3.574   4.678 -17.928
  193    HZ   PHE  26           HZ       PHE  26   1.886   3.138 -16.990
  194    H    ASP  27           H        ASP  27   8.705   4.962 -14.926
  195    HA   ASP  27           HA       ASP  27   8.338   3.251 -17.288
  196   1HB   ASP  27          1HB       ASP  27  10.873   4.866 -16.673
  197   2HB   ASP  27          2HB       ASP  27  10.346   4.268 -18.230
  198    H    MET  28           H        MET  28  10.411   3.125 -14.446
  199    HA   MET  28           HA       MET  28  12.337   1.103 -15.178
  200   1HB   MET  28          1HB       MET  28  11.997   2.471 -12.869
  201   2HB   MET  28          2HB       MET  28  11.198   0.991 -12.371
  202   1HG   MET  28          1HG       MET  28  13.476   0.739 -11.654
  203   2HG   MET  28          2HG       MET  28  13.341  -0.301 -13.082
  204   1HE   MET  28          1HE       MET  28  14.283   3.433 -11.929
  205   2HE   MET  28          2HE       MET  28  15.008   4.059 -13.440
  206   3HE   MET  28          3HE       MET  28  13.265   3.661 -13.386
  207    H    PHE  29           H        PHE  29   9.056   0.763 -13.832
  208    HA   PHE  29           HA       PHE  29   9.072  -2.211 -13.746
  209   1HB   PHE  29          1HB       PHE  29   6.643  -0.321 -13.612
  210   2HB   PHE  29          2HB       PHE  29   6.624  -2.027 -13.251
  211    HD1  PHE  29           HD1      PHE  29   9.769  -0.855 -12.064
  212    HD2  PHE  29           HD2      PHE  29   5.580  -0.724 -11.079
  213    HE1  PHE  29           HE1      PHE  29  10.324  -0.386  -9.712
  214    HE2  PHE  29           HE2      PHE  29   6.159  -0.261  -8.732
  215    HZ   PHE  29           HZ       PHE  29   8.524  -0.099  -8.043
  216    H    ASP  30           H        ASP  30   8.034   0.306 -15.986
  217    HA   ASP  30           HA       ASP  30   6.426  -1.081 -17.885
  218   1HB   ASP  30          1HB       ASP  30   8.543   0.990 -18.695
  219   2HB   ASP  30          2HB       ASP  30   7.024   1.405 -17.935
  220    H    ALA  31           H        ALA  31   9.965  -0.613 -18.182
  221    HA   ALA  31           HA       ALA  31  11.698  -2.195 -18.778
  222   1HB   ALA  31          1HB       ALA  31  11.149  -4.535 -19.419
  223   2HB   ALA  31          2HB       ALA  31  10.346  -4.068 -17.907
  224   3HB   ALA  31          3HB       ALA  31   9.408  -4.165 -19.420
  225    H    ASP  32           H        ASP  32   8.836  -1.916 -20.879
  226    HA   ASP  32           HA       ASP  32  10.479  -2.143 -23.416
  227   1HB   ASP  32          1HB       ASP  32   8.085  -1.768 -24.498
  228   2HB   ASP  32          2HB       ASP  32   8.577  -3.326 -23.877
  229    H    GLY  33           H        GLY  33   7.782   0.048 -22.598
  230   1HA   GLY  33          1HA       GLY  33   8.468   2.629 -22.271
  231   2HA   GLY  33          2HA       GLY  33   9.390   2.378 -23.735
  232    H    GLY  34           H        GLY  34   6.157   1.150 -22.857
  233   1HA   GLY  34          1HA       GLY  34   4.924   2.265 -25.409
  234   2HA   GLY  34          2HA       GLY  34   4.164   1.093 -24.325
  235    H    GLY  35           H        GLY  35   3.509   1.834 -22.183
  236   1HA   GLY  35          1HA       GLY  35   3.233   4.601 -21.320
  237   2HA   GLY  35          2HA       GLY  35   1.799   4.238 -22.291
  238    H    ASP  36           H        ASP  36   1.745   1.415 -21.614
  239    HA   ASP  36           HA       ASP  36   0.742   1.547 -18.720
  240   1HB   ASP  36          1HB       ASP  36  -0.725  -0.538 -19.703
  241   2HB   ASP  36          2HB       ASP  36  -1.279   1.118 -19.612
  242    H    ILE  37           H        ILE  37   0.576  -0.736 -17.787
  243    HA   ILE  37           HA       ILE  37   3.203  -2.240 -18.273
  244    HB   ILE  37           HB       ILE  37   2.054  -2.543 -15.563
  245   1HG1  ILE  37          1HG1      ILE  37   2.824   0.239 -16.478
  246   2HG1  ILE  37          2HG1      ILE  37   1.651  -0.270 -15.279
  247   1HG2  ILE  37          1HG2      ILE  37   4.423  -2.583 -14.888
  248   2HG2  ILE  37          2HG2      ILE  37   4.189  -3.612 -16.308
  249   3HG2  ILE  37          3HG2      ILE  37   4.938  -2.008 -16.492
  250   1HD1  ILE  37          1HD1      ILE  37   4.693  -0.194 -14.815
  251   2HD1  ILE  37          2HD1      ILE  37   3.463   0.894 -14.134
  252   3HD1  ILE  37          3HD1      ILE  37   3.502  -0.815 -13.640
  253    H    SER  38           H        SER  38   2.774  -4.402 -16.674
  254    HA   SER  38           HA       SER  38   0.127  -5.716 -17.213
  255   1HB   SER  38          1HB       SER  38   0.580  -7.001 -19.033
  256   2HB   SER  38          2HB       SER  38   1.748  -5.730 -19.401
  257    HG   SER  38           HG       SER  38   2.805  -7.624 -19.496
  258    H    THR  39           H        THR  39   0.781  -8.306 -16.980
  259    HA   THR  39           HA       THR  39   1.734  -8.555 -14.134
  260    HB   THR  39           HB       THR  39   1.167 -11.166 -15.021
  261    HG1  THR  39           HG1      THR  39  -0.942  -9.534 -15.871
  262   1HG2  THR  39          1HG2      THR  39  -0.859 -11.039 -13.640
  263   2HG2  THR  39          2HG2      THR  39   0.452 -10.171 -12.807
  264   3HG2  THR  39          3HG2      THR  39  -0.830  -9.261 -13.650
  265    H    LYS  40           H        LYS  40   2.700  -9.488 -17.403
  266    HA   LYS  40           HA       LYS  40   4.965 -11.221 -16.686
  267   1HB   LYS  40          1HB       LYS  40   3.770 -11.241 -18.885
  268   2HB   LYS  40          2HB       LYS  40   4.469  -9.705 -19.328
  269   1HG   LYS  40          1HG       LYS  40   5.828 -12.435 -18.895
  270   2HG   LYS  40          2HG       LYS  40   6.792 -10.983 -18.945
  271   1HD   LYS  40          1HD       LYS  40   5.099 -12.082 -21.287
  272   2HD   LYS  40          2HD       LYS  40   5.857 -10.516 -21.271
  273   1HE   LYS  40          1HE       LYS  40   7.123 -12.471 -22.446
  274   2HE   LYS  40          2HE       LYS  40   8.043 -11.295 -21.518
  275   1HZ   LYS  40          1HZ       LYS  40   8.774 -13.488 -20.962
  276   2HZ   LYS  40          2HZ       LYS  40   7.247 -14.034 -20.649
  277   3HZ   LYS  40          3HZ       LYS  40   7.958 -12.942 -19.634
  278    H    GLU  41           H        GLU  41   4.555  -7.768 -17.396
  279    HA   GLU  41           HA       GLU  41   7.442  -7.060 -17.439
  280   1HB   GLU  41          1HB       GLU  41   6.700  -5.241 -18.441
  281   2HB   GLU  41          2HB       GLU  41   6.042  -4.672 -16.922
  282   1HG   GLU  41          1HG       GLU  41   4.218  -6.570 -18.377
  283   2HG   GLU  41          2HG       GLU  41   3.858  -5.080 -17.532
  284    H    LEU  42           H        LEU  42   4.787  -6.793 -15.086
  285    HA   LEU  42           HA       LEU  42   6.128  -5.292 -12.991
  286   1HB   LEU  42          1HB       LEU  42   3.757  -5.498 -12.804
  287   2HB   LEU  42          2HB       LEU  42   3.779  -7.241 -12.961
  288    HG   LEU  42           HG       LEU  42   4.601  -7.560 -10.685
  289   1HD1  LEU  42          1HD1      LEU  42   2.445  -5.361 -10.549
  290   2HD1  LEU  42          2HD1      LEU  42   2.114  -7.035 -11.020
  291   3HD1  LEU  42          3HD1      LEU  42   2.717  -6.680  -9.382
  292   1HD2  LEU  42          1HD2      LEU  42   5.236  -5.740  -9.140
  293   2HD2  LEU  42          2HD2      LEU  42   6.211  -5.571 -10.621
  294   3HD2  LEU  42          3HD2      LEU  42   4.826  -4.498 -10.351
  295    H    GLY  43           H        GLY  43   5.897  -8.781 -13.621
  296   1HA   GLY  43          1HA       GLY  43   7.107 -10.693 -12.752
  297   2HA   GLY  43          2HA       GLY  43   7.168  -9.805 -11.224
  298    H    THR  44           H        THR  44   8.504  -8.477 -14.176
  299    HA   THR  44           HA       THR  44  11.219  -9.528 -14.006
  300    HB   THR  44           HB       THR  44  10.095  -7.106 -15.475
  301    HG1  THR  44           HG1      THR  44  11.183  -9.586 -16.295
  302   1HG2  THR  44          1HG2      THR  44  12.249  -6.927 -16.733
  303   2HG2  THR  44          2HG2      THR  44  12.467  -6.497 -15.024
  304   3HG2  THR  44          3HG2      THR  44  13.013  -8.086 -15.618
  305    H    VAL  45           H        VAL  45   9.873  -6.360 -13.053
  306    HA   VAL  45           HA       VAL  45  12.294  -5.134 -12.033
  307    HB   VAL  45           HB       VAL  45   9.498  -4.420 -12.095
  308   1HG1  VAL  45          1HG1      VAL  45   9.254  -3.115  -9.985
  309   2HG1  VAL  45          2HG1      VAL  45   9.397  -4.840  -9.626
  310   3HG1  VAL  45          3HG1      VAL  45  10.793  -3.770  -9.367
  311   1HG2  VAL  45          1HG2      VAL  45  11.969  -2.665 -11.485
  312   2HG2  VAL  45          2HG2      VAL  45  11.314  -3.013 -13.102
  313   3HG2  VAL  45          3HG2      VAL  45  10.352  -2.075 -11.951
  314    H    MET  46           H        MET  46   9.788  -7.105 -10.438
  315    HA   MET  46           HA       MET  46  10.799  -6.947  -7.692
  316   1HB   MET  46          1HB       MET  46   9.225  -8.594  -7.084
  317   2HB   MET  46          2HB       MET  46   8.466  -7.742  -8.416
  318   1HG   MET  46          1HG       MET  46  10.019 -10.176  -9.278
  319   2HG   MET  46          2HG       MET  46   8.423  -9.602  -9.791
  320   1HE   MET  46          1HE       MET  46   6.275  -9.543  -7.880
  321   2HE   MET  46          2HE       MET  46   6.335 -10.530  -6.390
  322   3HE   MET  46          3HE       MET  46   7.351  -9.065  -6.530
  323    NH1  ARG  47           NH1      ARG  47  18.402 -12.367 -12.392
  324    NH2  ARG  47           NH2      ARG  47  18.539 -13.430 -10.388
  325    H    ARG  47           H        ARG  47  11.476  -9.055 -10.435
  326    HA   ARG  47           HA       ARG  47  13.074 -11.148  -9.170
  327   1HB   ARG  47          1HB       ARG  47  13.496 -10.056 -12.012
  328   2HB   ARG  47          2HB       ARG  47  12.178 -11.130 -11.564
  329   1HG   ARG  47          1HG       ARG  47  13.710 -12.704 -12.327
  330   2HG   ARG  47          2HG       ARG  47  14.077 -12.725 -10.601
  331   1HD   ARG  47          1HD       ARG  47  15.817 -11.873 -12.872
  332   2HD   ARG  47          2HD       ARG  47  15.740 -10.642 -11.621
  333    HE   ARG  47           HE       ARG  47  16.242 -12.842 -10.027
  334   1HH1  ARG  47          1HH1      ARG  47  17.823 -11.838 -13.053
  335   2HH1  ARG  47          2HH1      ARG  47  19.385 -12.634 -12.514
  336   1HH2  ARG  47          1HH2      ARG  47  18.068 -13.713  -9.522
  337   2HH2  ARG  47          2HH2      ARG  47  19.512 -13.622 -10.650
  338    H    MET  48           H        MET  48  13.921  -7.983 -10.551
  339    HA   MET  48           HA       MET  48  16.790  -8.048 -10.458
  340   1HB   MET  48          1HB       MET  48  15.081  -6.087 -11.216
  341   2HB   MET  48          2HB       MET  48  16.794  -5.835 -10.933
  342   1HG   MET  48          1HG       MET  48  15.233  -5.460  -8.420
  343   2HG   MET  48          2HG       MET  48  14.681  -4.400  -9.727
  344   1HE   MET  48          1HE       MET  48  15.712  -2.127 -10.154
  345   2HE   MET  48          2HE       MET  48  17.476  -1.905 -10.347
  346   3HE   MET  48          3HE       MET  48  16.606  -3.070 -11.387
  347    H    LEU  49           H        LEU  49  14.433  -7.521  -7.888
  348    HA   LEU  49           HA       LEU  49  16.235  -6.595  -5.768
  349   1HB   LEU  49          1HB       LEU  49  13.514  -6.773  -5.964
  350   2HB   LEU  49          2HB       LEU  49  14.384  -6.472  -4.475
  351    HG   LEU  49           HG       LEU  49  13.702  -9.349  -5.280
  352   1HD1  LEU  49          1HD1      LEU  49  11.808  -7.497  -3.703
  353   2HD1  LEU  49          2HD1      LEU  49  11.573  -7.953  -5.400
  354   3HD1  LEU  49          3HD1      LEU  49  11.526  -9.203  -4.133
  355   1HD2  LEU  49          1HD2      LEU  49  13.822  -9.820  -2.869
  356   2HD2  LEU  49          2HD2      LEU  49  15.286  -8.902  -3.298
  357   3HD2  LEU  49          3HD2      LEU  49  13.949  -8.088  -2.474
  358    H    GLY  50           H        GLY  50  14.968  -9.813  -6.638
  359   1HA   GLY  50          1HA       GLY  50  17.018 -11.572  -6.680
  360   2HA   GLY  50          2HA       GLY  50  17.160 -11.151  -4.967
  361    H    GLN  51           H        GLN  51  14.466 -11.926  -7.184
  362    HA   GLN  51           HA       GLN  51  13.656 -14.300  -5.441
  363   1HB   GLN  51          1HB       GLN  51  11.157 -13.459  -5.984
  364   2HB   GLN  51          2HB       GLN  51  11.922 -11.882  -6.043
  365   1HG   GLN  51          1HG       GLN  51  12.328 -11.797  -3.760
  366   2HG   GLN  51          2HG       GLN  51  12.639 -13.512  -3.611
  367   1HE2  GLN  51          1HE2      GLN  51   8.799 -12.085  -3.031
  368   2HE2  GLN  51          2HE2      GLN  51  10.117 -11.037  -3.761
  369    H    ASN  52           H        ASN  52  11.985 -15.603  -6.654
  370    HA   ASN  52           HA       ASN  52  12.007 -15.281  -9.653
  371   1HB   ASN  52          1HB       ASN  52  12.824 -17.972  -8.420
  372   2HB   ASN  52          2HB       ASN  52  14.002 -16.774  -8.908
  373   1HD2  ASN  52          1HD2      ASN  52  12.985 -19.405 -11.642
  374   2HD2  ASN  52          2HD2      ASN  52  13.357 -19.549  -9.851
  375    HA   PRO  53           HA       PRO  53   7.807 -16.836  -8.084
  376   1HB   PRO  53          1HB       PRO  53   6.172 -15.119  -9.485
  377   2HB   PRO  53          2HB       PRO  53   7.040 -14.671  -8.009
  378   1HG   PRO  53          1HG       PRO  53   7.789 -14.033 -10.898
  379   2HG   PRO  53          2HG       PRO  53   7.856 -12.956  -9.484
  380   1HD   PRO  53          1HD       PRO  53  10.009 -13.789  -8.865
  381   2HD   PRO  53          2HD       PRO  53  10.074 -14.412 -10.540
  382    H    THR  54           H        THR  54   5.770 -17.382  -9.561
  383    HA   THR  54           HA       THR  54   6.739 -18.916 -12.026
  384    HB   THR  54           HB       THR  54   6.012 -20.444 -10.292
  385    HG1  THR  54           HG1      THR  54   4.902 -21.621 -11.600
  386   1HG2  THR  54          1HG2      THR  54   3.690 -20.611  -9.457
  387   2HG2  THR  54          2HG2      THR  54   4.379 -19.035  -9.003
  388   3HG2  THR  54          3HG2      THR  54   3.217 -19.145 -10.349
  389    H    LYS  55           H        LYS  55   5.383 -18.975 -13.845
  390    HA   LYS  55           HA       LYS  55   4.441 -16.374 -14.717
  391   1HB   LYS  55          1HB       LYS  55   4.526 -17.345 -16.756
  392   2HB   LYS  55          2HB       LYS  55   4.973 -18.849 -15.976
  393   1HG   LYS  55          1HG       LYS  55   2.059 -18.561 -15.908
  394   2HG   LYS  55          2HG       LYS  55   2.626 -18.282 -17.545
  395   1HD   LYS  55          1HD       LYS  55   3.445 -20.522 -17.790
  396   2HD   LYS  55          2HD       LYS  55   1.995 -20.726 -16.818
  397   1HE   LYS  55          1HE       LYS  55   4.794 -20.525 -15.569
  398   2HE   LYS  55          2HE       LYS  55   3.309 -20.973 -14.733
  399   1HZ   LYS  55          1HZ       LYS  55   4.103 -22.607 -17.052
  400   2HZ   LYS  55          2HZ       LYS  55   3.367 -23.070 -15.647
  401   3HZ   LYS  55          3HZ       LYS  55   4.991 -22.763 -15.668
  402    H    GLU  56           H        GLU  56   2.799 -19.187 -13.371
  403    HA   GLU  56           HA       GLU  56   0.026 -18.266 -13.850
  404   1HB   GLU  56          1HB       GLU  56   0.939 -20.707 -13.494
  405   2HB   GLU  56          2HB       GLU  56  -0.688 -20.272 -13.005
  406   1HG   GLU  56          1HG       GLU  56   0.213 -19.950 -10.595
  407   2HG   GLU  56          2HG       GLU  56   1.757 -20.573 -11.148
  408    H    GLU  57           H        GLU  57   2.019 -18.614 -10.897
  409    HA   GLU  57           HA       GLU  57   0.287 -17.589  -8.902
  410   1HB   GLU  57          1HB       GLU  57   3.311 -17.481  -9.107
  411   2HB   GLU  57          2HB       GLU  57   2.296 -18.531  -8.142
  412   1HG   GLU  57          1HG       GLU  57   3.681 -16.457  -7.068
  413   2HG   GLU  57          2HG       GLU  57   2.249 -15.534  -7.505
  414    H    LEU  58           H        LEU  58   2.353 -15.754 -11.134
  415    HA   LEU  58           HA       LEU  58   2.091 -13.108  -9.969
  416   1HB   LEU  58          1HB       LEU  58   3.169 -14.292 -12.440
  417   2HB   LEU  58          2HB       LEU  58   2.372 -12.772 -12.795
  418    HG   LEU  58           HG       LEU  58   4.299 -12.828 -10.433
  419   1HD1  LEU  58          1HD1      LEU  58   6.272 -12.403 -11.951
  420   2HD1  LEU  58          2HD1      LEU  58   5.636 -14.040 -12.168
  421   3HD1  LEU  58          3HD1      LEU  58   5.270 -12.783 -13.375
  422   1HD2  LEU  58          1HD2      LEU  58   3.717 -10.716 -12.611
  423   2HD2  LEU  58          2HD2      LEU  58   3.037 -10.738 -10.965
  424   3HD2  LEU  58          3HD2      LEU  58   4.779 -10.499 -11.197
  425    H    ASP  59           H        ASP  59   0.356 -14.587 -12.730
  426    HA   ASP  59           HA       ASP  59  -1.581 -12.588 -13.367
  427   1HB   ASP  59          1HB       ASP  59  -1.311 -14.686 -14.688
  428   2HB   ASP  59          2HB       ASP  59  -2.040 -15.623 -13.405
  429    H    ALA  60           H        ALA  60  -1.454 -14.793 -10.638
  430    HA   ALA  60           HA       ALA  60  -4.150 -14.410  -9.559
  431   1HB   ALA  60          1HB       ALA  60  -3.231 -15.369  -7.453
  432   2HB   ALA  60          2HB       ALA  60  -2.720 -16.307  -8.869
  433   3HB   ALA  60          3HB       ALA  60  -1.568 -15.208  -8.067
  434    H    ILE  61           H        ILE  61  -1.012 -12.942  -8.658
  435    HA   ILE  61           HA       ILE  61  -1.691 -11.122  -6.616
  436    HB   ILE  61           HB       ILE  61   0.367 -10.819  -8.833
  437   1HG1  ILE  61          1HG1      ILE  61   0.665 -11.356  -5.803
  438   2HG1  ILE  61          2HG1      ILE  61   1.942 -11.394  -7.012
  439   1HG2  ILE  61          1HG2      ILE  61   1.427  -8.941  -7.545
  440   2HG2  ILE  61          2HG2      ILE  61  -0.163  -8.475  -8.147
  441   3HG2  ILE  61          3HG2      ILE  61   0.037  -8.904  -6.432
  442   1HD1  ILE  61          1HD1      ILE  61   1.035 -13.430  -8.073
  443   2HD1  ILE  61          2HD1      ILE  61   1.257 -13.687  -6.329
  444   3HD1  ILE  61          3HD1      ILE  61  -0.375 -13.401  -6.978
  445    H    ILE  62           H        ILE  62  -1.905 -10.530 -10.140
  446    HA   ILE  62           HA       ILE  62  -3.021  -7.797  -9.925
  447    HB   ILE  62           HB       ILE  62  -2.739  -9.724 -12.271
  448   1HG1  ILE  62          1HG1      ILE  62  -0.605  -8.764 -11.801
  449   2HG1  ILE  62          2HG1      ILE  62  -1.272  -7.218 -11.322
  450   1HG2  ILE  62          1HG2      ILE  62  -3.563  -7.933 -13.824
  451   2HG2  ILE  62          2HG2      ILE  62  -4.844  -8.419 -12.717
  452   3HG2  ILE  62          3HG2      ILE  62  -3.975  -6.893 -12.438
  453   1HD1  ILE  62          1HD1      ILE  62  -1.768  -6.568 -13.662
  454   2HD1  ILE  62          2HD1      ILE  62  -0.069  -7.056 -13.495
  455   3HD1  ILE  62          3HD1      ILE  62  -1.236  -8.170 -14.245
  456    H    GLU  63           H        GLU  63  -4.326 -11.064 -10.309
  457    HA   GLU  63           HA       GLU  63  -7.111 -10.552 -10.865
  458   1HB   GLU  63          1HB       GLU  63  -5.576 -12.850  -9.805
  459   2HB   GLU  63          2HB       GLU  63  -7.166 -12.745  -9.076
  460   1HG   GLU  63          1HG       GLU  63  -7.646 -12.332 -11.874
  461   2HG   GLU  63          2HG       GLU  63  -6.389 -13.556 -11.822
  462    H    GLU  64           H        GLU  64  -5.240 -10.288  -7.893
  463    HA   GLU  64           HA       GLU  64  -7.421 -10.040  -5.935
  464   1HB   GLU  64          1HB       GLU  64  -5.680 -10.233  -4.568
  465   2HB   GLU  64          2HB       GLU  64  -4.542  -9.965  -5.873
  466   1HG   GLU  64          1HG       GLU  64  -5.881  -7.589  -4.451
  467   2HG   GLU  64          2HG       GLU  64  -4.428  -7.573  -5.436
  468    H    VAL  65           H        VAL  65  -5.297  -7.539  -7.378
  469    HA   VAL  65           HA       VAL  65  -7.281  -5.329  -6.902
  470    HB   VAL  65           HB       VAL  65  -4.659  -5.141  -6.857
  471   1HG1  VAL  65          1HG1      VAL  65  -6.242  -2.876  -8.231
  472   2HG1  VAL  65          2HG1      VAL  65  -6.369  -3.257  -6.504
  473   3HG1  VAL  65          3HG1      VAL  65  -4.812  -2.721  -7.181
  474   1HG2  VAL  65          1HG2      VAL  65  -3.528  -4.394  -8.892
  475   2HG2  VAL  65          2HG2      VAL  65  -4.326  -5.933  -9.298
  476   3HG2  VAL  65          3HG2      VAL  65  -5.041  -4.406  -9.832
  477    H    ASP  66           H        ASP  66  -6.704  -4.017  -9.466
  478    HA   ASP  66           HA       ASP  66  -7.595  -3.818 -11.684
  479   1HB   ASP  66          1HB       ASP  66  -6.318  -6.247 -11.752
  480   2HB   ASP  66          2HB       ASP  66  -7.952  -6.786 -12.062
  481    H    GLU  67           H        GLU  67  -9.359  -2.942 -10.428
  482    HA   GLU  67           HA       GLU  67 -11.773  -4.591  -9.795
  483   1HB   GLU  67          1HB       GLU  67 -11.766  -1.544  -9.799
  484   2HB   GLU  67          2HB       GLU  67 -10.880  -2.426  -8.570
  485   1HG   GLU  67          1HG       GLU  67 -13.852  -3.033  -9.078
  486   2HG   GLU  67          2HG       GLU  67 -13.377  -1.642  -8.118
  487    H    ASP  68           H        ASP  68 -10.638  -2.507 -12.382
  488    HA   ASP  68           HA       ASP  68 -13.276  -2.298 -13.789
  489   1HB   ASP  68          1HB       ASP  68 -11.951  -0.379 -14.152
  490   2HB   ASP  68          2HB       ASP  68 -11.942  -1.236 -15.677
  491    H    GLY  69           H        GLY  69 -10.387  -4.297 -13.912
  492   1HA   GLY  69          1HA       GLY  69 -10.194  -6.594 -14.777
  493   2HA   GLY  69          2HA       GLY  69 -11.835  -6.452 -15.421
  494    H    SER  70           H        SER  70  -9.112  -4.246 -15.955
  495    HA   SER  70           HA       SER  70  -9.405  -4.303 -18.944
  496   1HB   SER  70          1HB       SER  70  -7.358  -2.741 -18.837
  497   2HB   SER  70          2HB       SER  70  -8.859  -2.161 -18.113
  498    HG   SER  70           HG       SER  70  -6.722  -3.421 -16.729
  499    H    GLY  71           H        GLY  71  -7.155  -5.489 -16.459
  500   1HA   GLY  71          1HA       GLY  71  -6.065  -7.788 -16.804
  501   2HA   GLY  71          2HA       GLY  71  -5.877  -7.371 -18.513
  502    H    THR  72           H        THR  72  -5.091  -4.618 -17.997
  503    HA   THR  72           HA       THR  72  -2.182  -5.090 -17.196
  504    HB   THR  72           HB       THR  72  -1.819  -2.835 -18.480
  505    HG1  THR  72           HG1      THR  72  -4.212  -3.742 -19.682
  506   1HG2  THR  72          1HG2      THR  72  -1.507  -3.941 -20.656
  507   2HG2  THR  72          2HG2      THR  72  -0.934  -5.029 -19.373
  508   3HG2  THR  72          3HG2      THR  72  -2.500  -5.333 -20.169
  509    H    ILE  73           H        ILE  73  -1.279  -2.646 -16.668
  510    HA   ILE  73           HA       ILE  73  -3.028  -1.388 -14.497
  511    HB   ILE  73           HB       ILE  73  -0.164  -2.381 -14.106
  512   1HG1  ILE  73          1HG1      ILE  73  -2.866  -3.133 -12.865
  513   2HG1  ILE  73          2HG1      ILE  73  -1.658  -4.180 -13.579
  514   1HG2  ILE  73          1HG2      ILE  73  -0.105  -1.231 -11.897
  515   2HG2  ILE  73          2HG2      ILE  73  -0.360  -0.037 -13.177
  516   3HG2  ILE  73          3HG2      ILE  73  -1.726  -0.546 -12.156
  517   1HD1  ILE  73          1HD1      ILE  73  -1.346  -2.801 -10.849
  518   2HD1  ILE  73          2HD1      ILE  73  -1.643  -4.523 -11.168
  519   3HD1  ILE  73          3HD1      ILE  73  -0.090  -3.792 -11.641
  520    H    ASP  74           H        ASP  74  -3.428   0.232 -15.993
  521    HA   ASP  74           HA       ASP  74  -1.414   1.758 -17.473
  522   1HB   ASP  74          1HB       ASP  74  -4.009   3.109 -16.663
  523   2HB   ASP  74          2HB       ASP  74  -3.098   3.237 -18.149
  524    H    PHE  75           H        PHE  75  -1.405   4.287 -17.029
  525    HA   PHE  75           HA       PHE  75   0.278   4.632 -14.606
  526   1HB   PHE  75          1HB       PHE  75   0.768   5.824 -16.758
  527   2HB   PHE  75          2HB       PHE  75  -0.719   6.726 -16.631
  528    HD1  PHE  75           HD1      PHE  75   0.449   8.905 -16.654
  529    HD2  PHE  75           HD2      PHE  75   1.339   6.034 -13.574
  530    HE1  PHE  75           HE1      PHE  75   1.576  10.651 -15.337
  531    HE2  PHE  75           HE2      PHE  75   2.456   7.798 -12.269
  532    HZ   PHE  75           HZ       PHE  75   2.583  10.102 -13.147
  533    H    GLU  76           H        GLU  76  -2.974   5.563 -15.648
  534    HA   GLU  76           HA       GLU  76  -3.653   7.315 -13.380
  535   1HB   GLU  76          1HB       GLU  76  -5.942   5.975 -14.740
  536   2HB   GLU  76          2HB       GLU  76  -5.677   7.656 -14.331
  537   1HG   GLU  76          1HG       GLU  76  -3.889   6.674 -16.537
  538   2HG   GLU  76          2HG       GLU  76  -5.598   6.558 -16.896
  539    H    GLU  77           H        GLU  77  -3.935   3.871 -14.027
  540    HA   GLU  77           HA       GLU  77  -5.613   3.215 -11.641
  541   1HB   GLU  77          1HB       GLU  77  -6.016   1.666 -13.288
  542   2HB   GLU  77          2HB       GLU  77  -4.366   1.635 -13.865
  543   1HG   GLU  77          1HG       GLU  77  -5.225   0.344 -11.199
  544   2HG   GLU  77          2HG       GLU  77  -3.651   0.186 -11.970
  545    H    PHE  78           H        PHE  78  -2.203   3.373 -12.422
  546    HA   PHE  78           HA       PHE  78  -1.112   1.862 -10.175
  547   1HB   PHE  78          1HB       PHE  78   0.183   2.553 -12.254
  548   2HB   PHE  78          2HB       PHE  78   0.222   4.202 -11.686
  549    HD1  PHE  78           HD1      PHE  78   1.717   0.857 -11.405
  550    HD2  PHE  78           HD2      PHE  78   1.548   4.715  -9.509
  551    HE1  PHE  78           HE1      PHE  78   3.815   0.374 -10.209
  552    HE2  PHE  78           HE2      PHE  78   3.636   4.207  -8.309
  553    HZ   PHE  78           HZ       PHE  78   4.775   2.043  -8.659
  554    H    LEU  79           H        LEU  79  -1.943   5.282 -10.620
  555    HA   LEU  79           HA       LEU  79  -0.929   6.271  -8.034
  556   1HB   LEU  79          1HB       LEU  79  -2.789   7.422 -10.161
  557   2HB   LEU  79          2HB       LEU  79  -2.697   8.211  -8.602
  558    HG   LEU  79           HG       LEU  79  -0.031   7.657  -9.915
  559   1HD1  LEU  79          1HD1      LEU  79  -0.219   9.589 -11.484
  560   2HD1  LEU  79          2HD1      LEU  79  -1.392   8.326 -11.904
  561   3HD1  LEU  79          3HD1      LEU  79  -1.938   9.798 -11.064
  562   1HD2  LEU  79          1HD2      LEU  79  -1.193  10.152  -8.502
  563   2HD2  LEU  79          2HD2      LEU  79  -0.111   8.941  -7.771
  564   3HD2  LEU  79          3HD2      LEU  79   0.483   9.974  -9.079
  565    H    VAL  80           H        VAL  80  -3.980   4.922  -9.152
  566    HA   VAL  80           HA       VAL  80  -5.571   5.546  -6.731
  567    HB   VAL  80           HB       VAL  80  -6.250   4.747  -9.276
  568   1HG1  VAL  80          1HG1      VAL  80  -7.482   2.573  -9.133
  569   2HG1  VAL  80          2HG1      VAL  80  -5.747   2.327  -8.897
  570   3HG1  VAL  80          3HG1      VAL  80  -6.839   2.295  -7.494
  571   1HG2  VAL  80          1HG2      VAL  80  -8.103   4.518  -6.814
  572   2HG2  VAL  80          2HG2      VAL  80  -7.767   6.019  -7.708
  573   3HG2  VAL  80          3HG2      VAL  80  -8.618   4.690  -8.510
  574    H    MET  81           H        MET  81  -3.495   2.919  -7.814
  575    HA   MET  81           HA       MET  81  -4.154   0.895  -5.795
  576   1HB   MET  81          1HB       MET  81  -2.771   0.589  -7.998
  577   2HB   MET  81          2HB       MET  81  -1.393   1.172  -7.083
  578   1HG   MET  81          1HG       MET  81  -1.988  -0.756  -5.341
  579   2HG   MET  81          2HG       MET  81  -2.959  -1.424  -6.664
  580   1HE   MET  81          1HE       MET  81  -1.679  -3.609  -6.956
  581   2HE   MET  81          2HE       MET  81   0.093  -3.755  -7.154
  582   3HE   MET  81          3HE       MET  81  -0.588  -3.241  -5.584
  583    H    MET  82           H        MET  82  -1.922   3.634  -5.880
  584    HA   MET  82           HA       MET  82  -0.547   2.929  -3.297
  585   1HB   MET  82          1HB       MET  82   1.107   4.249  -4.004
  586   2HB   MET  82          2HB       MET  82   0.258   4.371  -5.532
  587   1HG   MET  82          1HG       MET  82   0.351   6.618  -5.177
  588   2HG   MET  82          2HG       MET  82  -1.003   6.413  -4.060
  589   1HE   MET  82          1HE       MET  82   2.803   5.864  -4.395
  590   2HE   MET  82          2HE       MET  82   2.751   4.900  -2.890
  591   3HE   MET  82          3HE       MET  82   3.504   6.521  -2.882
  592    H    VAL  83           H        VAL  83  -3.089   5.065  -4.469
  593    HA   VAL  83           HA       VAL  83  -3.220   6.868  -2.121
  594    HB   VAL  83           HB       VAL  83  -4.554   6.707  -4.706
  595   1HG1  VAL  83          1HG1      VAL  83  -6.797   7.625  -4.094
  596   2HG1  VAL  83          2HG1      VAL  83  -6.606   5.981  -3.470
  597   3HG1  VAL  83          3HG1      VAL  83  -6.457   7.365  -2.364
  598   1HG2  VAL  83          1HG2      VAL  83  -4.396   9.028  -2.669
  599   2HG2  VAL  83          2HG2      VAL  83  -3.223   8.703  -3.966
  600   3HG2  VAL  83          3HG2      VAL  83  -4.880   9.166  -4.379
  601    NH1  ARG  84           NH1      ARG  84 -10.018   0.154  -1.263
  602    NH2  ARG  84           NH2      ARG  84 -11.394  -0.909  -2.725
  603    H    ARG  84           H        ARG  84  -4.799   3.882  -3.155
  604    HA   ARG  84           HA       ARG  84  -7.054   3.718  -1.314
  605   1HB   ARG  84          1HB       ARG  84  -5.536   1.774  -3.021
  606   2HB   ARG  84          2HB       ARG  84  -6.241   1.060  -1.578
  607   1HG   ARG  84          1HG       ARG  84  -7.747   2.559  -3.793
  608   2HG   ARG  84          2HG       ARG  84  -8.502   2.177  -2.244
  609   1HD   ARG  84          1HD       ARG  84  -7.605   0.273  -4.451
  610   2HD   ARG  84          2HD       ARG  84  -7.587  -0.335  -2.795
  611    HE   ARG  84           HE       ARG  84 -10.030   0.380  -4.408
  612   1HH1  ARG  84          1HH1      ARG  84 -11.588  -1.174  -3.697
  613   2HH1  ARG  84          2HH1      ARG  84 -11.964  -1.133  -1.901
  614   1HH2  ARG  84          1HH2      ARG  84  -9.139   0.661  -1.113
  615   2HH2  ARG  84          2HH2      ARG  84 -10.708  -0.105  -0.549
  616    H    GLN  85           H        GLN  85  -3.906   2.023  -1.036
  617    HA   GLN  85           HA       GLN  85  -4.246   1.143   1.741
  618   1HB   GLN  85          1HB       GLN  85  -2.125   0.215   1.604
  619   2HB   GLN  85          2HB       GLN  85  -2.607   0.257  -0.082
  620   1HG   GLN  85          1HG       GLN  85  -1.118   2.712   0.787
  621   2HG   GLN  85          2HG       GLN  85  -0.975   1.781  -0.688
  622   1HE2  GLN  85          1HE2      GLN  85   1.259   0.507   2.603
  623   2HE2  GLN  85          2HE2      GLN  85  -0.301   1.445   2.840
  624    H    MET  86           H        MET  86  -2.956   4.051   0.238
  625    HA   MET  86           HA       MET  86  -1.384   5.278   2.270
  626   1HB   MET  86          1HB       MET  86  -2.692   6.214  -0.146
  627   2HB   MET  86          2HB       MET  86  -3.043   7.370   1.125
  628   1HG   MET  86          1HG       MET  86  -0.239   6.855   1.424
  629   2HG   MET  86          2HG       MET  86  -0.513   6.932  -0.325
  630   1HE   MET  86          1HE       MET  86  -3.354   8.805  -0.104
  631   2HE   MET  86          2HE       MET  86  -2.656  10.412  -0.460
  632   3HE   MET  86          3HE       MET  86  -2.173   8.995  -1.437
  633    H    LYS  87           H        LYS  87  -4.901   5.093   1.971
  634    HA   LYS  87           HA       LYS  87  -5.789   6.878   4.069
  635   1HB   LYS  87          1HB       LYS  87  -7.760   5.165   4.360
  636   2HB   LYS  87          2HB       LYS  87  -7.008   4.255   3.058
  637   1HG   LYS  87          1HG       LYS  87  -7.192   7.019   2.174
  638   2HG   LYS  87          2HG       LYS  87  -8.753   6.575   2.845
  639   1HD   LYS  87          1HD       LYS  87  -7.296   5.478   0.412
  640   2HD   LYS  87          2HD       LYS  87  -8.293   4.347   1.320
  641   1HE   LYS  87          1HE       LYS  87 -10.085   6.481   1.084
  642   2HE   LYS  87          2HE       LYS  87  -9.164   6.661  -0.415
  643   1HZ   LYS  87          1HZ       LYS  87 -11.162   5.110  -0.435
  644   2HZ   LYS  87          2HZ       LYS  87 -10.238   4.018   0.391
  645   3HZ   LYS  87          3HZ       LYS  87  -9.775   4.522  -1.112
  646    H    GLU  88           H        GLU  88  -6.377   6.474   6.230
  647    HA   GLU  88           HA       GLU  88  -4.907   4.183   7.632
  648   1HB   GLU  88          1HB       GLU  88  -4.744   6.151   9.542
  649   2HB   GLU  88          2HB       GLU  88  -4.605   7.137   8.100
  650   1HG   GLU  88          1HG       GLU  88  -2.355   6.677   8.395
  651   2HG   GLU  88          2HG       GLU  88  -2.742   5.274   7.413
  652    H    ASP  89           H        ASP  89  -7.461   3.927   6.880
  653    HA   ASP  89           HA       ASP  89  -9.380   4.702   9.077
  654   1HB   ASP  89          1HB       ASP  89 -10.084   2.700   6.887
  655   2HB   ASP  89          2HB       ASP  89  -9.934   4.397   6.492
  656    H    ALA  90           H        ALA  90  -7.679   1.848   7.839
  657    HA   ALA  90           HA       ALA  90  -8.790  -0.028   9.908
  658   1HB   ALA  90          1HB       ALA  90  -7.276  -1.737   8.872
  659   2HB   ALA  90          2HB       ALA  90  -8.235  -0.912   7.628
  660   3HB   ALA  90          3HB       ALA  90  -6.519  -0.491   7.849
   
  Start of MODEL          19
 Raw file had  660 H/Q atoms
  Start of MODEL   19
    1   1H    ALA   1          1H        ALA   1 -20.453  -1.749 -14.147
    2   2H    ALA   1          2H        ALA   1 -20.794  -0.158 -13.723
    3   3H    ALA   1          3H        ALA   1 -20.671  -0.588 -15.344
    4    HA   ALA   1           HA       ALA   1 -18.580  -0.262 -13.313
    5   1HB   ALA   1          1HB       ALA   1 -17.049  -1.710 -14.371
    6   2HB   ALA   1          2HB       ALA   1 -17.899  -1.688 -15.928
    7   3HB   ALA   1          3HB       ALA   1 -18.553  -2.641 -14.571
    8    H    SER   2           H        SER   2 -18.781   1.933 -13.612
    9    HA   SER   2           HA       SER   2 -18.837   3.275 -16.274
   10   1HB   SER   2          1HB       SER   2 -18.224   4.726 -13.665
   11   2HB   SER   2          2HB       SER   2 -19.053   5.320 -15.106
   12    HG   SER   2           HG       SER   2 -20.832   4.382 -14.507
   13    H    MET   3           H        MET   3 -16.431   2.435 -13.845
   14    HA   MET   3           HA       MET   3 -14.033   2.548 -13.785
   15   1HB   MET   3          1HB       MET   3 -12.988   1.605 -15.606
   16   2HB   MET   3          2HB       MET   3 -14.646   1.131 -15.935
   17   1HG   MET   3          1HG       MET   3 -14.214   3.712 -17.232
   18   2HG   MET   3          2HG       MET   3 -12.832   2.673 -17.601
   19   1HE   MET   3          1HE       MET   3 -15.458   3.934 -19.354
   20   2HE   MET   3          2HE       MET   3 -15.830   2.623 -20.513
   21   3HE   MET   3          3HE       MET   3 -14.140   3.164 -20.293
   22    H    THR   4           H        THR   4 -15.585   5.009 -13.816
   23    HA   THR   4           HA       THR   4 -13.651   6.946 -15.162
   24    HB   THR   4           HB       THR   4 -15.957   7.011 -16.071
   25    HG1  THR   4           HG1      THR   4 -15.277   9.442 -14.857
   26   1HG2  THR   4          1HG2      THR   4 -17.860   7.774 -15.010
   27   2HG2  THR   4          2HG2      THR   4 -16.973   8.801 -13.862
   28   3HG2  THR   4          3HG2      THR   4 -17.107   7.047 -13.574
   29    H    ASP   5           H        ASP   5 -15.313   6.012 -12.224
   30    HA   ASP   5           HA       ASP   5 -14.441   8.396 -10.624
   31   1HB   ASP   5          1HB       ASP   5 -16.670   7.275 -10.222
   32   2HB   ASP   5          2HB       ASP   5 -15.701   7.557  -8.794
   33    H    GLN   6           H        GLN   6 -13.514   5.045 -11.117
   34    HA   GLN   6           HA       GLN   6 -11.258   5.100  -9.096
   35   1HB   GLN   6          1HB       GLN   6 -12.738   3.025  -9.678
   36   2HB   GLN   6          2HB       GLN   6 -11.803   2.907 -11.157
   37   1HG   GLN   6          1HG       GLN   6  -9.771   3.086  -9.222
   38   2HG   GLN   6          2HG       GLN   6 -11.016   2.223  -8.347
   39   1HE2  GLN   6          1HE2      GLN   6  -8.968   0.316 -11.378
   40   2HE2  GLN   6          2HE2      GLN   6  -8.821   2.124 -11.100
   41    H    GLN   7           H        GLN   7 -10.574   7.116 -10.364
   42    HA   GLN   7           HA       GLN   7  -8.005   6.827 -11.509
   43   1HB   GLN   7          1HB       GLN   7  -8.432   7.281 -14.023
   44   2HB   GLN   7          2HB       GLN   7  -8.632   5.636 -13.436
   45   1HG   GLN   7          1HG       GLN   7 -11.023   5.689 -13.585
   46   2HG   GLN   7          2HG       GLN   7 -11.095   7.441 -13.680
   47   1HE2  GLN   7          1HE2      GLN   7 -11.224   7.140 -17.252
   48   2HE2  GLN   7          2HE2      GLN   7 -11.862   7.878 -15.699
   49    H    ALA   8           H        ALA   8 -11.109   8.500 -11.826
   50    HA   ALA   8           HA       ALA   8  -9.982  11.182 -12.455
   51   1HB   ALA   8          1HB       ALA   8 -12.321  11.986 -12.178
   52   2HB   ALA   8          2HB       ALA   8 -12.250  10.552 -13.220
   53   3HB   ALA   8          3HB       ALA   8 -12.824  10.403 -11.539
   54    H    GLU   9           H        GLU   9 -11.007   9.429  -9.571
   55    HA   GLU   9           HA       GLU   9 -10.988  11.697  -7.661
   56   1HB   GLU   9          1HB       GLU   9 -11.080   8.661  -7.306
   57   2HB   GLU   9          2HB       GLU   9 -10.701   9.683  -5.927
   58   1HG   GLU   9          1HG       GLU   9 -13.133  10.636  -7.405
   59   2HG   GLU   9          2HG       GLU   9 -13.293   9.003  -6.768
   60    H    ALA  10           H        ALA  10  -8.632   9.329  -8.791
   61    HA   ALA  10           HA       ALA  10  -6.555   9.957  -6.728
   62   1HB   ALA  10          1HB       ALA  10  -5.137   8.346  -7.990
   63   2HB   ALA  10          2HB       ALA  10  -6.738   7.664  -7.648
   64   3HB   ALA  10          3HB       ALA  10  -6.351   8.244  -9.288
   65    NH1  ARG  11           NH1      ARG  11  -6.353  14.290 -17.183
   66    NH2  ARG  11           NH2      ARG  11  -4.610  15.659 -16.684
   67    H    ARG  11           H        ARG  11  -7.360  10.923 -10.003
   68    HA   ARG  11           HA       ARG  11  -4.750  12.199 -10.716
   69   1HB   ARG  11          1HB       ARG  11  -5.822  11.611 -12.682
   70   2HB   ARG  11          2HB       ARG  11  -7.431  11.847 -12.015
   71   1HG   ARG  11          1HG       ARG  11  -7.537  14.120 -12.537
   72   2HG   ARG  11          2HG       ARG  11  -5.792  14.367 -12.435
   73   1HD   ARG  11          1HD       ARG  11  -5.803  12.658 -14.574
   74   2HD   ARG  11          2HD       ARG  11  -7.434  13.302 -14.776
   75    HE   ARG  11           HE       ARG  11  -5.633  15.567 -14.384
   76   1HH1  ARG  11          1HH1      ARG  11  -4.062  16.136 -15.959
   77   2HH1  ARG  11          2HH1      ARG  11  -4.469  15.716 -17.698
   78   1HH2  ARG  11          1HH2      ARG  11  -7.075  13.647 -16.840
   79   2HH2  ARG  11          2HH2      ARG  11  -6.149  14.520 -18.162
   80    H    ALA  12           H        ALA  12  -7.868  13.204  -9.394
   81    HA   ALA  12           HA       ALA  12  -7.450  16.140  -9.615
   82   1HB   ALA  12          1HB       ALA  12  -9.506  16.331  -8.229
   83   2HB   ALA  12          2HB       ALA  12  -9.735  15.188  -9.568
   84   3HB   ALA  12          3HB       ALA  12  -9.492  14.579  -7.912
   85    H    PHE  13           H        PHE  13  -6.835  13.641  -7.209
   86    HA   PHE  13           HA       PHE  13  -6.246  15.460  -4.930
   87   1HB   PHE  13          1HB       PHE  13  -5.660  12.467  -5.298
   88   2HB   PHE  13          2HB       PHE  13  -7.116  13.139  -4.613
   89    HD1  PHE  13           HD1      PHE  13  -7.211  13.226  -2.226
   90    HD2  PHE  13           HD2      PHE  13  -3.342  13.391  -4.106
   91    HE1  PHE  13           HE1      PHE  13  -6.122  13.154  -0.019
   92    HE2  PHE  13           HE2      PHE  13  -2.274  13.316  -1.892
   93    HZ   PHE  13           HZ       PHE  13  -3.656  13.201   0.153
   94    H    LEU  14           H        LEU  14  -4.334  13.447  -7.176
   95    HA   LEU  14           HA       LEU  14  -1.680  14.544  -6.194
   96   1HB   LEU  14          1HB       LEU  14  -0.599  12.881  -7.521
   97   2HB   LEU  14          2HB       LEU  14  -1.981  12.651  -8.570
   98    HG   LEU  14           HG       LEU  14  -3.093  11.820  -6.169
   99   1HD1  LEU  14          1HD1      LEU  14  -0.153  10.905  -6.007
  100   2HD1  LEU  14          2HD1      LEU  14  -0.867  12.156  -4.973
  101   3HD1  LEU  14          3HD1      LEU  14  -1.470  10.482  -4.884
  102   1HD2  LEU  14          1HD2      LEU  14  -2.845   9.513  -6.988
  103   2HD2  LEU  14          2HD2      LEU  14  -3.038  10.561  -8.414
  104   3HD2  LEU  14          3HD2      LEU  14  -1.433   9.953  -7.982
  105    H    SER  15           H        SER  15  -1.161  16.460  -6.898
  106    HA   SER  15           HA       SER  15  -2.193  17.864  -9.249
  107   1HB   SER  15          1HB       SER  15  -1.027  18.787  -7.061
  108   2HB   SER  15          2HB       SER  15  -0.907  19.671  -8.585
  109    HG   SER  15           HG       SER  15   1.106  19.541  -7.890
  110    H    GLU  16           H        GLU  16  -0.231  18.900 -10.680
  111    HA   GLU  16           HA       GLU  16   0.572  16.751 -12.550
  112   1HB   GLU  16          1HB       GLU  16  -0.148  19.027 -13.288
  113   2HB   GLU  16          2HB       GLU  16   1.303  19.731 -12.603
  114   1HG   GLU  16          1HG       GLU  16   2.624  18.092 -14.224
  115   2HG   GLU  16          2HG       GLU  16   1.080  17.846 -15.021
  116    H    GLU  17           H        GLU  17   2.138  18.677 -10.067
  117    HA   GLU  17           HA       GLU  17   4.948  17.957 -10.805
  118   1HB   GLU  17          1HB       GLU  17   4.147  20.117  -9.579
  119   2HB   GLU  17          2HB       GLU  17   4.138  19.154  -8.114
  120   1HG   GLU  17          1HG       GLU  17   6.462  19.107  -7.957
  121   2HG   GLU  17          2HG       GLU  17   6.285  20.604  -8.855
  122    H    MET  18           H        MET  18   2.500  16.910  -8.476
  123    HA   MET  18           HA       MET  18   4.176  14.987  -6.943
  124   1HB   MET  18          1HB       MET  18   2.101  14.142  -5.963
  125   2HB   MET  18          2HB       MET  18   1.125  14.890  -7.214
  126   1HG   MET  18          1HG       MET  18   2.835  16.799  -5.592
  127   2HG   MET  18          2HG       MET  18   1.201  17.012  -6.243
  128   1HE   MET  18          1HE       MET  18   1.310  18.162  -3.515
  129   2HE   MET  18          2HE       MET  18   1.343  17.082  -2.089
  130   3HE   MET  18          3HE       MET  18   2.806  17.266  -3.102
  131    H    ILE  19           H        ILE  19   2.137  14.911  -9.823
  132    HA   ILE  19           HA       ILE  19   1.955  11.986 -10.151
  133    HB   ILE  19           HB       ILE  19   1.404  14.322 -12.015
  134   1HG1  ILE  19          1HG1      ILE  19  -0.221  13.335 -10.109
  135   2HG1  ILE  19          2HG1      ILE  19  -0.543  12.075 -11.281
  136   1HG2  ILE  19          1HG2      ILE  19   0.670  12.755 -13.830
  137   2HG2  ILE  19          2HG2      ILE  19   2.393  12.558 -13.517
  138   3HG2  ILE  19          3HG2      ILE  19   1.243  11.357 -12.887
  139   1HD1  ILE  19          1HD1      ILE  19  -1.417  13.683 -12.953
  140   2HD1  ILE  19          2HD1      ILE  19  -2.251  13.883 -11.398
  141   3HD1  ILE  19          3HD1      ILE  19  -1.003  15.054 -11.887
  142    H    ALA  20           H        ALA  20   4.206  14.511 -11.170
  143    HA   ALA  20           HA       ALA  20   5.780  13.188 -13.165
  144   1HB   ALA  20          1HB       ALA  20   7.606  14.779 -12.578
  145   2HB   ALA  20          2HB       ALA  20   6.031  15.594 -12.643
  146   3HB   ALA  20          3HB       ALA  20   6.776  15.222 -11.068
  147    H    GLU  21           H        GLU  21   6.027  13.042  -9.623
  148    HA   GLU  21           HA       GLU  21   8.592  11.723  -9.329
  149   1HB   GLU  21          1HB       GLU  21   6.180  11.470  -7.454
  150   2HB   GLU  21          2HB       GLU  21   7.833  11.043  -7.057
  151   1HG   GLU  21          1HG       GLU  21   6.843  13.375  -6.277
  152   2HG   GLU  21          2HG       GLU  21   7.123  13.905  -7.927
  153    H    PHE  22           H        PHE  22   5.327  10.481  -9.879
  154    HA   PHE  22           HA       PHE  22   6.015   7.598  -9.602
  155   1HB   PHE  22          1HB       PHE  22   3.489   8.871 -10.825
  156   2HB   PHE  22          2HB       PHE  22   3.704   7.176 -10.479
  157    HD1  PHE  22           HD1      PHE  22   2.971  10.455  -8.959
  158    HD2  PHE  22           HD2      PHE  22   3.904   6.346  -8.079
  159    HE1  PHE  22           HE1      PHE  22   2.158  10.752  -6.658
  160    HE2  PHE  22           HE2      PHE  22   3.088   6.665  -5.779
  161    HZ   PHE  22           HZ       PHE  22   2.202   8.859  -5.068
  162    H    LYS  23           H        LYS  23   5.703   9.947 -12.209
  163    HA   LYS  23           HA       LYS  23   5.620   8.294 -14.599
  164   1HB   LYS  23          1HB       LYS  23   6.388  11.110 -13.989
  165   2HB   LYS  23          2HB       LYS  23   7.337  10.433 -15.294
  166   1HG   LYS  23          1HG       LYS  23   5.140  11.711 -15.882
  167   2HG   LYS  23          2HG       LYS  23   4.277  10.305 -15.283
  168   1HD   LYS  23          1HD       LYS  23   4.360   9.600 -17.464
  169   2HD   LYS  23          2HD       LYS  23   5.964   9.006 -17.021
  170   1HE   LYS  23          1HE       LYS  23   6.282  10.250 -19.079
  171   2HE   LYS  23          2HE       LYS  23   5.277  11.600 -18.533
  172   1HZ   LYS  23          1HZ       LYS  23   7.834  11.799 -18.424
  173   2HZ   LYS  23          2HZ       LYS  23   7.734  10.910 -17.034
  174   3HZ   LYS  23          3HZ       LYS  23   6.958  12.365 -17.142
  175    H    ALA  24           H        ALA  24   8.332   9.372 -12.569
  176    HA   ALA  24           HA       ALA  24  10.584   8.490 -14.170
  177   1HB   ALA  24          1HB       ALA  24  11.894   8.539 -12.057
  178   2HB   ALA  24          2HB       ALA  24  10.860   9.972 -12.206
  179   3HB   ALA  24          3HB       ALA  24  10.400   8.655 -11.097
  180    H    ALA  25           H        ALA  25   9.009   6.833 -11.409
  181    HA   ALA  25           HA       ALA  25  10.459   4.246 -11.971
  182   1HB   ALA  25          1HB       ALA  25   9.462   3.475  -9.827
  183   2HB   ALA  25          2HB       ALA  25  10.274   5.039  -9.629
  184   3HB   ALA  25          3HB       ALA  25   8.494   4.964  -9.701
  185    H    PHE  26           H        PHE  26   7.964   5.555 -13.497
  186    HA   PHE  26           HA       PHE  26   5.986   3.267 -13.460
  187   1HB   PHE  26          1HB       PHE  26   5.020   5.490 -13.648
  188   2HB   PHE  26          2HB       PHE  26   6.049   5.935 -14.983
  189    HD1  PHE  26           HD1      PHE  26   5.603   4.897 -17.297
  190    HD2  PHE  26           HD2      PHE  26   2.971   4.179 -13.971
  191    HE1  PHE  26           HE1      PHE  26   3.870   4.065 -18.834
  192    HE2  PHE  26           HE2      PHE  26   1.252   3.345 -15.524
  193    HZ   PHE  26           HZ       PHE  26   1.698   3.282 -17.953
  194    H    ASP  27           H        ASP  27   8.431   4.757 -15.552
  195    HA   ASP  27           HA       ASP  27   8.119   2.881 -17.840
  196   1HB   ASP  27          1HB       ASP  27  10.561   3.873 -18.383
  197   2HB   ASP  27          2HB       ASP  27  10.129   5.057 -17.171
  198    H    MET  28           H        MET  28  10.457   3.260 -15.173
  199    HA   MET  28           HA       MET  28  12.222   1.045 -15.591
  200   1HB   MET  28          1HB       MET  28  12.627   2.591 -13.729
  201   2HB   MET  28          2HB       MET  28  11.153   2.095 -12.916
  202   1HG   MET  28          1HG       MET  28  13.784   0.565 -13.149
  203   2HG   MET  28          2HG       MET  28  12.284  -0.347 -12.910
  204   1HE   MET  28          1HE       MET  28  13.000   3.389 -11.665
  205   2HE   MET  28          2HE       MET  28  13.655   3.083 -10.028
  206   3HE   MET  28          3HE       MET  28  14.591   2.587 -11.469
  207    H    PHE  29           H        PHE  29   9.049   1.080 -13.966
  208    HA   PHE  29           HA       PHE  29   8.922  -1.784 -13.288
  209   1HB   PHE  29          1HB       PHE  29   7.457   0.112 -12.300
  210   2HB   PHE  29          2HB       PHE  29   6.495   0.044 -13.753
  211    HD1  PHE  29           HD1      PHE  29   6.312  -2.924 -14.291
  212    HD2  PHE  29           HD2      PHE  29   6.101  -0.787 -10.560
  213    HE1  PHE  29           HE1      PHE  29   4.963  -4.737 -13.315
  214    HE2  PHE  29           HE2      PHE  29   4.748  -2.608  -9.607
  215    HZ   PHE  29           HZ       PHE  29   4.170  -4.577 -10.980
  216    H    ASP  30           H        ASP  30   7.955   0.165 -16.079
  217    HA   ASP  30           HA       ASP  30   6.551  -1.988 -17.573
  218   1HB   ASP  30          1HB       ASP  30   7.704   0.414 -19.031
  219   2HB   ASP  30          2HB       ASP  30   6.441   0.690 -17.853
  220    H    ALA  31           H        ALA  31   7.314  -2.982 -19.499
  221    HA   ALA  31           HA       ALA  31  10.242  -3.762 -19.399
  222   1HB   ALA  31          1HB       ALA  31   9.560  -5.654 -20.880
  223   2HB   ALA  31          2HB       ALA  31   8.567  -5.577 -19.411
  224   3HB   ALA  31          3HB       ALA  31   7.898  -5.024 -20.968
  225    H    ASP  32           H        ASP  32   7.814  -2.669 -21.781
  226    HA   ASP  32           HA       ASP  32   9.906  -2.083 -23.890
  227   1HB   ASP  32          1HB       ASP  32   8.288  -2.337 -25.421
  228   2HB   ASP  32          2HB       ASP  32   7.290  -1.104 -24.687
  229    H    GLY  33           H        GLY  33   7.095  -0.140 -22.861
  230   1HA   GLY  33          1HA       GLY  33   7.782   1.935 -21.273
  231   2HA   GLY  33          2HA       GLY  33   8.900   2.300 -22.568
  232    H    GLY  34           H        GLY  34   5.595   1.027 -22.883
  233   1HA   GLY  34          1HA       GLY  34   4.667   3.277 -24.653
  234   2HA   GLY  34          2HA       GLY  34   3.698   1.885 -24.151
  235    H    GLY  35           H        GLY  35   2.405   1.988 -22.413
  236   1HA   GLY  35          1HA       GLY  35   2.446   4.165 -20.343
  237   2HA   GLY  35          2HA       GLY  35   1.197   4.426 -21.569
  238    H    ASP  36           H        ASP  36   2.270   1.231 -20.586
  239    HA   ASP  36           HA       ASP  36   0.253   0.678 -18.513
  240   1HB   ASP  36          1HB       ASP  36  -1.538   0.655 -19.990
  241   2HB   ASP  36          2HB       ASP  36  -1.097  -1.036 -19.930
  242    H    ILE  37           H        ILE  37   0.395  -1.469 -17.751
  243    HA   ILE  37           HA       ILE  37   2.832  -3.071 -18.674
  244    HB   ILE  37           HB       ILE  37   2.453  -3.207 -15.766
  245   1HG1  ILE  37          1HG1      ILE  37   2.963  -0.451 -16.939
  246   2HG1  ILE  37          2HG1      ILE  37   2.075  -0.912 -15.500
  247   1HG2  ILE  37          1HG2      ILE  37   4.917  -3.205 -15.748
  248   2HG2  ILE  37          2HG2      ILE  37   4.329  -4.282 -17.023
  249   3HG2  ILE  37          3HG2      ILE  37   4.975  -2.679 -17.448
  250   1HD1  ILE  37          1HD1      ILE  37   5.145  -0.851 -15.705
  251   2HD1  ILE  37          2HD1      ILE  37   4.095   0.268 -14.810
  252   3HD1  ILE  37          3HD1      ILE  37   4.234  -1.425 -14.282
  253    H    SER  38           H        SER  38   2.195  -4.962 -19.300
  254    HA   SER  38           HA       SER  38  -0.435  -6.175 -18.507
  255   1HB   SER  38          1HB       SER  38   1.141  -6.330 -20.800
  256   2HB   SER  38          2HB       SER  38   1.440  -7.900 -20.050
  257    HG   SER  38           HG       SER  38  -0.397  -8.391 -20.841
  258    H    THR  39           H        THR  39   0.416  -8.886 -18.557
  259    HA   THR  39           HA       THR  39   1.182  -9.288 -15.693
  260    HB   THR  39           HB       THR  39   1.107 -11.842 -16.565
  261    HG1  THR  39           HG1      THR  39  -0.828 -10.681 -18.211
  262   1HG2  THR  39          1HG2      THR  39  -1.261 -11.990 -15.933
  263   2HG2  THR  39          2HG2      THR  39  -0.445 -10.864 -14.824
  264   3HG2  THR  39          3HG2      THR  39  -1.487 -10.237 -16.129
  265    H    LYS  40           H        LYS  40   2.473 -10.542 -18.802
  266    HA   LYS  40           HA       LYS  40   4.949 -11.625 -17.911
  267   1HB   LYS  40          1HB       LYS  40   4.263 -12.085 -20.123
  268   2HB   LYS  40          2HB       LYS  40   4.123 -10.413 -20.600
  269   1HG   LYS  40          1HG       LYS  40   6.680 -10.263 -20.474
  270   2HG   LYS  40          2HG       LYS  40   6.066 -11.365 -21.678
  271   1HD   LYS  40          1HD       LYS  40   7.686 -11.992 -19.185
  272   2HD   LYS  40          2HD       LYS  40   6.438 -13.125 -19.611
  273   1HE   LYS  40          1HE       LYS  40   8.583 -13.840 -20.567
  274   2HE   LYS  40          2HE       LYS  40   7.383 -13.595 -21.829
  275   1HZ   LYS  40          1HZ       LYS  40   8.474 -11.618 -22.507
  276   2HZ   LYS  40          2HZ       LYS  40   9.707 -12.675 -22.203
  277   3HZ   LYS  40          3HZ       LYS  40   9.355 -11.481 -21.116
  278    H    GLU  41           H        GLU  41   4.160  -8.285 -18.862
  279    HA   GLU  41           HA       GLU  41   6.803  -7.092 -18.802
  280   1HB   GLU  41          1HB       GLU  41   5.811  -4.961 -18.869
  281   2HB   GLU  41          2HB       GLU  41   4.380  -5.463 -17.995
  282   1HG   GLU  41          1HG       GLU  41   4.788  -6.780 -20.695
  283   2HG   GLU  41          2HG       GLU  41   3.310  -6.296 -19.891
  284    H    LEU  42           H        LEU  42   4.370  -7.533 -16.251
  285    HA   LEU  42           HA       LEU  42   5.711  -5.965 -14.143
  286   1HB   LEU  42          1HB       LEU  42   3.322  -7.731 -14.335
  287   2HB   LEU  42          2HB       LEU  42   3.537  -6.212 -13.492
  288    HG   LEU  42           HG       LEU  42   4.341  -8.997 -12.457
  289   1HD1  LEU  42          1HD1      LEU  42   5.054  -7.863 -10.335
  290   2HD1  LEU  42          2HD1      LEU  42   6.062  -7.363 -11.702
  291   3HD1  LEU  42          3HD1      LEU  42   4.800  -6.267 -11.086
  292   1HD2  LEU  42          1HD2      LEU  42   2.222  -7.000 -11.409
  293   2HD2  LEU  42          2HD2      LEU  42   1.887  -8.519 -12.278
  294   3HD2  LEU  42          3HD2      LEU  42   2.637  -8.569 -10.672
  295    H    GLY  43           H        GLY  43   5.750  -9.355 -15.141
  296   1HA   GLY  43          1HA       GLY  43   7.230 -11.202 -14.603
  297   2HA   GLY  43          2HA       GLY  43   6.983 -10.685 -12.932
  298    H    THR  44           H        THR  44   8.411  -8.500 -15.255
  299    HA   THR  44           HA       THR  44  11.224  -9.252 -14.947
  300    HB   THR  44           HB       THR  44   9.762  -7.075 -16.321
  301    HG1  THR  44           HG1      THR  44  11.066  -9.076 -16.969
  302   1HG2  THR  44          1HG2      THR  44  11.748  -5.592 -16.656
  303   2HG2  THR  44          2HG2      THR  44  11.188  -5.544 -14.971
  304   3HG2  THR  44          3HG2      THR  44  12.642  -6.482 -15.399
  305    H    VAL  45           H        VAL  45   9.854  -6.120 -13.945
  306    HA   VAL  45           HA       VAL  45  11.942  -5.348 -12.145
  307    HB   VAL  45           HB       VAL  45   9.283  -4.321 -12.779
  308   1HG1  VAL  45          1HG1      VAL  45   8.816  -3.046 -10.685
  309   2HG1  VAL  45          2HG1      VAL  45   8.695  -4.784 -10.386
  310   3HG1  VAL  45          3HG1      VAL  45  10.136  -3.897  -9.840
  311   1HG2  VAL  45          1HG2      VAL  45  11.788  -2.889 -11.668
  312   2HG2  VAL  45          2HG2      VAL  45  11.397  -3.114 -13.388
  313   3HG2  VAL  45          3HG2      VAL  45  10.358  -2.097 -12.380
  314    H    MET  46           H        MET  46   8.884  -7.055 -11.444
  315    HA   MET  46           HA       MET  46   8.944  -7.207  -8.590
  316   1HB   MET  46          1HB       MET  46   7.054  -8.042 -10.103
  317   2HB   MET  46          2HB       MET  46   7.391  -8.979  -8.659
  318   1HG   MET  46          1HG       MET  46   7.913  -9.749 -11.568
  319   2HG   MET  46          2HG       MET  46   8.884 -10.501 -10.291
  320   1HE   MET  46          1HE       MET  46   7.076 -10.770  -7.739
  321   2HE   MET  46          2HE       MET  46   6.235 -12.322  -8.023
  322   3HE   MET  46          3HE       MET  46   7.972 -12.167  -8.414
  323    NH1  ARG  47           NH1      ARG  47  13.216 -11.074 -14.761
  324    NH2  ARG  47           NH2      ARG  47  11.672 -12.628 -15.366
  325    H    ARG  47           H        ARG  47  10.537  -9.301 -10.980
  326    HA   ARG  47           HA       ARG  47  11.796 -11.252  -9.238
  327   1HB   ARG  47          1HB       ARG  47  11.712 -11.062 -11.908
  328   2HB   ARG  47          2HB       ARG  47  13.253 -10.240 -11.704
  329   1HG   ARG  47          1HG       ARG  47  12.610 -13.099 -10.761
  330   2HG   ARG  47          2HG       ARG  47  14.102 -12.252 -10.352
  331   1HD   ARG  47          1HD       ARG  47  14.669 -12.013 -12.816
  332   2HD   ARG  47          2HD       ARG  47  14.535 -13.685 -12.295
  333    HE   ARG  47           HE       ARG  47  12.361 -13.915 -13.462
  334   1HH1  ARG  47          1HH1      ARG  47  13.948 -10.794 -14.099
  335   2HH1  ARG  47          2HH1      ARG  47  12.898 -10.550 -15.583
  336   1HH2  ARG  47          1HH2      ARG  47  11.225 -13.530 -15.168
  337   2HH2  ARG  47          2HH2      ARG  47  11.462 -11.996 -16.146
  338    H    MET  48           H        MET  48  13.053  -8.165 -10.522
  339    HA   MET  48           HA       MET  48  15.671  -8.083  -9.376
  340   1HB   MET  48          1HB       MET  48  13.785  -5.972 -10.329
  341   2HB   MET  48          2HB       MET  48  14.891  -5.412  -9.089
  342   1HG   MET  48          1HG       MET  48  16.651  -6.795 -10.792
  343   2HG   MET  48          2HG       MET  48  15.463  -6.140 -11.931
  344   1HE   MET  48          1HE       MET  48  14.471  -3.419 -11.412
  345   2HE   MET  48          2HE       MET  48  15.837  -2.336 -11.809
  346   3HE   MET  48          3HE       MET  48  15.502  -3.762 -12.835
  347    H    LEU  49           H        LEU  49  12.545  -7.545  -7.857
  348    HA   LEU  49           HA       LEU  49  13.144  -6.165  -5.441
  349   1HB   LEU  49          1HB       LEU  49  11.222  -8.560  -5.603
  350   2HB   LEU  49          2HB       LEU  49  10.840  -6.976  -6.242
  351    HG   LEU  49           HG       LEU  49  11.512  -6.275  -3.641
  352   1HD1  LEU  49          1HD1      LEU  49   9.056  -6.085  -3.238
  353   2HD1  LEU  49          2HD1      LEU  49   9.465  -5.549  -4.878
  354   3HD1  LEU  49          3HD1      LEU  49   8.718  -7.147  -4.629
  355   1HD2  LEU  49          1HD2      LEU  49  10.180  -9.060  -3.424
  356   2HD2  LEU  49          2HD2      LEU  49  11.813  -8.631  -2.857
  357   3HD2  LEU  49          3HD2      LEU  49  10.396  -7.905  -2.084
  358    H    GLY  50           H        GLY  50  13.144  -9.720  -5.871
  359   1HA   GLY  50          1HA       GLY  50  15.598 -10.589  -4.953
  360   2HA   GLY  50          2HA       GLY  50  14.892 -10.098  -3.407
  361    H    GLN  51           H        GLN  51  13.671 -11.819  -6.290
  362    HA   GLN  51           HA       GLN  51  13.087 -14.358  -4.758
  363   1HB   GLN  51          1HB       GLN  51  10.554 -13.851  -5.914
  364   2HB   GLN  51          2HB       GLN  51  10.996 -12.310  -5.201
  365   1HG   GLN  51          1HG       GLN  51  10.914 -13.099  -3.006
  366   2HG   GLN  51          2HG       GLN  51  11.423 -14.720  -3.424
  367   1HE2  GLN  51          1HE2      GLN  51   7.385 -13.795  -3.429
  368   2HE2  GLN  51          2HE2      GLN  51   8.660 -12.476  -3.468
  369    H    ASN  52           H        ASN  52  11.325 -15.461  -6.565
  370    HA   ASN  52           HA       ASN  52  12.334 -15.036  -9.363
  371   1HB   ASN  52          1HB       ASN  52  12.486 -17.906  -8.347
  372   2HB   ASN  52          2HB       ASN  52  13.809 -16.815  -7.996
  373   1HD2  ASN  52          1HD2      ASN  52  15.143 -17.789 -11.193
  374   2HD2  ASN  52          2HD2      ASN  52  15.362 -17.596  -9.382
  375    HA   PRO  53           HA       PRO  53   7.751 -16.171  -9.007
  376   1HB   PRO  53          1HB       PRO  53   6.702 -14.372 -10.815
  377   2HB   PRO  53          2HB       PRO  53   7.231 -13.941  -9.182
  378   1HG   PRO  53          1HG       PRO  53   8.762 -13.569 -11.800
  379   2HG   PRO  53          2HG       PRO  53   8.549 -12.396 -10.480
  380   1HD   PRO  53          1HD       PRO  53  10.297 -13.412  -9.182
  381   2HD   PRO  53          2HD       PRO  53  10.828 -14.034 -10.772
  382    H    THR  54           H        THR  54   6.065 -16.580 -10.915
  383    HA   THR  54           HA       THR  54   7.387 -18.048 -13.247
  384    HB   THR  54           HB       THR  54   6.532 -19.511 -11.179
  385    HG1  THR  54           HG1      THR  54   5.750 -20.511 -13.636
  386   1HG2  THR  54          1HG2      THR  54   4.303 -20.515 -11.554
  387   2HG2  THR  54          2HG2      THR  54   4.130 -18.776 -11.223
  388   3HG2  THR  54          3HG2      THR  54   3.970 -19.386 -12.890
  389    H    LYS  55           H        LYS  55   5.994 -18.355 -15.062
  390    HA   LYS  55           HA       LYS  55   4.631 -15.892 -15.843
  391   1HB   LYS  55          1HB       LYS  55   5.592 -18.251 -17.179
  392   2HB   LYS  55          2HB       LYS  55   5.103 -16.726 -17.887
  393   1HG   LYS  55          1HG       LYS  55   2.635 -17.753 -17.705
  394   2HG   LYS  55          2HG       LYS  55   3.686 -18.090 -19.069
  395   1HD   LYS  55          1HD       LYS  55   2.812 -20.251 -18.462
  396   2HD   LYS  55          2HD       LYS  55   2.891 -19.898 -16.743
  397   1HE   LYS  55          1HE       LYS  55   5.540 -20.021 -18.204
  398   2HE   LYS  55          2HE       LYS  55   5.167 -20.480 -16.544
  399   1HZ   LYS  55          1HZ       LYS  55   4.166 -22.034 -18.883
  400   2HZ   LYS  55          2HZ       LYS  55   4.219 -22.516 -17.304
  401   3HZ   LYS  55          3HZ       LYS  55   5.620 -22.345 -18.163
  402    H    GLU  56           H        GLU  56   3.518 -19.071 -14.770
  403    HA   GLU  56           HA       GLU  56   0.661 -18.752 -15.342
  404   1HB   GLU  56          1HB       GLU  56   0.894 -20.585 -13.165
  405   2HB   GLU  56          2HB       GLU  56   2.370 -20.782 -14.089
  406   1HG   GLU  56          1HG       GLU  56   0.950 -21.141 -16.198
  407   2HG   GLU  56          2HG       GLU  56   0.788 -22.379 -14.965
  408    H    GLU  57           H        GLU  57   2.712 -18.051 -12.547
  409    HA   GLU  57           HA       GLU  57   0.564 -17.487 -10.593
  410   1HB   GLU  57          1HB       GLU  57   3.452 -16.505 -10.431
  411   2HB   GLU  57          2HB       GLU  57   2.958 -18.136 -10.032
  412   1HG   GLU  57          1HG       GLU  57   3.254 -16.412  -8.078
  413   2HG   GLU  57          2HG       GLU  57   1.735 -15.690  -8.593
  414    H    LEU  58           H        LEU  58   2.384 -15.600 -12.944
  415    HA   LEU  58           HA       LEU  58   1.888 -12.915 -12.034
  416   1HB   LEU  58          1HB       LEU  58   2.513 -14.123 -14.759
  417   2HB   LEU  58          2HB       LEU  58   2.079 -12.428 -14.662
  418    HG   LEU  58           HG       LEU  58   4.333 -13.639 -12.945
  419   1HD1  LEU  58          1HD1      LEU  58   5.974 -12.744 -14.644
  420   2HD1  LEU  58          2HD1      LEU  58   4.977 -14.035 -15.331
  421   3HD1  LEU  58          3HD1      LEU  58   4.629 -12.338 -15.741
  422   1HD2  LEU  58          1HD2      LEU  58   3.747 -10.721 -13.773
  423   2HD2  LEU  58          2HD2      LEU  58   3.451 -11.434 -12.168
  424   3HD2  LEU  58          3HD2      LEU  58   5.112 -11.273 -12.769
  425    H    ASP  59           H        ASP  59  -0.077 -15.155 -13.912
  426    HA   ASP  59           HA       ASP  59  -2.126 -13.394 -14.952
  427   1HB   ASP  59          1HB       ASP  59  -2.350 -16.366 -14.216
  428   2HB   ASP  59          2HB       ASP  59  -1.920 -15.695 -15.772
  429    H    ALA  60           H        ALA  60  -1.817 -15.054 -11.834
  430    HA   ALA  60           HA       ALA  60  -4.468 -14.213 -10.764
  431   1HB   ALA  60          1HB       ALA  60  -3.686 -15.238  -8.634
  432   2HB   ALA  60          2HB       ALA  60  -3.422 -16.324 -10.011
  433   3HB   ALA  60          3HB       ALA  60  -2.047 -15.442  -9.297
  434    H    ILE  61           H        ILE  61  -1.146 -13.059 -10.638
  435    HA   ILE  61           HA       ILE  61  -1.305 -11.248  -8.347
  436    HB   ILE  61           HB       ILE  61   0.639 -11.673 -10.573
  437   1HG1  ILE  61          1HG1      ILE  61   1.673 -12.641  -8.785
  438   2HG1  ILE  61          2HG1      ILE  61   0.543 -11.935  -7.650
  439   1HG2  ILE  61          1HG2      ILE  61   1.932  -9.560 -10.160
  440   2HG2  ILE  61          2HG2      ILE  61   0.344  -9.194 -10.830
  441   3HG2  ILE  61          3HG2      ILE  61   0.641  -8.957  -9.092
  442   1HD1  ILE  61          1HD1      ILE  61   1.880  -9.858  -7.426
  443   2HD1  ILE  61          2HD1      ILE  61   2.885 -11.290  -7.118
  444   3HD1  ILE  61          3HD1      ILE  61   3.023 -10.433  -8.671
  445    H    ILE  62           H        ILE  62  -1.999 -10.903 -11.802
  446    HA   ILE  62           HA       ILE  62  -2.534  -7.968 -11.729
  447    HB   ILE  62           HB       ILE  62  -2.603 -10.097 -13.843
  448   1HG1  ILE  62          1HG1      ILE  62  -0.593  -8.652 -13.593
  449   2HG1  ILE  62          2HG1      ILE  62  -1.557  -7.197 -13.737
  450   1HG2  ILE  62          1HG2      ILE  62  -3.877  -8.691 -15.487
  451   2HG2  ILE  62          2HG2      ILE  62  -4.915  -9.143 -14.137
  452   3HG2  ILE  62          3HG2      ILE  62  -4.243  -7.499 -14.216
  453   1HD1  ILE  62          1HD1      ILE  62  -2.088  -7.636 -16.118
  454   2HD1  ILE  62          2HD1      ILE  62  -0.334  -7.689 -15.847
  455   3HD1  ILE  62          3HD1      ILE  62  -1.242  -9.206 -16.042
  456    H    GLU  63           H        GLU  63  -4.368 -10.985 -11.571
  457    HA   GLU  63           HA       GLU  63  -7.078 -10.173 -11.756
  458   1HB   GLU  63          1HB       GLU  63  -6.153 -12.137  -9.602
  459   2HB   GLU  63          2HB       GLU  63  -6.129 -12.540 -11.307
  460   1HG   GLU  63          1HG       GLU  63  -8.770 -11.472 -10.279
  461   2HG   GLU  63          2HG       GLU  63  -8.456 -12.746 -11.445
  462    H    GLU  64           H        GLU  64  -5.027 -10.116  -8.826
  463    HA   GLU  64           HA       GLU  64  -6.995  -8.888  -7.040
  464   1HB   GLU  64          1HB       GLU  64  -4.297  -9.889  -6.817
  465   2HB   GLU  64          2HB       GLU  64  -4.301  -8.276  -6.132
  466   1HG   GLU  64          1HG       GLU  64  -6.294  -8.984  -4.651
  467   2HG   GLU  64          2HG       GLU  64  -4.761  -9.765  -4.306
  468    H    VAL  65           H        VAL  65  -4.518  -7.626  -9.206
  469    HA   VAL  65           HA       VAL  65  -5.113  -4.747  -8.400
  470    HB   VAL  65           HB       VAL  65  -3.064  -4.091  -9.593
  471   1HG1  VAL  65          1HG1      VAL  65  -1.400  -5.058  -7.995
  472   2HG1  VAL  65          2HG1      VAL  65  -2.909  -4.646  -7.160
  473   3HG1  VAL  65          3HG1      VAL  65  -2.542  -6.346  -7.540
  474   1HG2  VAL  65          1HG2      VAL  65  -2.547  -7.093 -10.151
  475   2HG2  VAL  65          2HG2      VAL  65  -2.870  -5.837 -11.370
  476   3HG2  VAL  65          3HG2      VAL  65  -1.384  -5.770 -10.411
  477    H    ASP  66           H        ASP  66  -7.068  -6.196  -9.786
  478    HA   ASP  66           HA       ASP  66  -7.379  -4.491 -12.272
  479   1HB   ASP  66          1HB       ASP  66  -7.713  -7.535 -12.501
  480   2HB   ASP  66          2HB       ASP  66  -6.268  -6.681 -12.994
  481    H    GLU  67           H        GLU  67  -8.728  -3.669 -10.439
  482    HA   GLU  67           HA       GLU  67 -11.293  -5.089  -9.780
  483   1HB   GLU  67          1HB       GLU  67  -9.824  -3.188  -8.440
  484   2HB   GLU  67          2HB       GLU  67 -11.043  -2.159  -9.166
  485   1HG   GLU  67          1HG       GLU  67 -12.065  -4.659  -7.773
  486   2HG   GLU  67          2HG       GLU  67 -12.793  -3.065  -7.878
  487    H    ASP  68           H        ASP  68 -10.075  -2.716 -12.055
  488    HA   ASP  68           HA       ASP  68 -12.758  -1.790 -13.014
  489   1HB   ASP  68          1HB       ASP  68 -10.529  -0.399 -13.043
  490   2HB   ASP  68          2HB       ASP  68 -11.716  -0.204 -14.313
  491    H    GLY  69           H        GLY  69 -10.256  -4.080 -14.002
  492   1HA   GLY  69          1HA       GLY  69 -12.185  -5.558 -15.798
  493   2HA   GLY  69          2HA       GLY  69 -10.569  -6.111 -15.339
  494    H    SER  70           H        SER  70  -8.931  -5.862 -16.677
  495    HA   SER  70           HA       SER  70  -9.336  -4.820 -19.457
  496   1HB   SER  70          1HB       SER  70  -7.262  -3.200 -19.162
  497   2HB   SER  70          2HB       SER  70  -8.895  -2.657 -18.767
  498    HG   SER  70           HG       SER  70  -7.826  -2.152 -17.020
  499    H    GLY  71           H        GLY  71  -6.965  -5.729 -16.942
  500   1HA   GLY  71          1HA       GLY  71  -5.732  -7.976 -17.189
  501   2HA   GLY  71          2HA       GLY  71  -5.613  -7.641 -18.921
  502    H    THR  72           H        THR  72  -5.015  -4.809 -18.553
  503    HA   THR  72           HA       THR  72  -2.034  -5.087 -18.056
  504    HB   THR  72           HB       THR  72  -2.207  -2.601 -19.152
  505    HG1  THR  72           HG1      THR  72  -4.284  -2.492 -19.555
  506   1HG2  THR  72          1HG2      THR  72  -1.656  -3.542 -21.358
  507   2HG2  THR  72          2HG2      THR  72  -0.785  -4.459 -20.110
  508   3HG2  THR  72          3HG2      THR  72  -2.229  -5.158 -20.888
  509    H    ILE  73           H        ILE  73  -1.249  -2.577 -17.511
  510    HA   ILE  73           HA       ILE  73  -2.718  -1.623 -15.006
  511    HB   ILE  73           HB       ILE  73   0.301  -2.125 -15.062
  512   1HG1  ILE  73          1HG1      ILE  73  -1.512  -4.181 -14.857
  513   2HG1  ILE  73          2HG1      ILE  73   0.057  -4.183 -14.080
  514   1HG2  ILE  73          1HG2      ILE  73   0.281  -1.512 -12.647
  515   2HG2  ILE  73          2HG2      ILE  73  -0.393  -0.182 -13.600
  516   3HG2  ILE  73          3HG2      ILE  73  -1.478  -1.251 -12.679
  517   1HD1  ILE  73          1HD1      ILE  73  -2.565  -3.427 -12.664
  518   2HD1  ILE  73          2HD1      ILE  73  -1.605  -4.907 -12.454
  519   3HD1  ILE  73          3HD1      ILE  73  -0.943  -3.343 -11.922
  520    H    ASP  74           H        ASP  74  -3.377  -0.216 -16.857
  521    HA   ASP  74           HA       ASP  74  -1.622   1.652 -18.215
  522   1HB   ASP  74          1HB       ASP  74  -3.580   1.975 -19.270
  523   2HB   ASP  74          2HB       ASP  74  -3.923   3.154 -18.025
  524    H    PHE  75           H        PHE  75  -1.490   3.998 -17.817
  525    HA   PHE  75           HA       PHE  75  -0.294   4.603 -15.199
  526   1HB   PHE  75          1HB       PHE  75  -1.214   6.692 -17.260
  527   2HB   PHE  75          2HB       PHE  75   0.214   5.721 -17.498
  528    HD1  PHE  75           HD1      PHE  75   2.056   5.808 -15.560
  529    HD2  PHE  75           HD2      PHE  75  -1.071   8.733 -15.996
  530    HE1  PHE  75           HE1      PHE  75   3.353   7.411 -14.218
  531    HE2  PHE  75           HE2      PHE  75   0.246  10.324 -14.653
  532    HZ   PHE  75           HZ       PHE  75   2.443   9.659 -13.743
  533    H    GLU  76           H        GLU  76  -3.506   4.906 -16.563
  534    HA   GLU  76           HA       GLU  76  -4.561   6.616 -14.294
  535   1HB   GLU  76          1HB       GLU  76  -6.810   6.151 -15.675
  536   2HB   GLU  76          2HB       GLU  76  -5.684   7.440 -16.042
  537   1HG   GLU  76          1HG       GLU  76  -4.601   5.714 -17.761
  538   2HG   GLU  76          2HG       GLU  76  -6.081   4.805 -17.539
  539    H    GLU  77           H        GLU  77  -3.528   4.216 -13.461
  540    HA   GLU  77           HA       GLU  77  -5.867   2.975 -12.056
  541   1HB   GLU  77          1HB       GLU  77  -6.096   1.521 -13.874
  542   2HB   GLU  77          2HB       GLU  77  -4.377   1.422 -14.183
  543   1HG   GLU  77          1HG       GLU  77  -4.004  -0.108 -12.313
  544   2HG   GLU  77          2HG       GLU  77  -5.596   0.207 -11.632
  545    H    PHE  78           H        PHE  78  -2.401   2.824 -12.828
  546    HA   PHE  78           HA       PHE  78  -1.417   1.471 -10.478
  547   1HB   PHE  78          1HB       PHE  78   0.000   1.927 -12.478
  548   2HB   PHE  78          2HB       PHE  78  -0.017   3.644 -12.165
  549    HD1  PHE  78           HD1      PHE  78   1.182   0.328 -10.827
  550    HD2  PHE  78           HD2      PHE  78   1.574   4.604 -10.558
  551    HE1  PHE  78           HE1      PHE  78   3.252   0.068  -9.520
  552    HE2  PHE  78           HE2      PHE  78   3.645   4.324  -9.259
  553    HZ   PHE  78           HZ       PHE  78   4.489   2.061  -8.740
  554    H    LEU  79           H        LEU  79  -2.210   4.866 -11.061
  555    HA   LEU  79           HA       LEU  79  -1.138   5.994  -8.565
  556   1HB   LEU  79          1HB       LEU  79  -3.061   6.998 -10.699
  557   2HB   LEU  79          2HB       LEU  79  -3.015   7.849  -9.171
  558    HG   LEU  79           HG       LEU  79  -0.346   7.894  -9.619
  559   1HD1  LEU  79          1HD1      LEU  79   0.199   8.115 -12.045
  560   2HD1  LEU  79          2HD1      LEU  79  -0.412   6.489 -11.688
  561   3HD1  LEU  79          3HD1      LEU  79  -1.470   7.677 -12.488
  562   1HD2  LEU  79          1HD2      LEU  79  -2.328   9.787 -11.055
  563   2HD2  LEU  79          2HD2      LEU  79  -1.734   9.960  -9.384
  564   3HD2  LEU  79          3HD2      LEU  79  -0.608  10.132 -10.739
  565    H    VAL  80           H        VAL  80  -4.408   4.989  -9.578
  566    HA   VAL  80           HA       VAL  80  -5.892   5.585  -7.177
  567    HB   VAL  80           HB       VAL  80  -6.340   3.631  -9.432
  568   1HG1  VAL  80          1HG1      VAL  80  -8.458   2.772  -8.410
  569   2HG1  VAL  80          2HG1      VAL  80  -7.053   2.256  -7.469
  570   3HG1  VAL  80          3HG1      VAL  80  -8.070   3.588  -6.873
  571   1HG2  VAL  80          1HG2      VAL  80  -8.149   5.842  -8.256
  572   2HG2  VAL  80          2HG2      VAL  80  -7.117   6.019  -9.694
  573   3HG2  VAL  80          3HG2      VAL  80  -8.473   4.881  -9.719
  574    H    MET  81           H        MET  81  -3.829   2.850  -8.043
  575    HA   MET  81           HA       MET  81  -4.372   0.986  -5.864
  576   1HB   MET  81          1HB       MET  81  -2.891   0.602  -7.985
  577   2HB   MET  81          2HB       MET  81  -1.596   1.378  -7.091
  578   1HG   MET  81          1HG       MET  81  -1.795  -0.388  -5.266
  579   2HG   MET  81          2HG       MET  81  -1.351  -1.043  -6.851
  580   1HE   MET  81          1HE       MET  81  -2.432  -2.966  -7.916
  581   2HE   MET  81          2HE       MET  81  -4.192  -3.288  -7.931
  582   3HE   MET  81          3HE       MET  81  -3.554  -1.797  -8.682
  583    H    MET  82           H        MET  82  -1.659   3.300  -6.161
  584    HA   MET  82           HA       MET  82  -0.762   3.012  -3.371
  585   1HB   MET  82          1HB       MET  82   0.584   5.184  -3.960
  586   2HB   MET  82          2HB       MET  82  -0.069   5.016  -5.579
  587   1HG   MET  82          1HG       MET  82   2.076   3.935  -5.658
  588   2HG   MET  82          2HG       MET  82   0.901   2.614  -5.638
  589   1HE   MET  82          1HE       MET  82   1.442   4.361  -1.833
  590   2HE   MET  82          2HE       MET  82   2.364   5.133  -3.157
  591   3HE   MET  82          3HE       MET  82   3.221   4.162  -1.924
  592    H    VAL  83           H        VAL  83  -3.333   4.798  -4.786
  593    HA   VAL  83           HA       VAL  83  -3.339   7.168  -3.010
  594    HB   VAL  83           HB       VAL  83  -4.693   6.463  -5.385
  595   1HG1  VAL  83          1HG1      VAL  83  -5.226   8.995  -3.710
  596   2HG1  VAL  83          2HG1      VAL  83  -3.750   8.753  -4.655
  597   3HG1  VAL  83          3HG1      VAL  83  -5.325   8.814  -5.481
  598   1HG2  VAL  83          1HG2      VAL  83  -7.076   6.854  -5.036
  599   2HG2  VAL  83          2HG2      VAL  83  -6.620   5.537  -3.932
  600   3HG2  VAL  83          3HG2      VAL  83  -6.850   7.172  -3.297
  601    NH1  ARG  84           NH1      ARG  84  -9.220  -0.773  -2.238
  602    NH2  ARG  84           NH2      ARG  84  -7.404  -2.127  -2.409
  603    H    ARG  84           H        ARG  84  -5.001   4.031  -3.105
  604    HA   ARG  84           HA       ARG  84  -6.907   4.460  -0.886
  605   1HB   ARG  84          1HB       ARG  84  -5.777   1.801  -1.960
  606   2HB   ARG  84          2HB       ARG  84  -7.135   1.971  -0.858
  607   1HG   ARG  84          1HG       ARG  84  -7.264   3.434  -3.531
  608   2HG   ARG  84          2HG       ARG  84  -8.592   2.889  -2.503
  609   1HD   ARG  84          1HD       ARG  84  -7.123   1.404  -4.628
  610   2HD   ARG  84          2HD       ARG  84  -8.749   1.129  -4.001
  611    HE   ARG  84           HE       ARG  84  -6.203   0.068  -2.656
  612   1HH1  ARG  84          1HH1      ARG  84  -6.416  -2.223  -2.670
  613   2HH1  ARG  84          2HH1      ARG  84  -8.020  -2.864  -2.048
  614   1HH2  ARG  84          1HH2      ARG  84  -9.630   0.151  -2.409
  615   2HH2  ARG  84          2HH2      ARG  84  -9.697  -1.596  -1.852
  616    H    GLN  85           H        GLN  85  -3.588   3.255  -1.138
  617    HA   GLN  85           HA       GLN  85  -3.315   2.396   1.720
  618   1HB   GLN  85          1HB       GLN  85  -1.389   2.639  -0.630
  619   2HB   GLN  85          2HB       GLN  85  -0.753   2.501   0.998
  620   1HG   GLN  85          1HG       GLN  85  -2.598   0.405   0.993
  621   2HG   GLN  85          2HG       GLN  85  -2.133   0.430  -0.694
  622   1HE2  GLN  85          1HE2      GLN  85   0.283  -1.856   1.050
  623   2HE2  GLN  85          2HE2      GLN  85  -1.470  -1.799   0.512
  624    H    MET  86           H        MET  86  -2.709   5.253  -0.244
  625    HA   MET  86           HA       MET  86  -0.909   6.817   1.324
  626   1HB   MET  86          1HB       MET  86  -2.760   7.379  -0.851
  627   2HB   MET  86          2HB       MET  86  -2.949   8.634   0.359
  628   1HG   MET  86          1HG       MET  86  -0.709   8.194  -1.531
  629   2HG   MET  86          2HG       MET  86  -0.121   8.389   0.128
  630   1HE   MET  86          1HE       MET  86  -3.410   9.867  -1.704
  631   2HE   MET  86          2HE       MET  86  -2.810  11.498  -2.126
  632   3HE   MET  86          3HE       MET  86  -2.094  10.057  -2.905
  633    H    LYS  87           H        LYS  87  -4.356   6.223   1.766
  634    HA   LYS  87           HA       LYS  87  -4.591   7.911   4.267
  635   1HB   LYS  87          1HB       LYS  87  -6.620   5.893   3.122
  636   2HB   LYS  87          2HB       LYS  87  -6.893   7.007   4.453
  637   1HG   LYS  87          1HG       LYS  87  -6.978   7.524   1.526
  638   2HG   LYS  87          2HG       LYS  87  -6.057   8.748   2.384
  639   1HD   LYS  87          1HD       LYS  87  -8.111   8.956   3.996
  640   2HD   LYS  87          2HD       LYS  87  -8.239   9.611   2.367
  641   1HE   LYS  87          1HE       LYS  87  -9.368   7.312   1.695
  642   2HE   LYS  87          2HE       LYS  87  -9.526   7.020   3.432
  643   1HZ   LYS  87          1HZ       LYS  87 -11.089   8.636   3.633
  644   2HZ   LYS  87          2HZ       LYS  87 -11.344   8.329   2.029
  645   3HZ   LYS  87          3HZ       LYS  87 -10.438   9.632   2.487
  646    H    GLU  88           H        GLU  88  -3.448   7.162   5.908
  647    HA   GLU  88           HA       GLU  88  -4.140   4.638   7.279
  648   1HB   GLU  88          1HB       GLU  88  -2.836   3.456   5.701
  649   2HB   GLU  88          2HB       GLU  88  -1.566   4.663   5.654
  650   1HG   GLU  88          1HG       GLU  88  -2.051   3.195   8.291
  651   2HG   GLU  88          2HG       GLU  88  -0.565   3.901   7.679
  652    H    ASP  89           H        ASP  89  -1.326   6.811   6.835
  653    HA   ASP  89           HA       ASP  89  -1.611   7.778   9.724
  654   1HB   ASP  89          1HB       ASP  89   0.835   6.526   8.463
  655   2HB   ASP  89          2HB       ASP  89   1.104   7.924   9.478
  656    H    ALA  90           H        ALA  90  -0.708   9.861  10.094
  657    HA   ALA  90           HA       ALA  90   0.230  11.668   7.935
  658   1HB   ALA  90          1HB       ALA  90  -1.771  13.174   7.803
  659   2HB   ALA  90          2HB       ALA  90  -2.166  11.552   7.201
  660   3HB   ALA  90          3HB       ALA  90  -2.717  12.057   8.817
   
  Start of MODEL          20
 Raw file had  660 H/Q atoms
  Start of MODEL   20
    1   1H    ALA   1          1H        ALA   1 -19.582  16.400 -18.276
    2   2H    ALA   1          2H        ALA   1 -19.580  16.685 -16.619
    3   3H    ALA   1          3H        ALA   1 -18.167  16.199 -17.391
    4    HA   ALA   1           HA       ALA   1 -19.756  14.577 -16.046
    5   1HB   ALA   1          1HB       ALA   1 -20.950  14.944 -18.799
    6   2HB   ALA   1          2HB       ALA   1 -21.738  14.512 -17.269
    7   3HB   ALA   1          3HB       ALA   1 -20.865  13.269 -18.202
    8    H    SER   2           H        SER   2 -18.790  12.584 -15.981
    9    HA   SER   2           HA       SER   2 -16.622  11.909 -18.048
   10   1HB   SER   2          1HB       SER   2 -16.447  11.687 -14.999
   11   2HB   SER   2          2HB       SER   2 -15.351  10.829 -16.084
   12    HG   SER   2           HG       SER   2 -14.333  12.645 -15.884
   13    H    MET   3           H        MET   3 -15.941   9.457 -17.346
   14    HA   MET   3           HA       MET   3 -18.498   7.802 -17.661
   15   1HB   MET   3          1HB       MET   3 -15.667   7.156 -18.664
   16   2HB   MET   3          2HB       MET   3 -17.077   6.133 -18.876
   17   1HG   MET   3          1HG       MET   3 -18.160   8.193 -20.138
   18   2HG   MET   3          2HG       MET   3 -16.524   8.866 -20.157
   19   1HE   MET   3          1HE       MET   3 -14.382   6.165 -21.903
   20   2HE   MET   3          2HE       MET   3 -14.481   7.434 -20.646
   21   3HE   MET   3          3HE       MET   3 -14.626   7.878 -22.372
   22    H    THR   4           H        THR   4 -15.130   7.011 -16.790
   23    HA   THR   4           HA       THR   4 -16.123   5.352 -14.459
   24    HB   THR   4           HB       THR   4 -13.548   5.207 -16.045
   25    HG1  THR   4           HG1      THR   4 -15.961   4.095 -16.087
   26   1HG2  THR   4          1HG2      THR   4 -12.829   4.622 -13.745
   27   2HG2  THR   4          2HG2      THR   4 -12.926   3.150 -14.737
   28   3HG2  THR   4          3HG2      THR   4 -14.203   3.514 -13.548
   29    H    ASP   5           H        ASP   5 -16.173   6.359 -12.595
   30    HA   ASP   5           HA       ASP   5 -14.408   8.712 -11.942
   31   1HB   ASP   5          1HB       ASP   5 -16.833   7.486 -10.538
   32   2HB   ASP   5          2HB       ASP   5 -15.808   8.641  -9.715
   33    H    GLN   6           H        GLN   6 -13.442   5.804 -12.094
   34    HA   GLN   6           HA       GLN   6 -12.394   5.257  -9.308
   35   1HB   GLN   6          1HB       GLN   6 -12.748   3.197 -10.256
   36   2HB   GLN   6          2HB       GLN   6 -12.503   3.764 -11.897
   37   1HG   GLN   6          1HG       GLN   6 -10.156   3.390  -9.948
   38   2HG   GLN   6          2HG       GLN   6 -10.054   3.663 -11.673
   39   1HE2  GLN   6          1HE2      GLN   6  -9.725   0.103 -11.977
   40   2HE2  GLN   6          2HE2      GLN   6  -9.009   1.773 -12.232
   41    H    GLN   7           H        GLN   7 -11.235   6.267 -12.517
   42    HA   GLN   7           HA       GLN   7  -8.382   6.664 -11.565
   43   1HB   GLN   7          1HB       GLN   7  -9.527   7.272 -14.364
   44   2HB   GLN   7          2HB       GLN   7  -7.836   7.193 -13.891
   45   1HG   GLN   7          1HG       GLN   7  -7.701   4.946 -14.160
   46   2HG   GLN   7          2HG       GLN   7  -9.167   4.630 -13.245
   47   1HE2  GLN   7          1HE2      GLN   7 -11.187   5.145 -16.423
   48   2HE2  GLN   7          2HE2      GLN   7 -11.144   5.857 -14.732
   49    H    ALA   8           H        ALA   8 -11.232   8.506 -12.553
   50    HA   ALA   8           HA       ALA   8 -10.271  11.161 -12.895
   51   1HB   ALA   8          1HB       ALA   8 -12.518  11.947 -12.165
   52   2HB   ALA   8          2HB       ALA   8 -12.643  10.537 -13.234
   53   3HB   ALA   8          3HB       ALA   8 -12.891  10.347 -11.479
   54    H    GLU   9           H        GLU   9 -10.651   9.311  -9.929
   55    HA   GLU   9           HA       GLU   9 -10.420  11.530  -7.993
   56   1HB   GLU   9          1HB       GLU   9 -10.448   8.512  -7.783
   57   2HB   GLU   9          2HB       GLU   9  -9.614   9.366  -6.493
   58   1HG   GLU   9          1HG       GLU   9 -12.413   8.916  -6.671
   59   2HG   GLU   9          2HG       GLU   9 -12.257  10.631  -7.032
   60    H    ALA  10           H        ALA  10  -8.116   9.168  -9.327
   61    HA   ALA  10           HA       ALA  10  -5.814   9.971  -7.647
   62   1HB   ALA  10          1HB       ALA  10  -4.489   8.464  -9.122
   63   2HB   ALA  10          2HB       ALA  10  -5.991   7.685  -8.589
   64   3HB   ALA  10          3HB       ALA  10  -5.856   8.313 -10.252
   65    NH1  ARG  11           NH1      ARG  11  -5.112  13.331 -16.782
   66    NH2  ARG  11           NH2      ARG  11  -3.693  11.736 -17.557
   67    H    ARG  11           H        ARG  11  -7.119  10.978 -10.738
   68    HA   ARG  11           HA       ARG  11  -4.678  12.324 -11.822
   69   1HB   ARG  11          1HB       ARG  11  -7.612  12.661 -12.703
   70   2HB   ARG  11          2HB       ARG  11  -6.189  13.226 -13.566
   71   1HG   ARG  11          1HG       ARG  11  -5.509  10.564 -13.336
   72   2HG   ARG  11          2HG       ARG  11  -7.268  10.416 -13.354
   73   1HD   ARG  11          1HD       ARG  11  -7.033  10.446 -15.642
   74   2HD   ARG  11          2HD       ARG  11  -6.963  12.199 -15.456
   75    HE   ARG  11           HE       ARG  11  -4.380  10.553 -15.442
   76   1HH1  ARG  11          1HH1      ARG  11  -5.843  13.588 -16.110
   77   2HH1  ARG  11          2HH1      ARG  11  -4.718  13.926 -17.519
   78   1HH2  ARG  11          1HH2      ARG  11  -3.322  10.784 -17.459
   79   2HH2  ARG  11          2HH2      ARG  11  -3.420  12.433 -18.258
   80    H    ALA  12           H        ALA  12  -7.579  13.249 -10.022
   81    HA   ALA  12           HA       ALA  12  -7.173  16.200 -10.193
   82   1HB   ALA  12          1HB       ALA  12  -9.063  16.337  -8.582
   83   2HB   ALA  12          2HB       ALA  12  -9.449  15.259  -9.938
   84   3HB   ALA  12          3HB       ALA  12  -9.032  14.572  -8.349
   85    H    PHE  13           H        PHE  13  -6.384  13.595  -7.942
   86    HA   PHE  13           HA       PHE  13  -5.478  15.329  -5.714
   87   1HB   PHE  13          1HB       PHE  13  -6.426  13.004  -5.446
   88   2HB   PHE  13          2HB       PHE  13  -4.985  12.323  -6.155
   89    HD1  PHE  13           HD1      PHE  13  -6.559  13.416  -3.099
   90    HD2  PHE  13           HD2      PHE  13  -2.677  12.942  -4.897
   91    HE1  PHE  13           HE1      PHE  13  -5.524  13.328  -0.868
   92    HE2  PHE  13           HE2      PHE  13  -1.662  12.854  -2.658
   93    HZ   PHE  13           HZ       PHE  13  -3.079  13.043  -0.642
   94    H    LEU  14           H        LEU  14  -4.018  13.689  -8.465
   95    HA   LEU  14           HA       LEU  14  -1.182  14.515  -7.637
   96   1HB   LEU  14          1HB       LEU  14  -0.315  12.800  -9.107
   97   2HB   LEU  14          2HB       LEU  14  -1.868  12.531  -9.868
   98    HG   LEU  14           HG       LEU  14  -2.613  11.793  -7.365
   99   1HD1  LEU  14          1HD1      LEU  14  -2.144   9.427  -8.010
  100   2HD1  LEU  14          2HD1      LEU  14  -2.746  10.348  -9.401
  101   3HD1  LEU  14          3HD1      LEU  14  -1.010   9.968  -9.275
  102   1HD2  LEU  14          1HD2      LEU  14   0.423  11.196  -7.353
  103   2HD2  LEU  14          2HD2      LEU  14  -0.436  12.288  -6.239
  104   3HD2  LEU  14          3HD2      LEU  14  -0.767  10.550  -6.195
  105    H    SER  15           H        SER  15  -0.669  16.390  -8.449
  106    HA   SER  15           HA       SER  15  -1.889  17.725 -10.760
  107   1HB   SER  15          1HB       SER  15  -0.606  18.736  -8.691
  108   2HB   SER  15          2HB       SER  15  -0.557  19.557 -10.253
  109    HG   SER  15           HG       SER  15   1.474  19.206 -10.355
  110    H    GLU  16           H        GLU  16   0.206  18.762 -12.198
  111    HA   GLU  16           HA       GLU  16   0.780  16.597 -14.157
  112   1HB   GLU  16          1HB       GLU  16   1.347  19.589 -14.104
  113   2HB   GLU  16          2HB       GLU  16   0.209  18.703 -15.101
  114   1HG   GLU  16          1HG       GLU  16   3.278  18.467 -15.367
  115   2HG   GLU  16          2HG       GLU  16   2.101  17.697 -16.416
  116    H    GLU  17           H        GLU  17   2.538  18.419 -11.718
  117    HA   GLU  17           HA       GLU  17   5.265  17.470 -12.542
  118   1HB   GLU  17          1HB       GLU  17   6.170  18.745 -10.701
  119   2HB   GLU  17          2HB       GLU  17   4.609  18.901  -9.919
  120   1HG   GLU  17          1HG       GLU  17   4.162  20.080 -12.469
  121   2HG   GLU  17          2HG       GLU  17   5.821  20.527 -12.112
  122    H    MET  18           H        MET  18   2.795  16.708 -10.144
  123    HA   MET  18           HA       MET  18   4.294  14.779  -8.478
  124   1HB   MET  18          1HB       MET  18   2.008  13.903  -7.804
  125   2HB   MET  18          2HB       MET  18   1.271  14.979  -8.977
  126   1HG   MET  18          1HG       MET  18   1.054  16.352  -7.125
  127   2HG   MET  18          2HG       MET  18   2.681  16.872  -7.594
  128   1HE   MET  18          1HE       MET  18   2.104  17.534  -4.721
  129   2HE   MET  18          2HE       MET  18   3.454  16.779  -3.824
  130   3HE   MET  18          3HE       MET  18   3.766  17.586  -5.389
  131    H    ILE  19           H        ILE  19   2.394  14.601 -11.459
  132    HA   ILE  19           HA       ILE  19   2.334  11.638 -11.667
  133    HB   ILE  19           HB       ILE  19   1.346  13.909 -13.313
  134   1HG1  ILE  19          1HG1      ILE  19   0.327  11.165 -12.419
  135   2HG1  ILE  19          2HG1      ILE  19  -0.447  11.944 -13.782
  136   1HG2  ILE  19          1HG2      ILE  19   1.128  12.627 -15.457
  137   2HG2  ILE  19          2HG2      ILE  19   2.829  12.866 -15.062
  138   3HG2  ILE  19          3HG2      ILE  19   2.074  11.282 -14.775
  139   1HD1  ILE  19          1HD1      ILE  19  -1.103  13.920 -12.436
  140   2HD1  ILE  19          2HD1      ILE  19  -1.651  12.422 -11.657
  141   3HD1  ILE  19          3HD1      ILE  19  -0.226  13.276 -11.020
  142    H    ALA  20           H        ALA  20   4.396  14.274 -12.795
  143    HA   ALA  20           HA       ALA  20   6.057  12.941 -14.736
  144   1HB   ALA  20          1HB       ALA  20   7.736  14.727 -14.290
  145   2HB   ALA  20          2HB       ALA  20   6.095  15.393 -14.407
  146   3HB   ALA  20          3HB       ALA  20   6.872  15.213 -12.813
  147    H    GLU  21           H        GLU  21   6.254  13.027 -11.199
  148    HA   GLU  21           HA       GLU  21   8.940  12.018 -10.778
  149   1HB   GLU  21          1HB       GLU  21   6.489  11.673  -8.970
  150   2HB   GLU  21          2HB       GLU  21   8.136  11.312  -8.492
  151   1HG   GLU  21          1HG       GLU  21   8.741  13.778  -8.918
  152   2HG   GLU  21          2HG       GLU  21   7.054  14.092  -9.285
  153    H    PHE  22           H        PHE  22   5.849  10.404 -11.343
  154    HA   PHE  22           HA       PHE  22   6.933   7.620 -10.943
  155   1HB   PHE  22          1HB       PHE  22   4.142   8.405 -11.975
  156   2HB   PHE  22          2HB       PHE  22   4.653   6.839 -11.406
  157    HD1  PHE  22           HD1      PHE  22   5.101   6.412  -8.950
  158    HD2  PHE  22           HD2      PHE  22   3.534  10.178 -10.326
  159    HE1  PHE  22           HE1      PHE  22   4.572   7.050  -6.634
  160    HE2  PHE  22           HE2      PHE  22   3.007  10.794  -8.002
  161    HZ   PHE  22           HZ       PHE  22   3.571   9.258  -6.151
  162    H    LYS  23           H        LYS  23   6.265   9.875 -13.532
  163    HA   LYS  23           HA       LYS  23   5.905   8.298 -15.880
  164   1HB   LYS  23          1HB       LYS  23   6.823  11.031 -15.336
  165   2HB   LYS  23          2HB       LYS  23   7.817  10.347 -16.604
  166   1HG   LYS  23          1HG       LYS  23   4.785  10.095 -16.861
  167   2HG   LYS  23          2HG       LYS  23   6.016  10.104 -18.113
  168   1HD   LYS  23          1HD       LYS  23   4.829  12.479 -16.612
  169   2HD   LYS  23          2HD       LYS  23   6.470  12.627 -17.251
  170   1HE   LYS  23          1HE       LYS  23   5.773  12.504 -19.517
  171   2HE   LYS  23          2HE       LYS  23   4.325  11.558 -19.148
  172   1HZ   LYS  23          1HZ       LYS  23   3.434  13.617 -19.522
  173   2HZ   LYS  23          2HZ       LYS  23   4.731  14.460 -18.942
  174   3HZ   LYS  23          3HZ       LYS  23   3.661  13.764 -17.893
  175    H    ALA  24           H        ALA  24   8.877   8.975 -14.081
  176    HA   ALA  24           HA       ALA  24  10.836   7.889 -15.980
  177   1HB   ALA  24          1HB       ALA  24  12.409   7.877 -14.053
  178   2HB   ALA  24          2HB       ALA  24  11.510   9.404 -14.141
  179   3HB   ALA  24          3HB       ALA  24  11.071   8.183 -12.919
  180    H    ALA  25           H        ALA  25   9.400   6.505 -13.003
  181    HA   ALA  25           HA       ALA  25  10.524   3.770 -13.552
  182   1HB   ALA  25          1HB       ALA  25   9.608   3.192 -11.311
  183   2HB   ALA  25          2HB       ALA  25  10.571   4.679 -11.243
  184   3HB   ALA  25          3HB       ALA  25   8.792   4.770 -11.198
  185    H    PHE  26           H        PHE  26   8.174   5.148 -15.110
  186    HA   PHE  26           HA       PHE  26   5.967   3.094 -14.858
  187   1HB   PHE  26          1HB       PHE  26   5.239   5.366 -15.326
  188   2HB   PHE  26          2HB       PHE  26   6.325   5.543 -16.679
  189    HD1  PHE  26           HD1      PHE  26   5.317   5.350 -18.832
  190    HD2  PHE  26           HD2      PHE  26   3.540   3.186 -15.566
  191    HE1  PHE  26           HE1      PHE  26   3.565   4.498 -20.336
  192    HE2  PHE  26           HE2      PHE  26   1.789   2.353 -17.084
  193    HZ   PHE  26           HZ       PHE  26   1.799   3.003 -19.467
  194    H    ASP  27           H        ASP  27   8.651   4.019 -16.960
  195    HA   ASP  27           HA       ASP  27   8.090   2.030 -19.117
  196   1HB   ASP  27          1HB       ASP  27   9.425   4.334 -19.283
  197   2HB   ASP  27          2HB       ASP  27   9.757   2.985 -20.344
  198    H    MET  28           H        MET  28  10.102   2.265 -16.236
  199    HA   MET  28           HA       MET  28  11.885   0.040 -16.452
  200   1HB   MET  28          1HB       MET  28  10.468   0.418 -13.785
  201   2HB   MET  28          2HB       MET  28  11.440   1.734 -14.418
  202   1HG   MET  28          1HG       MET  28  13.488   0.530 -14.230
  203   2HG   MET  28          2HG       MET  28  12.693  -1.052 -14.281
  204   1HE   MET  28          1HE       MET  28  10.666   1.508 -12.232
  205   2HE   MET  28          2HE       MET  28  11.524   1.627 -10.667
  206   3HE   MET  28          3HE       MET  28  12.243   2.354 -12.134
  207    H    PHE  29           H        PHE  29   8.454   0.089 -15.541
  208    HA   PHE  29           HA       PHE  29   8.185  -2.835 -15.042
  209   1HB   PHE  29          1HB       PHE  29   5.590  -2.093 -15.488
  210   2HB   PHE  29          2HB       PHE  29   6.250  -0.504 -15.209
  211    HD1  PHE  29           HD1      PHE  29   8.111  -0.635 -13.019
  212    HD2  PHE  29           HD2      PHE  29   4.568  -3.020 -13.566
  213    HE1  PHE  29           HE1      PHE  29   7.978  -1.016 -10.592
  214    HE2  PHE  29           HE2      PHE  29   4.460  -3.394 -11.137
  215    HZ   PHE  29           HZ       PHE  29   6.155  -2.392  -9.647
  216    H    ASP  30           H        ASP  30   7.548  -0.590 -17.721
  217    HA   ASP  30           HA       ASP  30   6.497  -2.618 -19.629
  218   1HB   ASP  30          1HB       ASP  30   7.671   0.075 -20.482
  219   2HB   ASP  30          2HB       ASP  30   6.117  -0.021 -19.685
  220    H    ALA  31           H        ALA  31   7.699  -2.838 -21.790
  221    HA   ALA  31           HA       ALA  31  10.707  -3.206 -21.452
  222   1HB   ALA  31          1HB       ALA  31  10.614  -5.569 -22.248
  223   2HB   ALA  31          2HB       ALA  31   9.741  -5.357 -20.718
  224   3HB   ALA  31          3HB       ALA  31   8.835  -5.533 -22.244
  225    H    ASP  32           H        ASP  32   8.806  -1.473 -22.998
  226    HA   ASP  32           HA       ASP  32   9.733  -2.100 -25.847
  227   1HB   ASP  32          1HB       ASP  32   7.469  -0.755 -26.450
  228   2HB   ASP  32          2HB       ASP  32   6.944  -1.375 -24.902
  229    H    GLY  33           H        GLY  33   8.006   0.601 -24.262
  230   1HA   GLY  33          1HA       GLY  33   9.978   2.573 -23.769
  231   2HA   GLY  33          2HA       GLY  33   9.853   2.605 -25.513
  232    H    GLY  34           H        GLY  34   7.543   2.313 -22.784
  233   1HA   GLY  34          1HA       GLY  34   6.273   4.998 -23.303
  234   2HA   GLY  34          2HA       GLY  34   5.826   3.868 -22.017
  235    H    GLY  35           H        GLY  35   3.702   3.693 -22.309
  236   1HA   GLY  35          1HA       GLY  35   2.606   2.450 -24.891
  237   2HA   GLY  35          2HA       GLY  35   1.892   3.959 -24.308
  238    H    ASP  36           H        ASP  36   2.910   0.873 -22.821
  239    HA   ASP  36           HA       ASP  36   0.909   0.662 -20.741
  240   1HB   ASP  36          1HB       ASP  36  -1.044   0.337 -21.794
  241   2HB   ASP  36          2HB       ASP  36  -0.446  -1.244 -22.243
  242    H    ILE  37           H        ILE  37   1.298  -1.089 -19.535
  243    HA   ILE  37           HA       ILE  37   3.418  -3.081 -20.464
  244    HB   ILE  37           HB       ILE  37   2.507  -2.660 -17.587
  245   1HG1  ILE  37          1HG1      ILE  37   5.273  -1.729 -18.135
  246   2HG1  ILE  37          2HG1      ILE  37   4.093  -0.794 -19.033
  247   1HG2  ILE  37          1HG2      ILE  37   4.466  -4.009 -16.941
  248   2HG2  ILE  37          2HG2      ILE  37   3.465  -4.917 -18.083
  249   3HG2  ILE  37          3HG2      ILE  37   4.979  -4.162 -18.639
  250   1HD1  ILE  37          1HD1      ILE  37   4.086  -1.126 -15.974
  251   2HD1  ILE  37          2HD1      ILE  37   4.504   0.327 -16.906
  252   3HD1  ILE  37          3HD1      ILE  37   2.828  -0.269 -16.904
  253    H    SER  38           H        SER  38   3.168  -5.315 -19.768
  254    HA   SER  38           HA       SER  38   0.260  -6.268 -19.528
  255   1HB   SER  38          1HB       SER  38   1.359  -6.443 -21.909
  256   2HB   SER  38          2HB       SER  38   0.437  -7.804 -21.265
  257    HG   SER  38           HG       SER  38   3.204  -7.605 -20.778
  258    H    THR  39           H        THR  39   0.983  -8.998 -19.543
  259    HA   THR  39           HA       THR  39   1.857  -9.376 -16.705
  260    HB   THR  39           HB       THR  39   1.638 -11.955 -17.671
  261    HG1  THR  39           HG1      THR  39   0.946 -11.448 -19.638
  262   1HG2  THR  39          1HG2      THR  39  -0.591 -12.058 -16.644
  263   2HG2  THR  39          2HG2      THR  39   0.458 -11.043 -15.627
  264   3HG2  THR  39          3HG2      THR  39  -0.760 -10.288 -16.688
  265    H    LYS  40           H        LYS  40   3.077 -10.121 -19.960
  266    HA   LYS  40           HA       LYS  40   5.510 -11.528 -19.166
  267   1HB   LYS  40          1HB       LYS  40   4.736 -10.070 -21.736
  268   2HB   LYS  40          2HB       LYS  40   4.630 -11.785 -21.439
  269   1HG   LYS  40          1HG       LYS  40   7.324 -11.509 -21.145
  270   2HG   LYS  40          2HG       LYS  40   7.062  -9.995 -21.970
  271   1HD   LYS  40          1HD       LYS  40   7.796 -12.103 -23.391
  272   2HD   LYS  40          2HD       LYS  40   6.162 -12.653 -23.158
  273   1HE   LYS  40          1HE       LYS  40   5.839  -9.992 -24.141
  274   2HE   LYS  40          2HE       LYS  40   7.098 -10.706 -25.140
  275   1HZ   LYS  40          1HZ       LYS  40   5.199 -11.388 -26.209
  276   2HZ   LYS  40          2HZ       LYS  40   4.282 -11.501 -24.839
  277   3HZ   LYS  40          3HZ       LYS  40   5.367 -12.691 -25.208
  278    H    GLU  41           H        GLU  41   5.194  -8.246 -20.567
  279    HA   GLU  41           HA       GLU  41   7.840  -7.267 -20.074
  280   1HB   GLU  41          1HB       GLU  41   7.089  -5.524 -21.197
  281   2HB   GLU  41          2HB       GLU  41   6.239  -4.966 -19.772
  282   1HG   GLU  41          1HG       GLU  41   4.764  -7.016 -21.448
  283   2HG   GLU  41          2HG       GLU  41   4.150  -5.647 -20.547
  284    H    LEU  42           H        LEU  42   4.969  -7.142 -17.983
  285    HA   LEU  42           HA       LEU  42   5.985  -5.497 -15.820
  286   1HB   LEU  42          1HB       LEU  42   3.619  -5.941 -15.887
  287   2HB   LEU  42          2HB       LEU  42   3.838  -7.677 -15.891
  288    HG   LEU  42           HG       LEU  42   5.035  -6.882 -13.436
  289   1HD1  LEU  42          1HD1      LEU  42   3.291  -5.472 -12.311
  290   2HD1  LEU  42          2HD1      LEU  42   4.077  -4.593 -13.631
  291   3HD1  LEU  42          3HD1      LEU  42   2.441  -5.259 -13.863
  292   1HD2  LEU  42          1HD2      LEU  42   2.166  -7.945 -13.904
  293   2HD2  LEU  42          2HD2      LEU  42   3.638  -8.938 -13.759
  294   3HD2  LEU  42          3HD2      LEU  42   3.066  -8.002 -12.366
  295    H    GLY  43           H        GLY  43   6.133  -8.998 -16.391
  296   1HA   GLY  43          1HA       GLY  43   7.190  -9.985 -13.913
  297   2HA   GLY  43          2HA       GLY  43   7.534 -10.736 -15.477
  298    H    THR  44           H        THR  44   8.830  -8.420 -16.627
  299    HA   THR  44           HA       THR  44  11.570  -9.096 -16.194
  300    HB   THR  44           HB       THR  44  10.299  -6.623 -17.405
  301    HG1  THR  44           HG1      THR  44  11.627  -7.537 -19.152
  302   1HG2  THR  44          1HG2      THR  44  12.538  -5.818 -18.174
  303   2HG2  THR  44          2HG2      THR  44  12.380  -5.688 -16.410
  304   3HG2  THR  44          3HG2      THR  44  13.343  -7.009 -17.121
  305    H    VAL  45           H        VAL  45   9.728  -6.379 -14.804
  306    HA   VAL  45           HA       VAL  45  11.926  -5.232 -13.224
  307    HB   VAL  45           HB       VAL  45   9.121  -4.587 -13.681
  308   1HG1  VAL  45          1HG1      VAL  45   8.557  -3.515 -11.500
  309   2HG1  VAL  45          2HG1      VAL  45   8.713  -5.265 -11.302
  310   3HG1  VAL  45          3HG1      VAL  45  10.025  -4.198 -10.753
  311   1HG2  VAL  45          1HG2      VAL  45  11.427  -2.852 -12.571
  312   2HG2  VAL  45          2HG2      VAL  45  11.001  -3.040 -14.288
  313   3HG2  VAL  45          3HG2      VAL  45   9.865  -2.250 -13.186
  314    H    MET  46           H        MET  46   9.418  -7.646 -12.635
  315    HA   MET  46           HA       MET  46   9.577  -7.890  -9.739
  316   1HB   MET  46          1HB       MET  46   8.896 -10.462 -10.427
  317   2HB   MET  46          2HB       MET  46   8.531  -9.660 -11.943
  318   1HG   MET  46          1HG       MET  46   7.351  -7.998  -9.886
  319   2HG   MET  46          2HG       MET  46   6.531  -8.981 -11.110
  320   1HE   MET  46          1HE       MET  46   6.313  -8.238  -7.596
  321   2HE   MET  46          2HE       MET  46   6.582  -9.728  -6.645
  322   3HE   MET  46          3HE       MET  46   7.973  -8.876  -7.377
  323    NH1  ARG  47           NH1      ARG  47  14.709 -13.162 -17.429
  324    NH2  ARG  47           NH2      ARG  47  16.566 -13.500 -16.163
  325    H    ARG  47           H        ARG  47  11.470  -9.282 -12.368
  326    HA   ARG  47           HA       ARG  47  12.895 -11.421 -11.020
  327   1HB   ARG  47          1HB       ARG  47  14.762 -10.911 -12.781
  328   2HB   ARG  47          2HB       ARG  47  13.688  -9.656 -13.385
  329   1HG   ARG  47          1HG       ARG  47  11.856 -11.401 -13.725
  330   2HG   ARG  47          2HG       ARG  47  12.996 -12.650 -13.223
  331   1HD   ARG  47          1HD       ARG  47  12.760 -12.315 -15.792
  332   2HD   ARG  47          2HD       ARG  47  13.535 -10.751 -15.590
  333    HE   ARG  47           HE       ARG  47  15.446 -12.347 -14.383
  334   1HH1  ARG  47          1HH1      ARG  47  13.762 -12.772 -17.489
  335   2HH1  ARG  47          2HH1      ARG  47  15.217 -13.660 -18.169
  336   1HH2  ARG  47          1HH2      ARG  47  17.038 -13.369 -15.261
  337   2HH2  ARG  47          2HH2      ARG  47  16.944 -13.974 -16.991
  338    H    MET  48           H        MET  48  13.423  -7.935 -11.146
  339    HA   MET  48           HA       MET  48  15.930  -8.007  -9.451
  340   1HB   MET  48          1HB       MET  48  14.402  -5.807 -10.879
  341   2HB   MET  48          2HB       MET  48  15.339  -5.365  -9.463
  342   1HG   MET  48          1HG       MET  48  17.154  -6.971 -10.975
  343   2HG   MET  48          2HG       MET  48  16.288  -6.012 -12.188
  344   1HE   MET  48          1HE       MET  48  15.421  -3.468 -10.109
  345   2HE   MET  48          2HE       MET  48  16.710  -2.313 -10.558
  346   3HE   MET  48          3HE       MET  48  15.861  -3.239 -11.830
  347    H    LEU  49           H        LEU  49  14.749  -9.260  -7.817
  348    HA   LEU  49           HA       LEU  49  13.792  -7.474  -5.586
  349   1HB   LEU  49          1HB       LEU  49  11.768  -9.064  -5.161
  350   2HB   LEU  49          2HB       LEU  49  11.948  -9.597  -6.818
  351    HG   LEU  49           HG       LEU  49  11.489  -7.307  -7.679
  352   1HD1  LEU  49          1HD1      LEU  49   9.085  -7.151  -7.025
  353   2HD1  LEU  49          2HD1      LEU  49   9.552  -8.840  -7.293
  354   3HD1  LEU  49          3HD1      LEU  49   9.365  -8.225  -5.632
  355   1HD2  LEU  49          1HD2      LEU  49  11.171  -6.446  -4.723
  356   2HD2  LEU  49          2HD2      LEU  49  12.441  -5.898  -5.844
  357   3HD2  LEU  49          3HD2      LEU  49  10.755  -5.455  -6.144
  358    H    GLY  50           H        GLY  50  13.317 -10.946  -6.197
  359   1HA   GLY  50          1HA       GLY  50  15.619 -11.756  -4.371
  360   2HA   GLY  50          2HA       GLY  50  13.991 -12.106  -3.776
  361    H    GLN  51           H        GLN  51  12.583 -13.430  -5.068
  362    HA   GLN  51           HA       GLN  51  13.983 -15.835  -6.230
  363   1HB   GLN  51          1HB       GLN  51  11.953 -17.001  -6.027
  364   2HB   GLN  51          2HB       GLN  51  10.964 -15.563  -6.200
  365   1HG   GLN  51          1HG       GLN  51  10.662 -15.696  -3.954
  366   2HG   GLN  51          2HG       GLN  51  12.238 -14.948  -3.818
  367   1HE2  GLN  51          1HE2      GLN  51  11.738 -18.858  -2.628
  368   2HE2  GLN  51          2HE2      GLN  51  10.378 -17.819  -3.291
  369    H    ASN  52           H        ASN  52  12.150 -16.643  -8.123
  370    HA   ASN  52           HA       ASN  52  12.017 -14.448 -10.217
  371   1HB   ASN  52          1HB       ASN  52  14.097 -15.830 -10.584
  372   2HB   ASN  52          2HB       ASN  52  13.125 -17.270 -10.798
  373   1HD2  ASN  52          1HD2      ASN  52  13.825 -16.041 -14.241
  374   2HD2  ASN  52          2HD2      ASN  52  14.744 -16.722 -12.806
  375    HA   PRO  53           HA       PRO  53   7.697 -16.536  -9.790
  376   1HB   PRO  53          1HB       PRO  53   6.197 -14.718 -10.130
  377   2HB   PRO  53          2HB       PRO  53   7.178 -14.052 -11.444
  378   1HG   PRO  53          1HG       PRO  53   7.834 -12.549  -9.786
  379   2HG   PRO  53          2HG       PRO  53   7.619 -13.695  -8.442
  380   1HD   PRO  53          1HD       PRO  53   9.985 -13.965  -8.643
  381   2HD   PRO  53          2HD       PRO  53  10.012 -13.317 -10.309
  382    H    THR  54           H        THR  54   6.217 -17.182 -11.560
  383    HA   THR  54           HA       THR  54   7.689 -17.791 -14.174
  384    HB   THR  54           HB       THR  54   6.926 -19.720 -12.534
  385    HG1  THR  54           HG1      THR  54   7.302 -19.453 -15.142
  386   1HG2  THR  54          1HG2      THR  54   4.755 -20.756 -13.106
  387   2HG2  THR  54          2HG2      THR  54   4.484 -19.147 -12.400
  388   3HG2  THR  54          3HG2      THR  54   4.328 -19.386 -14.159
  389    H    LYS  55           H        LYS  55   6.199 -18.062 -16.047
  390    HA   LYS  55           HA       LYS  55   4.811 -15.514 -16.519
  391   1HB   LYS  55          1HB       LYS  55   6.059 -16.926 -18.277
  392   2HB   LYS  55          2HB       LYS  55   4.701 -18.032 -18.297
  393   1HG   LYS  55          1HG       LYS  55   4.326 -15.060 -18.910
  394   2HG   LYS  55          2HG       LYS  55   4.880 -16.177 -20.145
  395   1HD   LYS  55          1HD       LYS  55   2.129 -15.729 -19.101
  396   2HD   LYS  55          2HD       LYS  55   2.655 -16.458 -20.611
  397   1HE   LYS  55          1HE       LYS  55   2.893 -18.102 -18.057
  398   2HE   LYS  55          2HE       LYS  55   1.302 -17.904 -18.788
  399   1HZ   LYS  55          1HZ       LYS  55   2.156 -19.819 -19.770
  400   2HZ   LYS  55          2HZ       LYS  55   3.695 -19.236 -19.917
  401   3HZ   LYS  55          3HZ       LYS  55   2.508 -18.699 -20.932
  402    H    GLU  56           H        GLU  56   3.793 -18.825 -15.837
  403    HA   GLU  56           HA       GLU  56   0.920 -18.516 -16.349
  404   1HB   GLU  56          1HB       GLU  56   2.046 -20.578 -14.407
  405   2HB   GLU  56          2HB       GLU  56   2.375 -20.699 -16.124
  406   1HG   GLU  56          1HG       GLU  56   0.176 -21.317 -16.656
  407   2HG   GLU  56          2HG       GLU  56  -0.540 -20.335 -15.390
  408    H    GLU  57           H        GLU  57   2.977 -18.161 -13.487
  409    HA   GLU  57           HA       GLU  57   0.835 -17.758 -11.477
  410   1HB   GLU  57          1HB       GLU  57   3.711 -16.774 -11.205
  411   2HB   GLU  57          2HB       GLU  57   3.271 -18.460 -11.033
  412   1HG   GLU  57          1HG       GLU  57   1.553 -17.599  -9.170
  413   2HG   GLU  57          2HG       GLU  57   3.258 -17.794  -8.783
  414    H    LEU  58           H        LEU  58   2.679 -15.708 -13.669
  415    HA   LEU  58           HA       LEU  58   2.137 -13.084 -12.562
  416   1HB   LEU  58          1HB       LEU  58   2.987 -14.147 -15.261
  417   2HB   LEU  58          2HB       LEU  58   2.352 -12.515 -15.226
  418    HG   LEU  58           HG       LEU  58   4.550 -13.334 -13.250
  419   1HD1  LEU  58          1HD1      LEU  58   6.297 -12.552 -14.897
  420   2HD1  LEU  58          2HD1      LEU  58   5.478 -14.011 -15.474
  421   3HD1  LEU  58          3HD1      LEU  58   5.055 -12.427 -16.169
  422   1HD2  LEU  58          1HD2      LEU  58   3.848 -10.629 -14.564
  423   2HD2  LEU  58          2HD2      LEU  58   3.431 -11.127 -12.906
  424   3HD2  LEU  58          3HD2      LEU  58   5.131 -10.908 -13.360
  425    H    ASP  59           H        ASP  59   0.289 -15.232 -14.654
  426    HA   ASP  59           HA       ASP  59  -1.757 -13.423 -15.636
  427   1HB   ASP  59          1HB       ASP  59  -1.362 -15.734 -16.561
  428   2HB   ASP  59          2HB       ASP  59  -2.077 -16.434 -15.127
  429    H    ALA  60           H        ALA  60  -1.525 -15.347 -12.668
  430    HA   ALA  60           HA       ALA  60  -4.276 -14.876 -11.690
  431   1HB   ALA  60          1HB       ALA  60  -3.465 -15.881  -9.560
  432   2HB   ALA  60          2HB       ALA  60  -2.975 -16.851 -10.963
  433   3HB   ALA  60          3HB       ALA  60  -1.782 -15.818 -10.135
  434    H    ILE  61           H        ILE  61  -1.151 -13.295 -11.276
  435    HA   ILE  61           HA       ILE  61  -1.779 -11.552  -9.001
  436    HB   ILE  61           HB       ILE  61   0.448 -11.755 -10.966
  437   1HG1  ILE  61          1HG1      ILE  61   1.447 -12.465  -9.051
  438   2HG1  ILE  61          2HG1      ILE  61   0.042 -12.028  -8.101
  439   1HG2  ILE  61          1HG2      ILE  61   1.413  -9.483 -10.506
  440   2HG2  ILE  61          2HG2      ILE  61  -0.117  -9.343 -11.370
  441   3HG2  ILE  61          3HG2      ILE  61  -0.061  -9.015  -9.622
  442   1HD1  ILE  61          1HD1      ILE  61   0.886  -9.731  -7.691
  443   2HD1  ILE  61          2HD1      ILE  61   2.102 -10.941  -7.227
  444   3HD1  ILE  61          3HD1      ILE  61   2.293 -10.036  -8.747
  445    H    ILE  62           H        ILE  62  -1.878 -11.089 -12.537
  446    HA   ILE  62           HA       ILE  62  -2.805  -8.302 -12.546
  447    HB   ILE  62           HB       ILE  62  -2.728 -10.478 -14.655
  448   1HG1  ILE  62          1HG1      ILE  62  -0.616  -9.310 -14.349
  449   2HG1  ILE  62          2HG1      ILE  62  -1.386  -7.738 -14.283
  450   1HG2  ILE  62          1HG2      ILE  62  -3.741  -8.950 -16.371
  451   2HG2  ILE  62          2HG2      ILE  62  -4.919  -9.326 -15.115
  452   3HG2  ILE  62          3HG2      ILE  62  -4.105  -7.745 -15.112
  453   1HD1  ILE  62          1HD1      ILE  62  -1.926  -7.766 -16.703
  454   2HD1  ILE  62          2HD1      ILE  62  -0.198  -8.079 -16.443
  455   3HD1  ILE  62          3HD1      ILE  62  -1.286  -9.426 -16.851
  456    H    GLU  63           H        GLU  63  -4.385 -11.448 -12.367
  457    HA   GLU  63           HA       GLU  63  -7.126 -10.946 -12.800
  458   1HB   GLU  63          1HB       GLU  63  -6.327 -12.562 -10.348
  459   2HB   GLU  63          2HB       GLU  63  -5.883 -13.121 -11.949
  460   1HG   GLU  63          1HG       GLU  63  -8.674 -12.832 -10.726
  461   2HG   GLU  63          2HG       GLU  63  -8.513 -12.784 -12.474
  462    H    GLU  64           H        GLU  64  -5.405 -10.467  -9.695
  463    HA   GLU  64           HA       GLU  64  -7.695  -9.191  -8.327
  464   1HB   GLU  64          1HB       GLU  64  -5.436  -8.505  -6.810
  465   2HB   GLU  64          2HB       GLU  64  -4.925  -9.985  -7.599
  466   1HG   GLU  64          1HG       GLU  64  -7.239  -9.565  -5.637
  467   2HG   GLU  64          2HG       GLU  64  -5.882 -10.672  -5.512
  468    H    VAL  65           H        VAL  65  -4.782  -8.067  -9.990
  469    HA   VAL  65           HA       VAL  65  -5.458  -5.145  -9.429
  470    HB   VAL  65           HB       VAL  65  -3.056  -4.939 -10.686
  471   1HG1  VAL  65          1HG1      VAL  65  -2.032  -4.662  -8.421
  472   2HG1  VAL  65          2HG1      VAL  65  -3.642  -3.920  -8.479
  473   3HG1  VAL  65          3HG1      VAL  65  -3.417  -5.485  -7.662
  474   1HG2  VAL  65          1HG2      VAL  65  -2.815  -7.644  -9.197
  475   2HG2  VAL  65          2HG2      VAL  65  -2.625  -7.386 -10.948
  476   3HG2  VAL  65          3HG2      VAL  65  -1.460  -6.674  -9.823
  477    H    ASP  66           H        ASP  66  -7.272  -6.166 -11.013
  478    HA   ASP  66           HA       ASP  66  -7.053  -4.637 -13.541
  479   1HB   ASP  66          1HB       ASP  66  -7.142  -7.673 -13.967
  480   2HB   ASP  66          2HB       ASP  66  -5.658  -6.751 -14.039
  481    H    GLU  67           H        GLU  67  -8.770  -4.233 -11.687
  482    HA   GLU  67           HA       GLU  67 -11.334  -5.794 -11.977
  483   1HB   GLU  67          1HB       GLU  67 -12.221  -4.224 -10.245
  484   2HB   GLU  67          2HB       GLU  67 -10.725  -3.310 -10.279
  485   1HG   GLU  67          1HG       GLU  67 -10.037  -4.646  -8.555
  486   2HG   GLU  67          2HG       GLU  67  -9.773  -5.902  -9.752
  487    H    ASP  68           H        ASP  68 -10.398  -4.604 -14.370
  488    HA   ASP  68           HA       ASP  68 -12.504  -2.460 -14.932
  489   1HB   ASP  68          1HB       ASP  68 -10.304  -1.331 -14.834
  490   2HB   ASP  68          2HB       ASP  68 -11.038  -1.235 -16.418
  491    H    GLY  69           H        GLY  69 -10.287  -4.869 -16.376
  492   1HA   GLY  69          1HA       GLY  69 -12.359  -5.443 -18.575
  493   2HA   GLY  69          2HA       GLY  69 -11.604  -6.775 -17.697
  494    H    SER  70           H        SER  70 -10.016  -3.780 -18.703
  495    HA   SER  70           HA       SER  70  -8.968  -4.292 -21.254
  496   1HB   SER  70          1HB       SER  70  -7.402  -2.587 -20.905
  497   2HB   SER  70          2HB       SER  70  -8.651  -2.214 -19.714
  498    HG   SER  70           HG       SER  70  -6.887  -2.153 -18.553
  499    H    GLY  71           H        GLY  71  -7.590  -5.413 -18.157
  500   1HA   GLY  71          1HA       GLY  71  -6.375  -7.859 -19.390
  501   2HA   GLY  71          2HA       GLY  71  -6.284  -7.415 -17.680
  502    H    THR  72           H        THR  72  -5.306  -4.721 -18.196
  503    HA   THR  72           HA       THR  72  -2.367  -5.355 -18.603
  504    HB   THR  72           HB       THR  72  -1.986  -3.354 -20.044
  505    HG1  THR  72           HG1      THR  72  -4.443  -3.194 -21.064
  506   1HG2  THR  72          1HG2      THR  72  -2.734  -4.264 -22.204
  507   2HG2  THR  72          2HG2      THR  72  -2.147  -5.601 -21.191
  508   3HG2  THR  72          3HG2      THR  72  -3.898  -5.355 -21.420
  509    H    ILE  73           H        ILE  73  -1.294  -2.907 -18.332
  510    HA   ILE  73           HA       ILE  73  -2.493  -1.578 -15.856
  511    HB   ILE  73           HB       ILE  73   0.424  -2.498 -16.011
  512   1HG1  ILE  73          1HG1      ILE  73  -1.473  -3.507 -13.852
  513   2HG1  ILE  73          2HG1      ILE  73  -1.643  -4.204 -15.449
  514   1HG2  ILE  73          1HG2      ILE  73   0.679  -1.606 -13.699
  515   2HG2  ILE  73          2HG2      ILE  73   0.139  -0.310 -14.774
  516   3HG2  ILE  73          3HG2      ILE  73  -1.019  -1.078 -13.663
  517   1HD1  ILE  73          1HD1      ILE  73   0.950  -4.290 -13.798
  518   2HD1  ILE  73          2HD1      ILE  73  -0.163  -5.631 -14.142
  519   3HD1  ILE  73          3HD1      ILE  73   0.781  -4.906 -15.465
  520    H    ASP  74           H        ASP  74  -3.030  -0.385 -17.976
  521    HA   ASP  74           HA       ASP  74  -1.022   1.228 -19.367
  522   1HB   ASP  74          1HB       ASP  74  -2.734   2.226 -20.553
  523   2HB   ASP  74          2HB       ASP  74  -3.789   2.388 -19.168
  524    H    PHE  75           H        PHE  75  -0.729   3.539 -19.209
  525    HA   PHE  75           HA       PHE  75   0.180   4.540 -16.696
  526   1HB   PHE  75          1HB       PHE  75   0.426   5.513 -19.174
  527   2HB   PHE  75          2HB       PHE  75  -0.967   6.477 -18.766
  528    HD1  PHE  75           HD1      PHE  75   2.073   5.481 -16.693
  529    HD2  PHE  75           HD2      PHE  75  -0.247   8.700 -18.360
  530    HE1  PHE  75           HE1      PHE  75   3.461   7.118 -15.490
  531    HE2  PHE  75           HE2      PHE  75   1.159  10.322 -17.154
  532    HZ   PHE  75           HZ       PHE  75   2.995   9.537 -15.701
  533    H    GLU  76           H        GLU  76  -3.059   4.456 -18.030
  534    HA   GLU  76           HA       GLU  76  -4.236   6.248 -15.891
  535   1HB   GLU  76          1HB       GLU  76  -6.449   5.555 -17.183
  536   2HB   GLU  76          2HB       GLU  76  -5.384   6.831 -17.733
  537   1HG   GLU  76          1HG       GLU  76  -4.274   4.942 -19.258
  538   2HG   GLU  76          2HG       GLU  76  -5.720   4.024 -18.894
  539    H    GLU  77           H        GLU  77  -3.013   4.007 -14.884
  540    HA   GLU  77           HA       GLU  77  -5.209   2.749 -13.304
  541   1HB   GLU  77          1HB       GLU  77  -5.484   1.161 -14.997
  542   2HB   GLU  77          2HB       GLU  77  -3.784   1.102 -15.403
  543   1HG   GLU  77          1HG       GLU  77  -4.612   0.102 -12.642
  544   2HG   GLU  77          2HG       GLU  77  -3.247  -0.400 -13.631
  545    H    PHE  78           H        PHE  78  -1.787   2.700 -14.253
  546    HA   PHE  78           HA       PHE  78  -0.576   1.510 -11.949
  547   1HB   PHE  78          1HB       PHE  78   0.586   2.239 -14.132
  548   2HB   PHE  78          2HB       PHE  78   0.637   3.873 -13.521
  549    HD1  PHE  78           HD1      PHE  78   3.106   3.997 -13.475
  550    HD2  PHE  78           HD2      PHE  78   1.115   0.841 -11.334
  551    HE1  PHE  78           HE1      PHE  78   5.222   3.397 -12.369
  552    HE2  PHE  78           HE2      PHE  78   3.239   0.256 -10.237
  553    HZ   PHE  78           HZ       PHE  78   5.294   1.529 -10.752
  554    H    LEU  79           H        LEU  79  -1.504   4.896 -12.519
  555    HA   LEU  79           HA       LEU  79  -0.490   6.036 -10.015
  556   1HB   LEU  79          1HB       LEU  79  -2.915   7.197 -11.469
  557   2HB   LEU  79          2HB       LEU  79  -1.696   8.038 -10.536
  558    HG   LEU  79           HG       LEU  79  -1.158   6.705 -13.262
  559   1HD1  LEU  79          1HD1      LEU  79   0.641   8.650 -11.684
  560   2HD1  LEU  79          2HD1      LEU  79   0.871   6.892 -11.731
  561   3HD1  LEU  79          3HD1      LEU  79   1.027   7.847 -13.227
  562   1HD2  LEU  79          1HD2      LEU  79  -1.197   8.946 -14.272
  563   2HD2  LEU  79          2HD2      LEU  79  -2.726   8.747 -13.381
  564   3HD2  LEU  79          3HD2      LEU  79  -1.425   9.726 -12.686
  565    H    VAL  80           H        VAL  80  -3.666   4.766 -10.994
  566    HA   VAL  80           HA       VAL  80  -5.191   5.347  -8.569
  567    HB   VAL  80           HB       VAL  80  -5.610   3.082 -10.585
  568   1HG1  VAL  80          1HG1      VAL  80  -7.155   5.741 -10.385
  569   2HG1  VAL  80          2HG1      VAL  80  -5.793   5.498 -11.487
  570   3HG1  VAL  80          3HG1      VAL  80  -7.260   4.508 -11.668
  571   1HG2  VAL  80          1HG2      VAL  80  -7.895   2.812  -9.739
  572   2HG2  VAL  80          2HG2      VAL  80  -6.801   2.624  -8.349
  573   3HG2  VAL  80          3HG2      VAL  80  -7.692   4.138  -8.567
  574    H    MET  81           H        MET  81  -2.871   2.857  -9.442
  575    HA   MET  81           HA       MET  81  -3.230   0.846  -7.427
  576   1HB   MET  81          1HB       MET  81  -1.364   1.172  -9.399
  577   2HB   MET  81          2HB       MET  81  -0.378   1.641  -8.026
  578   1HG   MET  81          1HG       MET  81  -0.524  -0.529  -6.988
  579   2HG   MET  81          2HG       MET  81  -1.942  -0.998  -7.941
  580   1HE   MET  81          1HE       MET  81  -1.555  -0.322 -10.853
  581   2HE   MET  81          2HE       MET  81  -0.541  -1.627 -11.538
  582   3HE   MET  81          3HE       MET  81  -1.861  -2.029 -10.403
  583    H    MET  82           H        MET  82  -0.824   3.487  -7.203
  584    HA   MET  82           HA       MET  82  -0.184   3.102  -4.393
  585   1HB   MET  82          1HB       MET  82   1.272   4.865  -4.580
  586   2HB   MET  82          2HB       MET  82   1.069   4.481  -6.280
  587   1HG   MET  82          1HG       MET  82  -0.738   6.615  -5.023
  588   2HG   MET  82          2HG       MET  82  -0.256   6.417  -6.712
  589   1HE   MET  82          1HE       MET  82   0.554   7.375  -3.171
  590   2HE   MET  82          2HE       MET  82   1.904   8.542  -3.290
  591   3HE   MET  82          3HE       MET  82   2.248   6.790  -3.200
  592    H    VAL  83           H        VAL  83  -2.621   5.075  -6.017
  593    HA   VAL  83           HA       VAL  83  -3.354   6.855  -3.811
  594    HB   VAL  83           HB       VAL  83  -4.412   6.297  -6.508
  595   1HG1  VAL  83          1HG1      VAL  83  -6.724   7.175  -6.143
  596   2HG1  VAL  83          2HG1      VAL  83  -6.504   5.633  -5.305
  597   3HG1  VAL  83          3HG1      VAL  83  -6.479   7.151  -4.377
  598   1HG2  VAL  83          1HG2      VAL  83  -4.472   8.859  -4.780
  599   2HG2  VAL  83          2HG2      VAL  83  -3.211   8.432  -5.959
  600   3HG2  VAL  83          3HG2      VAL  83  -4.858   8.759  -6.517
  601    NH1  ARG  84           NH1      ARG  84  -7.216  -1.719  -7.802
  602    NH2  ARG  84           NH2      ARG  84  -7.313  -2.903  -5.866
  603    H    ARG  84           H        ARG  84  -4.318   3.602  -4.754
  604    HA   ARG  84           HA       ARG  84  -6.737   3.354  -3.025
  605   1HB   ARG  84          1HB       ARG  84  -5.118   1.470  -4.770
  606   2HB   ARG  84          2HB       ARG  84  -6.067   0.754  -3.475
  607   1HG   ARG  84          1HG       ARG  84  -8.156   1.493  -4.351
  608   2HG   ARG  84          2HG       ARG  84  -7.426   2.749  -5.354
  609   1HD   ARG  84          1HD       ARG  84  -7.874   1.143  -6.998
  610   2HD   ARG  84          2HD       ARG  84  -6.211   0.700  -6.605
  611    HE   ARG  84           HE       ARG  84  -8.316  -0.756  -5.004
  612   1HH1  ARG  84          1HH1      ARG  84  -7.304  -0.809  -8.267
  613   2HH1  ARG  84          2HH1      ARG  84  -7.000  -2.618  -8.247
  614   1HH2  ARG  84          1HH2      ARG  84  -7.430  -2.889  -4.846
  615   2HH2  ARG  84          2HH2      ARG  84  -7.133  -3.725  -6.453
  616    H    GLN  85           H        GLN  85  -3.289   2.628  -2.754
  617    HA   GLN  85           HA       GLN  85  -3.470   1.019  -0.255
  618   1HB   GLN  85          1HB       GLN  85  -0.908   1.334  -0.243
  619   2HB   GLN  85          2HB       GLN  85  -1.084   2.260  -1.722
  620   1HG   GLN  85          1HG       GLN  85  -2.382   0.099  -2.627
  621   2HG   GLN  85          2HG       GLN  85  -0.635   0.196  -2.658
  622   1HE2  GLN  85          1HE2      GLN  85  -0.363  -2.159   0.242
  623   2HE2  GLN  85          2HE2      GLN  85   0.312  -0.543  -0.306
  624    H    MET  86           H        MET  86  -2.994   4.399  -1.094
  625    HA   MET  86           HA       MET  86  -1.873   5.402   1.423
  626   1HB   MET  86          1HB       MET  86  -1.715   7.346   0.315
  627   2HB   MET  86          2HB       MET  86  -2.351   6.501  -1.083
  628   1HG   MET  86          1HG       MET  86  -4.313   7.784   0.898
  629   2HG   MET  86          2HG       MET  86  -4.605   7.260  -0.767
  630   1HE   MET  86          1HE       MET  86  -4.794   8.922  -2.653
  631   2HE   MET  86          2HE       MET  86  -3.526  10.135  -3.000
  632   3HE   MET  86          3HE       MET  86  -3.104   8.399  -2.933
  633    H    LYS  87           H        LYS  87  -5.195   5.260   0.136
  634    HA   LYS  87           HA       LYS  87  -6.641   6.459   2.398
  635   1HB   LYS  87          1HB       LYS  87  -7.519   5.687  -0.047
  636   2HB   LYS  87          2HB       LYS  87  -8.578   5.912   1.337
  637   1HG   LYS  87          1HG       LYS  87  -7.501   3.226   0.313
  638   2HG   LYS  87          2HG       LYS  87  -8.361   3.381   1.836
  639   1HD   LYS  87          1HD       LYS  87 -10.211   2.902   0.559
  640   2HD   LYS  87          2HD       LYS  87 -10.169   4.624   0.200
  641   1HE   LYS  87          1HE       LYS  87  -9.322   4.319  -2.007
  642   2HE   LYS  87          2HE       LYS  87  -8.556   2.771  -1.626
  643   1HZ   LYS  87          1HZ       LYS  87 -10.980   1.971  -1.286
  644   2HZ   LYS  87          2HZ       LYS  87 -10.422   2.172  -2.828
  645   3HZ   LYS  87          3HZ       LYS  87 -11.410   3.311  -2.152
  646    H    GLU  88           H        GLU  88  -7.381   5.613   4.250
  647    HA   GLU  88           HA       GLU  88  -7.718   2.888   5.065
  648   1HB   GLU  88          1HB       GLU  88  -5.204   3.365   6.479
  649   2HB   GLU  88          2HB       GLU  88  -4.922   3.439   4.751
  650   1HG   GLU  88          1HG       GLU  88  -6.243   1.134   4.642
  651   2HG   GLU  88          2HG       GLU  88  -4.574   1.159   5.185
  652    H    ASP  89           H        ASP  89  -6.568   6.107   5.923
  653    HA   ASP  89           HA       ASP  89  -8.705   6.365   8.034
  654   1HB   ASP  89          1HB       ASP  89  -5.783   6.821   8.866
  655   2HB   ASP  89          2HB       ASP  89  -6.715   5.399   9.275
  656    H    ALA  90           H        ALA  90  -9.600   8.257   7.805
  657    HA   ALA  90           HA       ALA  90  -8.202  10.539   6.336
  658   1HB   ALA  90          1HB       ALA  90 -10.473  11.596   6.202
  659   2HB   ALA  90          2HB       ALA  90 -10.501   9.958   5.519
  660   3HB   ALA  90          3HB       ALA  90 -11.184  10.256   7.137
   
  Start of MODEL          21
 Raw file had  660 H/Q atoms
  Start of MODEL   21
    1   1H    ALA   1          1H        ALA   1 -19.990   7.882 -24.801
    2   2H    ALA   1          2H        ALA   1 -18.559   8.616 -25.292
    3   3H    ALA   1          3H        ALA   1 -18.712   6.943 -25.359
    4    HA   ALA   1           HA       ALA   1 -19.078   6.964 -22.907
    5   1HB   ALA   1          1HB       ALA   1 -16.950   6.221 -24.134
    6   2HB   ALA   1          2HB       ALA   1 -16.682   6.785 -22.474
    7   3HB   ALA   1          3HB       ALA   1 -16.267   7.840 -23.849
    8    H    SER   2           H        SER   2 -19.134   8.179 -21.092
    9    HA   SER   2           HA       SER   2 -18.053  10.949 -20.862
   10   1HB   SER   2          1HB       SER   2 -20.160  12.178 -20.596
   11   2HB   SER   2          2HB       SER   2 -20.065  11.457 -22.205
   12    HG   SER   2           HG       SER   2 -21.774  10.398 -21.774
   13    H    MET   3           H        MET   3 -17.436   8.796 -19.408
   14    HA   MET   3           HA       MET   3 -18.148   9.491 -16.604
   15   1HB   MET   3          1HB       MET   3 -20.231   8.275 -17.356
   16   2HB   MET   3          2HB       MET   3 -19.278   6.833 -17.659
   17   1HG   MET   3          1HG       MET   3 -18.551   7.235 -15.040
   18   2HG   MET   3          2HG       MET   3 -20.112   8.065 -15.019
   19   1HE   MET   3          1HE       MET   3 -20.597   6.499 -13.185
   20   2HE   MET   3          2HE       MET   3 -21.151   4.809 -13.368
   21   3HE   MET   3          3HE       MET   3 -22.192   6.152 -13.923
   22    H    THR   4           H        THR   4 -16.145   9.375 -15.875
   23    HA   THR   4           HA       THR   4 -14.494   6.856 -16.289
   24    HB   THR   4           HB       THR   4 -13.838   8.419 -18.034
   25    HG1  THR   4           HG1      THR   4 -11.981   7.621 -17.840
   26   1HG2  THR   4          1HG2      THR   4 -12.624  10.452 -17.758
   27   2HG2  THR   4          2HG2      THR   4 -12.419  10.232 -16.006
   28   3HG2  THR   4          3HG2      THR   4 -14.015  10.662 -16.673
   29    H    ASP   5           H        ASP   5 -16.029   7.829 -14.041
   30    HA   ASP   5           HA       ASP   5 -14.340   8.920 -11.882
   31   1HB   ASP   5          1HB       ASP   5 -16.994   8.630 -12.019
   32   2HB   ASP   5          2HB       ASP   5 -16.135   8.720 -10.499
   33    H    GLN   6           H        GLN   6 -14.265   5.950 -13.520
   34    HA   GLN   6           HA       GLN   6 -13.038   4.297 -11.305
   35   1HB   GLN   6          1HB       GLN   6 -13.318   3.658 -14.298
   36   2HB   GLN   6          2HB       GLN   6 -14.455   3.192 -13.040
   37   1HG   GLN   6          1HG       GLN   6 -13.285   1.318 -12.591
   38   2HG   GLN   6          2HG       GLN   6 -11.860   2.242 -12.173
   39   1HE2  GLN   6          1HE2      GLN   6 -10.107   1.224 -15.114
   40   2HE2  GLN   6          2HE2      GLN   6 -10.088   1.820 -13.379
   41    H    GLN   7           H        GLN   7 -11.494   6.007 -10.901
   42    HA   GLN   7           HA       GLN   7  -9.032   6.066 -10.655
   43   1HB   GLN   7          1HB       GLN   7  -7.501   5.462 -12.424
   44   2HB   GLN   7          2HB       GLN   7  -8.749   5.572 -13.655
   45   1HG   GLN   7          1HG       GLN   7  -9.842   3.500 -12.923
   46   2HG   GLN   7          2HG       GLN   7  -8.144   3.207 -13.267
   47   1HE2  GLN   7          1HE2      GLN   7  -9.545   2.831  -9.354
   48   2HE2  GLN   7          2HE2      GLN   7 -10.481   3.793 -10.604
   49    H    ALA   8           H        ALA   8 -11.226   7.975 -11.615
   50    HA   ALA   8           HA       ALA   8  -9.746  10.048 -13.218
   51   1HB   ALA   8          1HB       ALA   8 -11.850  11.373 -13.043
   52   2HB   ALA   8          2HB       ALA   8 -12.163   9.729 -13.629
   53   3HB   ALA   8          3HB       ALA   8 -12.557  10.163 -11.946
   54    H    GLU   9           H        GLU   9 -11.127   9.700  -9.943
   55    HA   GLU   9           HA       GLU   9 -10.508  12.272  -8.818
   56   1HB   GLU   9          1HB       GLU   9 -10.692   9.556  -7.382
   57   2HB   GLU   9          2HB       GLU   9 -10.443  11.075  -6.534
   58   1HG   GLU   9          1HG       GLU   9 -12.954  10.073  -7.902
   59   2HG   GLU   9          2HG       GLU   9 -12.676  11.809  -7.974
   60    H    ALA  10           H        ALA  10  -8.536   9.290  -8.753
   61    HA   ALA  10           HA       ALA  10  -6.353  10.084  -7.090
   62   1HB   ALA  10          1HB       ALA  10  -4.985   8.378  -8.280
   63   2HB   ALA  10          2HB       ALA  10  -6.616   7.771  -7.935
   64   3HB   ALA  10          3HB       ALA  10  -6.188   8.280  -9.588
   65    NH1  ARG  11           NH1      ARG  11  -4.742  11.366 -16.025
   66    NH2  ARG  11           NH2      ARG  11  -2.843  10.407 -15.228
   67    H    ARG  11           H        ARG  11  -7.020  10.877 -10.455
   68    HA   ARG  11           HA       ARG  11  -4.406  12.016 -11.229
   69   1HB   ARG  11          1HB       ARG  11  -5.845  11.376 -13.038
   70   2HB   ARG  11          2HB       ARG  11  -7.225  12.237 -12.373
   71   1HG   ARG  11          1HG       ARG  11  -6.586  13.615 -14.168
   72   2HG   ARG  11          2HG       ARG  11  -5.914  14.457 -12.769
   73   1HD   ARG  11          1HD       ARG  11  -4.464  13.850 -15.046
   74   2HD   ARG  11          2HD       ARG  11  -3.728  14.174 -13.475
   75    HE   ARG  11           HE       ARG  11  -3.439  11.705 -13.156
   76   1HH1  ARG  11          1HH1      ARG  11  -5.471  12.076 -15.902
   77   2HH1  ARG  11          2HH1      ARG  11  -4.655  10.701 -16.802
   78   1HH2  ARG  11          1HH2      ARG  11  -2.102  10.414 -14.518
   79   2HH2  ARG  11          2HH2      ARG  11  -2.909   9.787 -16.043
   80    H    ALA  12           H        ALA  12  -7.511  13.701 -10.673
   81    HA   ALA  12           HA       ALA  12  -6.599  16.396 -10.618
   82   1HB   ALA  12          1HB       ALA  12  -8.646  16.974  -9.331
   83   2HB   ALA  12          2HB       ALA  12  -9.005  15.808 -10.621
   84   3HB   ALA  12          3HB       ALA  12  -8.915  15.261  -8.928
   85    H    PHE  13           H        PHE  13  -6.413  13.957  -8.089
   86    HA   PHE  13           HA       PHE  13  -5.801  15.751  -5.814
   87   1HB   PHE  13          1HB       PHE  13  -5.610  12.728  -6.222
   88   2HB   PHE  13          2HB       PHE  13  -6.815  13.619  -5.329
   89    HD1  PHE  13           HD1      PHE  13  -6.412  14.188  -2.962
   90    HD2  PHE  13           HD2      PHE  13  -3.193  12.577  -5.323
   91    HE1  PHE  13           HE1      PHE  13  -5.102  13.780  -0.919
   92    HE2  PHE  13           HE2      PHE  13  -1.901  12.175  -3.269
   93    HZ   PHE  13           HZ       PHE  13  -2.850  12.771  -1.066
   94    H    LEU  14           H        LEU  14  -3.890  13.603  -7.933
   95    HA   LEU  14           HA       LEU  14  -1.239  14.615  -6.828
   96   1HB   LEU  14          1HB       LEU  14  -0.165  12.807  -7.928
   97   2HB   LEU  14          2HB       LEU  14  -1.456  12.582  -9.088
   98    HG   LEU  14           HG       LEU  14  -2.924  11.824  -7.006
   99   1HD1  LEU  14          1HD1      LEU  14  -0.123  11.312  -5.826
  100   2HD1  LEU  14          2HD1      LEU  14  -1.220  12.590  -5.273
  101   3HD1  LEU  14          3HD1      LEU  14  -1.689  10.881  -5.093
  102   1HD2  LEU  14          1HD2      LEU  14  -2.254   9.478  -7.322
  103   2HD2  LEU  14          2HD2      LEU  14  -2.070  10.295  -8.894
  104   3HD2  LEU  14          3HD2      LEU  14  -0.640   9.954  -7.908
  105    H    SER  15           H        SER  15  -0.814  16.556  -7.596
  106    HA   SER  15           HA       SER  15  -1.637  17.770 -10.092
  107   1HB   SER  15          1HB       SER  15  -0.968  19.371  -8.574
  108   2HB   SER  15          2HB       SER  15   0.470  19.320  -9.596
  109    HG   SER  15           HG       SER  15   1.404  17.884  -8.108
  110    H    GLU  16           H        GLU  16   0.333  18.724 -11.519
  111    HA   GLU  16           HA       GLU  16   1.319  16.510 -13.189
  112   1HB   GLU  16          1HB       GLU  16   0.742  18.554 -14.286
  113   2HB   GLU  16          2HB       GLU  16   1.789  19.526 -13.270
  114   1HG   GLU  16          1HG       GLU  16   3.792  18.174 -14.346
  115   2HG   GLU  16          2HG       GLU  16   2.999  19.423 -15.291
  116    H    GLU  17           H        GLU  17   2.691  18.539 -10.673
  117    HA   GLU  17           HA       GLU  17   5.544  17.762 -11.142
  118   1HB   GLU  17          1HB       GLU  17   5.553  19.861 -10.239
  119   2HB   GLU  17          2HB       GLU  17   4.137  19.600  -9.238
  120   1HG   GLU  17          1HG       GLU  17   6.946  18.477  -8.609
  121   2HG   GLU  17          2HG       GLU  17   5.531  18.286  -7.589
  122    H    MET  18           H        MET  18   2.930  16.916  -8.897
  123    HA   MET  18           HA       MET  18   4.438  15.073  -7.135
  124   1HB   MET  18          1HB       MET  18   1.460  15.523  -7.630
  125   2HB   MET  18          2HB       MET  18   1.991  14.099  -6.755
  126   1HG   MET  18          1HG       MET  18   3.158  16.715  -5.768
  127   2HG   MET  18          2HG       MET  18   1.417  16.488  -5.534
  128   1HE   MET  18          1HE       MET  18   1.922  16.629  -2.852
  129   2HE   MET  18          2HE       MET  18   3.050  15.521  -2.015
  130   3HE   MET  18          3HE       MET  18   3.684  16.736  -3.164
  131    H    ILE  19           H        ILE  19   2.682  14.806 -10.183
  132    HA   ILE  19           HA       ILE  19   2.512  11.864 -10.328
  133    HB   ILE  19           HB       ILE  19   1.880  14.124 -12.156
  134   1HG1  ILE  19          1HG1      ILE  19  -0.021  13.133 -11.114
  135   2HG1  ILE  19          2HG1      ILE  19   0.588  11.500 -11.280
  136   1HG2  ILE  19          1HG2      ILE  19   1.832  12.772 -14.267
  137   2HG2  ILE  19          2HG2      ILE  19   3.487  12.920 -13.678
  138   3HG2  ILE  19          3HG2      ILE  19   2.599  11.399 -13.433
  139   1HD1  ILE  19          1HD1      ILE  19   0.089  11.428 -13.706
  140   2HD1  ILE  19          2HD1      ILE  19  -1.353  11.904 -12.786
  141   3HD1  ILE  19          3HD1      ILE  19  -0.428  13.136 -13.676
  142    H    ALA  20           H        ALA  20   4.862  14.317 -11.298
  143    HA   ALA  20           HA       ALA  20   6.603  12.881 -13.054
  144   1HB   ALA  20          1HB       ALA  20   8.383  14.493 -12.388
  145   2HB   ALA  20          2HB       ALA  20   6.828  15.310 -12.640
  146   3HB   ALA  20          3HB       ALA  20   7.422  15.020 -10.986
  147    H    GLU  21           H        GLU  21   6.445  12.853  -9.516
  148    HA   GLU  21           HA       GLU  21   8.983  11.570  -8.891
  149   1HB   GLU  21          1HB       GLU  21   8.150  11.175  -6.679
  150   2HB   GLU  21          2HB       GLU  21   6.474  11.194  -7.190
  151   1HG   GLU  21          1HG       GLU  21   8.131  13.733  -7.588
  152   2HG   GLU  21          2HG       GLU  21   6.399  13.574  -7.352
  153    H    PHE  22           H        PHE  22   5.734  10.268  -9.517
  154    HA   PHE  22           HA       PHE  22   6.494   7.398  -9.165
  155   1HB   PHE  22          1HB       PHE  22   3.920   8.706 -10.233
  156   2HB   PHE  22          2HB       PHE  22   4.150   6.981 -10.144
  157    HD1  PHE  22           HD1      PHE  22   3.705   5.766  -8.123
  158    HD2  PHE  22           HD2      PHE  22   4.118  10.047  -7.939
  159    HE1  PHE  22           HE1      PHE  22   3.120   5.731  -5.735
  160    HE2  PHE  22           HE2      PHE  22   3.524   9.990  -5.552
  161    HZ   PHE  22           HZ       PHE  22   3.066   7.834  -4.436
  162    H    LYS  23           H        LYS  23   6.452   9.732 -11.751
  163    HA   LYS  23           HA       LYS  23   6.030   8.149 -14.141
  164   1HB   LYS  23          1HB       LYS  23   7.141  10.815 -13.544
  165   2HB   LYS  23          2HB       LYS  23   8.094  10.039 -14.789
  166   1HG   LYS  23          1HG       LYS  23   5.073   9.996 -15.139
  167   2HG   LYS  23          2HG       LYS  23   5.895  11.540 -15.287
  168   1HD   LYS  23          1HD       LYS  23   7.539   9.969 -16.893
  169   2HD   LYS  23          2HD       LYS  23   5.985   9.162 -17.137
  170   1HE   LYS  23          1HE       LYS  23   6.803  11.997 -17.899
  171   2HE   LYS  23          2HE       LYS  23   5.106  11.736 -17.468
  172   1HZ   LYS  23          1HZ       LYS  23   5.028  11.191 -19.657
  173   2HZ   LYS  23          2HZ       LYS  23   5.470   9.690 -19.125
  174   3HZ   LYS  23          3HZ       LYS  23   6.606  10.710 -19.757
  175    H    ALA  24           H        ALA  24   8.961   8.737 -12.218
  176    HA   ALA  24           HA       ALA  24  10.960   7.559 -13.963
  177   1HB   ALA  24          1HB       ALA  24  12.393   7.398 -11.938
  178   2HB   ALA  24          2HB       ALA  24  11.569   8.966 -12.019
  179   3HB   ALA  24          3HB       ALA  24  10.995   7.718 -10.884
  180    H    ALA  25           H        ALA  25   9.377   6.116 -11.089
  181    HA   ALA  25           HA       ALA  25  10.418   3.409 -11.307
  182   1HB   ALA  25          1HB       ALA  25   8.574   2.769  -9.764
  183   2HB   ALA  25          2HB       ALA  25   9.364   4.266  -9.234
  184   3HB   ALA  25          3HB       ALA  25   7.768   4.334 -10.025
  185    H    PHE  26           H        PHE  26   7.760   5.050 -12.897
  186    HA   PHE  26           HA       PHE  26   6.115   2.778 -13.733
  187   1HB   PHE  26          1HB       PHE  26   5.442   5.257 -13.859
  188   2HB   PHE  26          2HB       PHE  26   6.391   5.402 -15.314
  189    HD1  PHE  26           HD1      PHE  26   3.125   5.034 -14.217
  190    HD2  PHE  26           HD2      PHE  26   5.797   3.157 -17.017
  191    HE1  PHE  26           HE1      PHE  26   1.203   4.212 -15.517
  192    HE2  PHE  26           HE2      PHE  26   3.862   2.334 -18.298
  193    HZ   PHE  26           HZ       PHE  26   1.568   2.908 -17.585
  194    H    ASP  27           H        ASP  27   8.809   4.505 -15.298
  195    HA   ASP  27           HA       ASP  27   8.825   3.010 -17.817
  196   1HB   ASP  27          1HB       ASP  27  11.272   4.428 -16.627
  197   2HB   ASP  27          2HB       ASP  27   9.945   5.291 -17.371
  198    H    MET  28           H        MET  28  10.565   2.626 -14.749
  199    HA   MET  28           HA       MET  28  12.338   0.437 -15.289
  200   1HB   MET  28          1HB       MET  28  12.648   1.088 -13.104
  201   2HB   MET  28          2HB       MET  28  10.944   1.385 -12.813
  202   1HG   MET  28          1HG       MET  28  12.387  -1.328 -12.702
  203   2HG   MET  28          2HG       MET  28  10.619  -1.211 -12.751
  204   1HE   MET  28          1HE       MET  28  12.681   1.752 -11.175
  205   2HE   MET  28          2HE       MET  28  12.969   1.191  -9.500
  206   3HE   MET  28          3HE       MET  28  13.810   0.396 -10.864
  207    H    PHE  29           H        PHE  29   8.990   0.158 -14.050
  208    HA   PHE  29           HA       PHE  29   8.752  -2.733 -14.252
  209   1HB   PHE  29          1HB       PHE  29   6.199  -2.308 -14.306
  210   2HB   PHE  29          2HB       PHE  29   6.541  -0.599 -14.311
  211    HD1  PHE  29           HD1      PHE  29   7.436  -3.702 -12.304
  212    HD2  PHE  29           HD2      PHE  29   6.691   0.537 -12.216
  213    HE1  PHE  29           HE1      PHE  29   7.641  -3.704  -9.851
  214    HE2  PHE  29           HE2      PHE  29   6.889   0.509  -9.764
  215    HZ   PHE  29           HZ       PHE  29   7.369  -1.603  -8.579
  216    H    ASP  30           H        ASP  30   8.227  -0.128 -16.570
  217    HA   ASP  30           HA       ASP  30   6.888  -1.629 -18.702
  218   1HB   ASP  30          1HB       ASP  30   8.491   0.978 -18.777
  219   2HB   ASP  30          2HB       ASP  30   6.755   0.773 -18.784
  220    H    ALA  31           H        ALA  31   7.717  -2.560 -20.558
  221    HA   ALA  31           HA       ALA  31  10.705  -3.265 -20.593
  222   1HB   ALA  31          1HB       ALA  31  10.109  -5.603 -21.238
  223   2HB   ALA  31          2HB       ALA  31   9.456  -5.173 -19.645
  224   3HB   ALA  31          3HB       ALA  31   8.375  -5.240 -21.062
  225    H    ASP  32           H        ASP  32   7.653  -3.072 -22.410
  226    HA   ASP  32           HA       ASP  32   9.033  -3.279 -25.093
  227   1HB   ASP  32          1HB       ASP  32   6.594  -2.976 -25.991
  228   2HB   ASP  32          2HB       ASP  32   7.079  -4.493 -25.269
  229    H    GLY  33           H        GLY  33   6.982  -0.958 -23.306
  230   1HA   GLY  33          1HA       GLY  33   7.389   1.492 -23.124
  231   2HA   GLY  33          2HA       GLY  33   8.544   1.359 -24.431
  232    H    GLY  34           H        GLY  34   5.084   1.247 -23.643
  233   1HA   GLY  34          1HA       GLY  34   3.372   1.264 -25.694
  234   2HA   GLY  34          2HA       GLY  34   4.425   2.523 -26.351
  235    H    GLY  35           H        GLY  35   3.501   2.045 -22.961
  236   1HA   GLY  35          1HA       GLY  35   2.970   4.649 -22.017
  237   2HA   GLY  35          2HA       GLY  35   1.528   4.327 -22.990
  238    H    ASP  36           H        ASP  36   1.447   1.495 -22.518
  239    HA   ASP  36           HA       ASP  36   0.428   1.452 -19.628
  240   1HB   ASP  36          1HB       ASP  36  -1.504   0.387 -20.219
  241   2HB   ASP  36          2HB       ASP  36  -0.751  -0.574 -21.471
  242    H    ILE  37           H        ILE  37   0.543  -0.586 -18.540
  243    HA   ILE  37           HA       ILE  37   3.084  -2.138 -19.203
  244    HB   ILE  37           HB       ILE  37   1.774  -2.670 -16.578
  245   1HG1  ILE  37          1HG1      ILE  37   2.671   0.126 -17.244
  246   2HG1  ILE  37          2HG1      ILE  37   1.514  -0.440 -16.055
  247   1HG2  ILE  37          1HG2      ILE  37   4.098  -2.913 -15.796
  248   2HG2  ILE  37          2HG2      ILE  37   3.878  -3.812 -17.304
  249   3HG2  ILE  37          3HG2      ILE  37   4.730  -2.250 -17.323
  250   1HD1  ILE  37          1HD1      ILE  37   4.567  -0.488 -15.672
  251   2HD1  ILE  37          2HD1      ILE  37   3.390   0.579 -14.876
  252   3HD1  ILE  37          3HD1      ILE  37   3.389  -1.163 -14.515
  253    H    SER  38           H        SER  38   2.890  -4.493 -18.248
  254    HA   SER  38           HA       SER  38   0.207  -5.804 -18.733
  255   1HB   SER  38          1HB       SER  38   1.918  -5.566 -20.931
  256   2HB   SER  38          2HB       SER  38   2.288  -7.188 -20.342
  257    HG   SER  38           HG       SER  38   0.561  -7.246 -21.728
  258    H    THR  39           H        THR  39   1.096  -8.403 -18.916
  259    HA   THR  39           HA       THR  39   2.040  -8.960 -16.109
  260    HB   THR  39           HB       THR  39   1.712 -11.466 -17.048
  261    HG1  THR  39           HG1      THR  39  -0.437 -10.623 -18.356
  262   1HG2  THR  39          1HG2      THR  39  -0.591 -11.490 -16.197
  263   2HG2  THR  39          2HG2      THR  39   0.395 -10.455 -15.139
  264   3HG2  THR  39          3HG2      THR  39  -0.721  -9.720 -16.320
  265    H    LYS  40           H        LYS  40   3.055  -9.582 -19.467
  266    HA   LYS  40           HA       LYS  40   5.451 -11.161 -18.943
  267   1HB   LYS  40          1HB       LYS  40   4.343 -11.010 -21.147
  268   2HB   LYS  40          2HB       LYS  40   4.807  -9.341 -21.350
  269   1HG   LYS  40          1HG       LYS  40   7.243 -10.805 -20.830
  270   2HG   LYS  40          2HG       LYS  40   6.279 -11.886 -21.800
  271   1HD   LYS  40          1HD       LYS  40   7.722  -9.386 -22.633
  272   2HD   LYS  40          2HD       LYS  40   7.432 -10.887 -23.462
  273   1HE   LYS  40          1HE       LYS  40   5.029  -9.085 -23.137
  274   2HE   LYS  40          2HE       LYS  40   6.252  -8.607 -24.307
  275   1HZ   LYS  40          1HZ       LYS  40   5.702 -10.357 -25.654
  276   2HZ   LYS  40          2HZ       LYS  40   4.252 -10.253 -24.868
  277   3HZ   LYS  40          3HZ       LYS  40   5.354 -11.399 -24.420
  278    H    GLU  41           H        GLU  41   4.772  -7.692 -19.078
  279    HA   GLU  41           HA       GLU  41   7.552  -6.711 -19.018
  280   1HB   GLU  41          1HB       GLU  41   6.700  -4.506 -18.741
  281   2HB   GLU  41          2HB       GLU  41   5.185  -5.062 -18.064
  282   1HG   GLU  41          1HG       GLU  41   6.003  -5.543 -20.999
  283   2HG   GLU  41          2HG       GLU  41   4.460  -5.945 -20.276
  284    H    LEU  42           H        LEU  42   4.994  -6.756 -16.512
  285    HA   LEU  42           HA       LEU  42   6.504  -5.727 -14.280
  286   1HB   LEU  42          1HB       LEU  42   4.627  -7.834 -13.406
  287   2HB   LEU  42          2HB       LEU  42   3.895  -6.846 -14.651
  288    HG   LEU  42           HG       LEU  42   4.710  -4.779 -13.160
  289   1HD1  LEU  42          1HD1      LEU  42   4.554  -6.947 -10.974
  290   2HD1  LEU  42          2HD1      LEU  42   6.073  -6.266 -11.577
  291   3HD1  LEU  42          3HD1      LEU  42   4.898  -5.212 -10.752
  292   1HD2  LEU  42          1HD2      LEU  42   2.540  -4.745 -11.982
  293   2HD2  LEU  42          2HD2      LEU  42   2.281  -5.460 -13.593
  294   3HD2  LEU  42          3HD2      LEU  42   2.353  -6.509 -12.165
  295    H    GLY  43           H        GLY  43   6.270  -8.974 -15.632
  296   1HA   GLY  43          1HA       GLY  43   7.540 -11.008 -15.263
  297   2HA   GLY  43          2HA       GLY  43   7.417 -10.588 -13.549
  298    H    THR  44           H        THR  44   9.050  -8.845 -16.185
  299    HA   THR  44           HA       THR  44  11.752  -9.812 -15.742
  300    HB   THR  44           HB       THR  44  10.570  -7.544 -17.285
  301    HG1  THR  44           HG1      THR  44  11.542  -9.850 -17.734
  302   1HG2  THR  44          1HG2      THR  44  12.784  -6.529 -17.853
  303   2HG2  THR  44          2HG2      THR  44  12.359  -6.233 -16.154
  304   3HG2  THR  44          3HG2      THR  44  13.566  -7.479 -16.565
  305    H    VAL  45           H        VAL  45  10.096  -6.888 -14.557
  306    HA   VAL  45           HA       VAL  45  12.341  -5.694 -13.115
  307    HB   VAL  45           HB       VAL  45   9.455  -5.133 -13.349
  308   1HG1  VAL  45          1HG1      VAL  45  11.782  -3.200 -12.753
  309   2HG1  VAL  45          2HG1      VAL  45  11.388  -3.774 -14.378
  310   3HG1  VAL  45          3HG1      VAL  45  10.198  -2.811 -13.474
  311   1HG2  VAL  45          1HG2      VAL  45   9.087  -3.864 -11.297
  312   2HG2  VAL  45          2HG2      VAL  45   9.579  -5.497 -10.793
  313   3HG2  VAL  45          3HG2      VAL  45  10.746  -4.169 -10.718
  314    H    MET  46           H        MET  46   9.880  -8.082 -12.274
  315    HA   MET  46           HA       MET  46  10.262  -8.198  -9.359
  316   1HB   MET  46          1HB       MET  46   9.113 -10.228 -11.347
  317   2HB   MET  46          2HB       MET  46   9.330 -10.627  -9.653
  318   1HG   MET  46          1HG       MET  46   7.927  -8.351  -9.232
  319   2HG   MET  46          2HG       MET  46   7.385  -8.640 -10.894
  320   1HE   MET  46          1HE       MET  46   6.330  -9.055  -7.418
  321   2HE   MET  46          2HE       MET  46   5.965 -10.781  -7.129
  322   3HE   MET  46          3HE       MET  46   7.664 -10.231  -7.204
  323    NH1  ARG  47           NH1      ARG  47  18.651 -12.712 -15.107
  324    NH2  ARG  47           NH2      ARG  47  18.022 -14.866 -15.468
  325    H    ARG  47           H        ARG  47  11.814  -9.731 -12.131
  326    HA   ARG  47           HA       ARG  47  13.421 -11.779 -10.859
  327   1HB   ARG  47          1HB       ARG  47  14.482 -10.184 -13.242
  328   2HB   ARG  47          2HB       ARG  47  13.067 -11.214 -13.410
  329   1HG   ARG  47          1HG       ARG  47  14.251 -13.198 -13.220
  330   2HG   ARG  47          2HG       ARG  47  15.402 -12.544 -12.054
  331   1HD   ARG  47          1HD       ARG  47  15.517 -11.534 -14.952
  332   2HD   ARG  47          2HD       ARG  47  16.783 -11.549 -13.734
  333    HE   ARG  47           HE       ARG  47  15.850 -14.270 -14.643
  334   1HH1  ARG  47          1HH1      ARG  47  18.384 -11.776 -14.782
  335   2HH1  ARG  47          2HH1      ARG  47  19.568 -13.001 -15.464
  336   1HH2  ARG  47          1HH2      ARG  47  17.280 -15.573 -15.421
  337   2HH2  ARG  47          2HH2      ARG  47  18.982 -15.004 -15.801
  338    H    MET  48           H        MET  48  13.971  -8.315 -11.336
  339    HA   MET  48           HA       MET  48  16.768  -8.058 -10.677
  340   1HB   MET  48          1HB       MET  48  14.906  -6.192 -11.357
  341   2HB   MET  48          2HB       MET  48  16.493  -5.817 -10.714
  342   1HG   MET  48          1HG       MET  48  14.106  -4.848  -9.673
  343   2HG   MET  48          2HG       MET  48  14.406  -6.211  -8.582
  344   1HE   MET  48          1HE       MET  48  14.659  -2.647  -8.497
  345   2HE   MET  48          2HE       MET  48  16.374  -2.152  -8.388
  346   3HE   MET  48          3HE       MET  48  15.708  -2.721  -9.947
  347    H    LEU  49           H        LEU  49  13.920  -8.393  -8.621
  348    HA   LEU  49           HA       LEU  49  15.082  -7.767  -6.019
  349   1HB   LEU  49          1HB       LEU  49  13.192  -9.122  -5.039
  350   2HB   LEU  49          2HB       LEU  49  12.774  -9.708  -6.634
  351    HG   LEU  49           HG       LEU  49  11.758  -7.716  -7.298
  352   1HD1  LEU  49          1HD1      LEU  49  13.416  -6.063  -5.292
  353   2HD1  LEU  49          2HD1      LEU  49  13.858  -6.303  -6.993
  354   3HD1  LEU  49          3HD1      LEU  49  12.358  -5.435  -6.581
  355   1HD2  LEU  49          1HD2      LEU  49  10.333  -6.839  -5.495
  356   2HD2  LEU  49          2HD2      LEU  49  10.599  -8.569  -5.162
  357   3HD2  LEU  49          3HD2      LEU  49  11.496  -7.350  -4.244
  358    H    GLY  50           H        GLY  50  14.105 -11.050  -7.009
  359   1HA   GLY  50          1HA       GLY  50  16.774 -12.242  -6.109
  360   2HA   GLY  50          2HA       GLY  50  15.327 -12.713  -5.208
  361    H    GLN  51           H        GLN  51  13.735 -13.955  -6.162
  362    HA   GLN  51           HA       GLN  51  14.636 -15.848  -8.331
  363   1HB   GLN  51          1HB       GLN  51  11.941 -15.842  -6.860
  364   2HB   GLN  51          2HB       GLN  51  12.626 -17.135  -7.827
  365   1HG   GLN  51          1HG       GLN  51  14.625 -17.102  -6.071
  366   2HG   GLN  51          2HG       GLN  51  13.129 -17.932  -5.708
  367   1HE2  GLN  51          1HE2      GLN  51  14.364 -15.158  -3.107
  368   2HE2  GLN  51          2HE2      GLN  51  15.389 -15.952  -4.405
  369    H    ASN  52           H        ASN  52  12.301 -16.424  -9.614
  370    HA   ASN  52           HA       ASN  52  11.075 -13.921 -10.732
  371   1HB   ASN  52          1HB       ASN  52  12.426 -15.812 -12.728
  372   2HB   ASN  52          2HB       ASN  52  13.310 -14.484 -12.009
  373   1HD2  ASN  52          1HD2      ASN  52  11.614 -13.527 -15.341
  374   2HD2  ASN  52          2HD2      ASN  52  12.678 -14.918 -14.793
  375    HA   PRO  53           HA       PRO  53   7.805 -17.415 -10.284
  376   1HB   PRO  53          1HB       PRO  53   6.104 -14.989 -11.003
  377   2HB   PRO  53          2HB       PRO  53   5.876 -16.256  -9.789
  378   1HG   PRO  53          1HG       PRO  53   6.788 -13.768  -9.095
  379   2HG   PRO  53          2HG       PRO  53   7.244 -15.216  -8.167
  380   1HD   PRO  53          1HD       PRO  53   9.458 -14.598  -8.799
  381   2HD   PRO  53          2HD       PRO  53   8.882 -13.577 -10.149
  382    H    THR  54           H        THR  54   6.279 -18.227 -11.888
  383    HA   THR  54           HA       THR  54   7.359 -18.044 -14.704
  384    HB   THR  54           HB       THR  54   6.678 -20.253 -13.404
  385    HG1  THR  54           HG1      THR  54   7.359 -20.725 -15.272
  386   1HG2  THR  54          1HG2      THR  54   4.474 -21.171 -14.050
  387   2HG2  THR  54          2HG2      THR  54   4.249 -19.724 -13.040
  388   3HG2  THR  54          3HG2      THR  54   4.003 -19.628 -14.803
  389    H    LYS  55           H        LYS  55   5.593 -18.136 -16.449
  390    HA   LYS  55           HA       LYS  55   4.359 -15.554 -16.660
  391   1HB   LYS  55          1HB       LYS  55   4.371 -16.298 -18.799
  392   2HB   LYS  55          2HB       LYS  55   2.807 -17.003 -18.447
  393   1HG   LYS  55          1HG       LYS  55   4.136 -19.163 -17.749
  394   2HG   LYS  55          2HG       LYS  55   3.870 -18.804 -19.446
  395   1HD   LYS  55          1HD       LYS  55   6.146 -18.764 -19.847
  396   2HD   LYS  55          2HD       LYS  55   6.337 -19.384 -18.215
  397   1HE   LYS  55          1HE       LYS  55   6.077 -16.628 -17.742
  398   2HE   LYS  55          2HE       LYS  55   7.588 -17.533 -17.750
  399   1HZ   LYS  55          1HZ       LYS  55   6.999 -15.460 -19.386
  400   2HZ   LYS  55          2HZ       LYS  55   6.691 -16.731 -20.394
  401   3HZ   LYS  55          3HZ       LYS  55   8.180 -16.572 -19.696
  402    H    GLU  56           H        GLU  56   3.124 -18.607 -15.407
  403    HA   GLU  56           HA       GLU  56   0.259 -17.815 -15.278
  404   1HB   GLU  56          1HB       GLU  56   0.252 -19.940 -13.644
  405   2HB   GLU  56          2HB       GLU  56   1.844 -20.220 -14.319
  406   1HG   GLU  56          1HG       GLU  56   0.782 -21.350 -15.995
  407   2HG   GLU  56          2HG       GLU  56   0.327 -19.785 -16.646
  408    H    GLU  57           H        GLU  57   3.036 -17.888 -13.090
  409    HA   GLU  57           HA       GLU  57   1.674 -17.327 -10.545
  410   1HB   GLU  57          1HB       GLU  57   3.868 -16.649  -9.652
  411   2HB   GLU  57          2HB       GLU  57   4.556 -16.618 -11.261
  412   1HG   GLU  57          1HG       GLU  57   3.757 -19.234 -11.284
  413   2HG   GLU  57          2HG       GLU  57   5.321 -18.721 -10.664
  414    H    LEU  58           H        LEU  58   2.860 -15.333 -13.194
  415    HA   LEU  58           HA       LEU  58   2.618 -12.701 -11.836
  416   1HB   LEU  58          1HB       LEU  58   3.090 -13.588 -14.720
  417   2HB   LEU  58          2HB       LEU  58   2.710 -11.914 -14.369
  418    HG   LEU  58           HG       LEU  58   4.938 -13.171 -12.727
  419   1HD1  LEU  58          1HD1      LEU  58   4.847 -10.443 -14.177
  420   2HD1  LEU  58          2HD1      LEU  58   4.268 -10.683 -12.522
  421   3HD1  LEU  58          3HD1      LEU  58   5.987 -10.950 -12.904
  422   1HD2  LEU  58          1HD2      LEU  58   6.612 -13.006 -14.531
  423   2HD2  LEU  58          2HD2      LEU  58   5.297 -14.075 -15.079
  424   3HD2  LEU  58          3HD2      LEU  58   5.388 -12.410 -15.681
  425    H    ASP  59           H        ASP  59   0.617 -14.791 -13.845
  426    HA   ASP  59           HA       ASP  59  -1.588 -12.999 -14.501
  427   1HB   ASP  59          1HB       ASP  59  -1.242 -15.252 -15.580
  428   2HB   ASP  59          2HB       ASP  59  -1.747 -16.038 -14.102
  429    H    ALA  60           H        ALA  60  -0.784 -14.875 -11.635
  430    HA   ALA  60           HA       ALA  60  -3.315 -14.480 -10.157
  431   1HB   ALA  60          1HB       ALA  60  -2.053 -15.337  -8.189
  432   2HB   ALA  60          2HB       ALA  60  -1.793 -16.355  -9.619
  433   3HB   ALA  60          3HB       ALA  60  -0.519 -15.228  -9.086
  434    H    ILE  61           H        ILE  61  -0.262 -12.740 -10.436
  435    HA   ILE  61           HA       ILE  61  -0.551 -10.900  -8.162
  436    HB   ILE  61           HB       ILE  61   1.311 -11.158 -10.462
  437   1HG1  ILE  61          1HG1      ILE  61   1.432 -11.300  -7.594
  438   2HG1  ILE  61          2HG1      ILE  61   2.722 -11.585  -8.743
  439   1HG2  ILE  61          1HG2      ILE  61   2.221  -8.820 -10.357
  440   2HG2  ILE  61          2HG2      ILE  61   0.562  -8.813 -10.951
  441   3HG2  ILE  61          3HG2      ILE  61   0.896  -8.333  -9.271
  442   1HD1  ILE  61          1HD1      ILE  61   2.140  -8.858  -7.443
  443   2HD1  ILE  61          2HD1      ILE  61   3.502  -9.951  -7.116
  444   3HD1  ILE  61          3HD1      ILE  61   3.376  -9.147  -8.698
  445    H    ILE  62           H        ILE  62  -1.555 -10.865 -11.551
  446    HA   ILE  62           HA       ILE  62  -2.557  -8.048 -11.554
  447    HB   ILE  62           HB       ILE  62  -2.884 -10.290 -13.612
  448   1HG1  ILE  62          1HG1      ILE  62  -0.685  -9.725 -14.013
  449   2HG1  ILE  62          2HG1      ILE  62  -0.787  -8.217 -13.131
  450   1HG2  ILE  62          1HG2      ILE  62  -3.769  -8.563 -15.205
  451   2HG2  ILE  62          2HG2      ILE  62  -4.842  -8.719 -13.816
  452   3HG2  ILE  62          3HG2      ILE  62  -3.736  -7.331 -13.919
  453   1HD1  ILE  62          1HD1      ILE  62  -1.758  -7.009 -15.066
  454   2HD1  ILE  62          2HD1      ILE  62  -0.255  -7.832 -15.531
  455   3HD1  ILE  62          3HD1      ILE  62  -1.823  -8.524 -16.009
  456    H    GLU  63           H        GLU  63  -3.838 -11.319 -11.157
  457    HA   GLU  63           HA       GLU  63  -6.658 -10.950 -11.156
  458   1HB   GLU  63          1HB       GLU  63  -5.518 -13.150 -10.856
  459   2HB   GLU  63          2HB       GLU  63  -5.104 -12.735  -9.204
  460   1HG   GLU  63          1HG       GLU  63  -7.753 -12.433  -8.885
  461   2HG   GLU  63          2HG       GLU  63  -7.869 -13.346 -10.380
  462    H    GLU  64           H        GLU  64  -4.521 -10.692  -8.290
  463    HA   GLU  64           HA       GLU  64  -6.436  -9.839  -6.332
  464   1HB   GLU  64          1HB       GLU  64  -3.454  -9.673  -6.565
  465   2HB   GLU  64          2HB       GLU  64  -4.168  -8.516  -5.460
  466   1HG   GLU  64          1HG       GLU  64  -4.015 -11.537  -5.258
  467   2HG   GLU  64          2HG       GLU  64  -5.474 -10.807  -4.612
  468    H    VAL  65           H        VAL  65  -4.156  -7.715  -8.105
  469    HA   VAL  65           HA       VAL  65  -5.794  -5.241  -7.627
  470    HB   VAL  65           HB       VAL  65  -4.126  -3.987  -8.818
  471   1HG1  VAL  65          1HG1      VAL  65  -2.078  -4.459  -7.462
  472   2HG1  VAL  65          2HG1      VAL  65  -3.539  -4.606  -6.468
  473   3HG1  VAL  65          3HG1      VAL  65  -2.700  -6.071  -7.030
  474   1HG2  VAL  65          1HG2      VAL  65  -2.756  -6.624  -9.690
  475   2HG2  VAL  65          2HG2      VAL  65  -3.589  -5.467 -10.757
  476   3HG2  VAL  65          3HG2      VAL  65  -2.104  -4.984  -9.925
  477    H    ASP  66           H        ASP  66  -5.332  -4.154 -10.299
  478    HA   ASP  66           HA       ASP  66  -6.598  -3.846 -12.312
  479   1HB   ASP  66          1HB       ASP  66  -5.266  -6.384 -12.490
  480   2HB   ASP  66          2HB       ASP  66  -6.877  -6.652 -13.115
  481    H    GLU  67           H        GLU  67  -8.252  -3.353 -10.595
  482    HA   GLU  67           HA       GLU  67 -10.546  -5.279 -10.264
  483   1HB   GLU  67          1HB       GLU  67  -9.527  -3.562  -8.505
  484   2HB   GLU  67          2HB       GLU  67 -11.216  -4.032  -8.481
  485   1HG   GLU  67          1HG       GLU  67 -10.506  -1.550 -10.099
  486   2HG   GLU  67          2HG       GLU  67 -11.973  -1.910  -9.204
  487    H    ASP  68           H        ASP  68  -9.889  -4.325 -12.957
  488    HA   ASP  68           HA       ASP  68 -12.393  -2.713 -13.668
  489   1HB   ASP  68          1HB       ASP  68 -10.635  -1.229 -14.214
  490   2HB   ASP  68          2HB       ASP  68 -11.147  -1.921 -15.736
  491    H    GLY  69           H        GLY  69  -9.982  -4.823 -15.287
  492   1HA   GLY  69          1HA       GLY  69 -12.197  -6.113 -16.948
  493   2HA   GLY  69          2HA       GLY  69 -11.231  -7.186 -15.933
  494    H    SER  70           H        SER  70 -10.068  -4.297 -17.608
  495    HA   SER  70           HA       SER  70  -9.184  -5.174 -20.122
  496   1HB   SER  70          1HB       SER  70  -7.745  -3.314 -20.224
  497   2HB   SER  70          2HB       SER  70  -8.972  -2.827 -19.052
  498    HG   SER  70           HG       SER  70  -6.740  -2.463 -18.474
  499    H    GLY  71           H        GLY  71  -7.420  -5.545 -17.037
  500   1HA   GLY  71          1HA       GLY  71  -6.139  -7.647 -16.474
  501   2HA   GLY  71          2HA       GLY  71  -5.869  -7.901 -18.202
  502    H    THR  72           H        THR  72  -5.192  -5.108 -18.723
  503    HA   THR  72           HA       THR  72  -2.283  -5.124 -17.887
  504    HB   THR  72           HB       THR  72  -2.287  -2.930 -19.381
  505    HG1  THR  72           HG1      THR  72  -4.382  -2.713 -19.787
  506   1HG2  THR  72          1HG2      THR  72  -1.814  -4.209 -21.431
  507   2HG2  THR  72          2HG2      THR  72  -1.050  -5.031 -20.053
  508   3HG2  THR  72          3HG2      THR  72  -2.550  -5.683 -20.764
  509    H    ILE  73           H        ILE  73  -1.328  -3.128 -17.055
  510    HA   ILE  73           HA       ILE  73  -3.170  -1.566 -15.160
  511    HB   ILE  73           HB       ILE  73  -0.311  -2.528 -14.654
  512   1HG1  ILE  73          1HG1      ILE  73  -2.705  -3.116 -12.836
  513   2HG1  ILE  73          2HG1      ILE  73  -2.492  -4.070 -14.289
  514   1HG2  ILE  73          1HG2      ILE  73  -0.375  -1.346 -12.461
  515   2HG2  ILE  73          2HG2      ILE  73  -0.613  -0.178 -13.768
  516   3HG2  ILE  73          3HG2      ILE  73  -2.004  -0.714 -12.795
  517   1HD1  ILE  73          1HD1      ILE  73  -0.420  -3.890 -12.024
  518   2HD1  ILE  73          2HD1      ILE  73  -1.471  -5.265 -12.428
  519   3HD1  ILE  73          3HD1      ILE  73  -0.183  -4.777 -13.556
  520    H    ASP  74           H        ASP  74  -3.514   0.196 -16.358
  521    HA   ASP  74           HA       ASP  74  -1.398   1.573 -17.954
  522   1HB   ASP  74          1HB       ASP  74  -3.979   3.027 -17.375
  523   2HB   ASP  74          2HB       ASP  74  -3.032   2.948 -18.842
  524    H    PHE  75           H        PHE  75  -1.473   4.134 -17.585
  525    HA   PHE  75           HA       PHE  75  -0.030   4.627 -15.028
  526   1HB   PHE  75          1HB       PHE  75   0.474   5.723 -17.328
  527   2HB   PHE  75          2HB       PHE  75  -0.916   6.743 -17.073
  528    HD1  PHE  75           HD1      PHE  75   1.269   8.361 -17.432
  529    HD2  PHE  75           HD2      PHE  75   0.411   6.184 -13.820
  530    HE1  PHE  75           HE1      PHE  75   2.619   9.958 -16.136
  531    HE2  PHE  75           HE2      PHE  75   1.761   7.798 -12.540
  532    HZ   PHE  75           HZ       PHE  75   2.864   9.683 -13.691
  533    H    GLU  76           H        GLU  76  -3.220   5.250 -16.375
  534    HA   GLU  76           HA       GLU  76  -4.205   7.244 -14.492
  535   1HB   GLU  76          1HB       GLU  76  -6.143   7.208 -15.621
  536   2HB   GLU  76          2HB       GLU  76  -5.197   6.318 -16.796
  537   1HG   GLU  76          1HG       GLU  76  -6.113   4.129 -15.685
  538   2HG   GLU  76          2HG       GLU  76  -7.206   5.161 -14.787
  539    H    GLU  77           H        GLU  77  -4.565   3.696 -14.551
  540    HA   GLU  77           HA       GLU  77  -5.982   3.572 -11.918
  541   1HB   GLU  77          1HB       GLU  77  -6.418   1.373 -12.322
  542   2HB   GLU  77          2HB       GLU  77  -6.242   1.952 -13.962
  543   1HG   GLU  77          1HG       GLU  77  -3.814   1.076 -13.955
  544   2HG   GLU  77          2HG       GLU  77  -4.121   0.373 -12.370
  545    H    PHE  78           H        PHE  78  -2.707   3.199 -13.107
  546    HA   PHE  78           HA       PHE  78  -1.402   1.833 -10.950
  547   1HB   PHE  78          1HB       PHE  78  -0.293   4.111 -12.704
  548   2HB   PHE  78          2HB       PHE  78  -0.236   2.407 -13.077
  549    HD1  PHE  78           HD1      PHE  78   0.938   0.962 -10.939
  550    HD2  PHE  78           HD2      PHE  78   1.684   5.086 -11.911
  551    HE1  PHE  78           HE1      PHE  78   3.121   0.846  -9.806
  552    HE2  PHE  78           HE2      PHE  78   3.866   4.949 -10.781
  553    HZ   PHE  78           HZ       PHE  78   4.590   2.833  -9.731
  554    H    LEU  79           H        LEU  79  -2.421   5.198 -11.249
  555    HA   LEU  79           HA       LEU  79  -1.111   6.125  -8.719
  556   1HB   LEU  79          1HB       LEU  79  -3.236   7.601 -10.379
  557   2HB   LEU  79          2HB       LEU  79  -2.208   8.297  -9.146
  558    HG   LEU  79           HG       LEU  79  -0.984   7.034 -11.662
  559   1HD1  LEU  79          1HD1      LEU  79   0.087   9.265  -9.822
  560   2HD1  LEU  79          2HD1      LEU  79   0.525   7.552  -9.674
  561   3HD1  LEU  79          3HD1      LEU  79   0.963   8.455 -11.146
  562   1HD2  LEU  79          1HD2      LEU  79  -1.011   9.205 -12.815
  563   2HD2  LEU  79          2HD2      LEU  79  -2.689   8.844 -12.340
  564   3HD2  LEU  79          3HD2      LEU  79  -1.745  10.014 -11.407
  565    H    VAL  80           H        VAL  80  -4.307   5.098  -9.797
  566    HA   VAL  80           HA       VAL  80  -5.934   5.851  -7.517
  567    HB   VAL  80           HB       VAL  80  -6.396   3.296  -9.126
  568   1HG1  VAL  80          1HG1      VAL  80  -7.393   6.099  -9.946
  569   2HG1  VAL  80          2HG1      VAL  80  -5.969   5.335 -10.665
  570   3HG1  VAL  80          3HG1      VAL  80  -7.565   4.571 -10.847
  571   1HG2  VAL  80          1HG2      VAL  80  -8.785   3.643  -8.691
  572   2HG2  VAL  80          2HG2      VAL  80  -7.951   3.713  -7.121
  573   3HG2  VAL  80          3HG2      VAL  80  -8.484   5.210  -7.901
  574    H    MET  81           H        MET  81  -3.784   3.113  -8.117
  575    HA   MET  81           HA       MET  81  -4.348   1.357  -5.894
  576   1HB   MET  81          1HB       MET  81  -1.429   1.656  -6.510
  577   2HB   MET  81          2HB       MET  81  -2.438   1.371  -7.917
  578   1HG   MET  81          1HG       MET  81  -3.220  -0.775  -7.092
  579   2HG   MET  81          2HG       MET  81  -2.651  -0.447  -5.447
  580   1HE   MET  81          1HE       MET  81  -1.947  -3.143  -6.753
  581   2HE   MET  81          2HE       MET  81  -0.174  -3.304  -6.570
  582   3HE   MET  81          3HE       MET  81  -1.157  -2.690  -5.210
  583    H    MET  82           H        MET  82  -1.610   3.650  -5.999
  584    HA   MET  82           HA       MET  82  -0.935   3.528  -3.188
  585   1HB   MET  82          1HB       MET  82  -0.295   5.481  -5.412
  586   2HB   MET  82          2HB       MET  82   0.041   5.997  -3.769
  587   1HG   MET  82          1HG       MET  82   1.070   3.284  -4.795
  588   2HG   MET  82          2HG       MET  82   1.930   4.787  -5.153
  589   1HE   MET  82          1HE       MET  82   3.492   2.634  -3.827
  590   2HE   MET  82          2HE       MET  82   2.235   1.857  -2.819
  591   3HE   MET  82          3HE       MET  82   3.643   2.638  -2.041
  592    H    VAL  83           H        VAL  83  -3.320   5.442  -4.913
  593    HA   VAL  83           HA       VAL  83  -3.789   7.573  -2.974
  594    HB   VAL  83           HB       VAL  83  -5.112   6.655  -5.450
  595   1HG1  VAL  83          1HG1      VAL  83  -7.327   7.745  -5.051
  596   2HG1  VAL  83          2HG1      VAL  83  -7.118   6.349  -3.984
  597   3HG1  VAL  83          3HG1      VAL  83  -6.920   7.993  -3.333
  598   1HG2  VAL  83          1HG2      VAL  83  -4.866   9.464  -4.183
  599   2HG2  VAL  83          2HG2      VAL  83  -3.747   8.760  -5.372
  600   3HG2  VAL  83          3HG2      VAL  83  -5.417   9.109  -5.841
  601    NH1  ARG  84           NH1      ARG  84  -8.442  -0.796  -5.331
  602    NH2  ARG  84           NH2      ARG  84  -9.579  -1.561  -3.520
  603    H    ARG  84           H        ARG  84  -5.245   4.364  -3.453
  604    HA   ARG  84           HA       ARG  84  -7.376   4.576  -1.393
  605   1HB   ARG  84          1HB       ARG  84  -6.284   2.400  -3.169
  606   2HB   ARG  84          2HB       ARG  84  -6.954   1.854  -1.639
  607   1HG   ARG  84          1HG       ARG  84  -9.140   2.476  -2.144
  608   2HG   ARG  84          2HG       ARG  84  -8.664   3.831  -3.171
  609   1HD   ARG  84          1HD       ARG  84  -9.085   2.518  -4.985
  610   2HD   ARG  84          2HD       ARG  84  -7.640   1.585  -4.590
  611    HE   ARG  84           HE       ARG  84 -10.365   0.828  -3.404
  612   1HH1  ARG  84          1HH1      ARG  84  -8.110   0.013  -5.868
  613   2HH1  ARG  84          2HH1      ARG  84  -8.270  -1.786  -5.541
  614   1HH2  ARG  84          1HH2      ARG  84 -10.099  -1.335  -2.664
  615   2HH2  ARG  84          2HH2      ARG  84  -9.336  -2.497  -3.862
  616    H    GLN  85           H        GLN  85  -4.025   3.455  -1.483
  617    HA   GLN  85           HA       GLN  85  -3.960   2.119   1.160
  618   1HB   GLN  85          1HB       GLN  85  -1.354   2.523   0.815
  619   2HB   GLN  85          2HB       GLN  85  -1.815   3.046  -0.794
  620   1HG   GLN  85          1HG       GLN  85  -3.014   0.412   0.025
  621   2HG   GLN  85          2HG       GLN  85  -2.364   0.910  -1.521
  622   1HE2  GLN  85          1HE2      GLN  85   0.059  -1.619  -0.256
  623   2HE2  GLN  85          2HE2      GLN  85  -1.672  -1.529  -0.859
  624    H    MET  86           H        MET  86  -3.486   5.397  -0.018
  625    HA   MET  86           HA       MET  86  -2.003   6.698   2.050
  626   1HB   MET  86          1HB       MET  86  -3.245   7.586  -0.225
  627   2HB   MET  86          2HB       MET  86  -2.490   8.606   0.985
  628   1HG   MET  86          1HG       MET  86  -5.487   7.955   0.613
  629   2HG   MET  86          2HG       MET  86  -4.909   8.644   2.137
  630   1HE   MET  86          1HE       MET  86  -5.831   9.278  -1.606
  631   2HE   MET  86          2HE       MET  86  -4.945  10.773  -2.026
  632   3HE   MET  86          3HE       MET  86  -4.051   9.240  -1.810
  633    H    LYS  87           H        LYS  87  -5.441   5.844   1.928
  634    HA   LYS  87           HA       LYS  87  -6.491   7.141   4.281
  635   1HB   LYS  87          1HB       LYS  87  -8.342   5.719   4.198
  636   2HB   LYS  87          2HB       LYS  87  -7.763   5.655   2.540
  637   1HG   LYS  87          1HG       LYS  87  -6.506   3.488   3.118
  638   2HG   LYS  87          2HG       LYS  87  -7.304   3.492   4.682
  639   1HD   LYS  87          1HD       LYS  87  -9.452   3.807   2.842
  640   2HD   LYS  87          2HD       LYS  87  -8.325   2.762   1.986
  641   1HE   LYS  87          1HE       LYS  87  -9.678   2.192   4.699
  642   2HE   LYS  87          2HE       LYS  87  -9.851   1.281   3.192
  643   1HZ   LYS  87          1HZ       LYS  87  -8.123   0.667   5.165
  644   2HZ   LYS  87          2HZ       LYS  87  -7.116   1.465   4.127
  645   3HZ   LYS  87          3HZ       LYS  87  -7.969   0.150   3.604
  646    H    GLU  88           H        GLU  88  -6.227   6.875   6.381
  647    HA   GLU  88           HA       GLU  88  -4.010   5.249   7.491
  648   1HB   GLU  88          1HB       GLU  88  -4.409   7.355   8.534
  649   2HB   GLU  88          2HB       GLU  88  -4.751   6.107   9.717
  650   1HG   GLU  88          1HG       GLU  88  -7.221   6.436   9.397
  651   2HG   GLU  88          2HG       GLU  88  -6.929   7.590   8.108
  652    H    ASP  89           H        ASP  89  -7.558   5.078   7.490
  653    HA   ASP  89           HA       ASP  89  -7.762   2.181   7.599
  654   1HB   ASP  89          1HB       ASP  89  -7.848   3.500  10.352
  655   2HB   ASP  89          2HB       ASP  89  -6.914   2.120   9.823
  656    H    ALA  90           H        ALA  90  -9.580   1.870   6.603
  657    HA   ALA  90           HA       ALA  90 -11.866   2.048   5.842
  658   1HB   ALA  90          1HB       ALA  90 -13.557   3.123   7.351
  659   2HB   ALA  90          2HB       ALA  90 -12.528   2.000   8.260
  660   3HB   ALA  90          3HB       ALA  90 -12.264   3.755   8.400
   
  Start of MODEL          22
 Raw file had  660 H/Q atoms
  Start of MODEL   22
    1   1H    ALA   1          1H        ALA   1 -18.297  10.690 -16.989
    2   2H    ALA   1          2H        ALA   1 -18.505  11.684 -15.649
    3   3H    ALA   1          3H        ALA   1 -16.985  11.527 -16.351
    4    HA   ALA   1           HA       ALA   1 -17.183   9.068 -15.862
    5   1HB   ALA   1          1HB       ALA   1 -15.795  11.063 -14.662
    6   2HB   ALA   1          2HB       ALA   1 -15.794   9.413 -14.012
    7   3HB   ALA   1          3HB       ALA   1 -16.843  10.655 -13.282
    8    H    SER   2           H        SER   2 -18.378   7.545 -14.878
    9    HA   SER   2           HA       SER   2 -20.623   8.295 -12.949
   10   1HB   SER   2          1HB       SER   2 -21.300   6.162 -14.976
   11   2HB   SER   2          2HB       SER   2 -22.349   7.288 -14.112
   12    HG   SER   2           HG       SER   2 -20.604   7.821 -16.278
   13    H    MET   3           H        MET   3 -19.440   5.358 -14.620
   14    HA   MET   3           HA       MET   3 -19.344   3.793 -12.043
   15   1HB   MET   3          1HB       MET   3 -18.439   2.627 -14.698
   16   2HB   MET   3          2HB       MET   3 -19.221   1.836 -13.341
   17   1HG   MET   3          1HG       MET   3 -21.044   3.876 -14.440
   18   2HG   MET   3          2HG       MET   3 -20.437   2.846 -15.742
   19   1HE   MET   3          1HE       MET   3 -20.695   2.181 -12.009
   20   2HE   MET   3          2HE       MET   3 -21.711   0.716 -11.872
   21   3HE   MET   3          3HE       MET   3 -22.481   2.326 -11.964
   22    H    THR   4           H        THR   4 -17.486   2.831 -11.231
   23    HA   THR   4           HA       THR   4 -15.224   2.808 -10.483
   24    HB   THR   4           HB       THR   4 -15.369   1.395 -12.609
   25    HG1  THR   4           HG1      THR   4 -13.207   0.955 -12.356
   26   1HG2  THR   4          1HG2      THR   4 -13.260   3.289 -13.766
   27   2HG2  THR   4          2HG2      THR   4 -14.954   3.377 -14.298
   28   3HG2  THR   4          3HG2      THR   4 -14.020   1.876 -14.530
   29    H    ASP   5           H        ASP   5 -16.198   5.333 -10.365
   30    HA   ASP   5           HA       ASP   5 -14.215   7.289 -11.525
   31   1HB   ASP   5          1HB       ASP   5 -16.463   8.137 -11.433
   32   2HB   ASP   5          2HB       ASP   5 -15.500   9.041 -10.285
   33    H    GLN   6           H        GLN   6 -12.979   5.325 -10.024
   34    HA   GLN   6           HA       GLN   6 -12.465   6.288  -7.199
   35   1HB   GLN   6          1HB       GLN   6 -12.697   3.829  -7.730
   36   2HB   GLN   6          2HB       GLN   6 -11.258   4.276  -6.833
   37   1HG   GLN   6          1HG       GLN   6 -10.037   4.285  -9.191
   38   2HG   GLN   6          2HG       GLN   6 -11.442   3.419  -9.771
   39   1HE2  GLN   6          1HE2      GLN   6  -8.982   0.797  -8.725
   40   2HE2  GLN   6          2HE2      GLN   6  -9.024   2.191  -9.917
   41    H    GLN   7           H        GLN   7 -10.952   6.165 -10.382
   42    HA   GLN   7           HA       GLN   7  -8.210   7.000  -9.496
   43   1HB   GLN   7          1HB       GLN   7  -7.613   6.222 -11.536
   44   2HB   GLN   7          2HB       GLN   7  -8.467   7.566 -12.278
   45   1HG   GLN   7          1HG       GLN   7 -10.577   5.775 -11.784
   46   2HG   GLN   7          2HG       GLN   7  -9.798   6.071 -13.331
   47   1HE2  GLN   7          1HE2      GLN   7  -9.150   2.508 -13.230
   48   2HE2  GLN   7          2HE2      GLN   7 -10.110   3.884 -13.973
   49    H    ALA   8           H        ALA   8 -11.130   8.501 -10.796
   50    HA   ALA   8           HA       ALA   8 -10.242  11.125 -11.535
   51   1HB   ALA   8          1HB       ALA   8 -12.569  11.889 -11.087
   52   2HB   ALA   8          2HB       ALA   8 -12.552  10.332 -11.938
   53   3HB   ALA   8          3HB       ALA   8 -12.924  10.389 -10.196
   54    H    GLU   9           H        GLU   9 -10.928   9.768  -8.340
   55    HA   GLU   9           HA       GLU   9 -10.747  12.325  -6.828
   56   1HB   GLU   9          1HB       GLU   9 -11.045  11.070  -4.804
   57   2HB   GLU   9          2HB       GLU   9 -12.127  10.398  -6.015
   58   1HG   GLU   9          1HG       GLU   9  -9.571   8.899  -6.043
   59   2HG   GLU   9          2HG       GLU   9 -11.220   8.308  -5.875
   60    H    ALA  10           H        ALA  10  -8.583   9.607  -7.523
   61    HA   ALA  10           HA       ALA  10  -6.348  10.263  -5.751
   62   1HB   ALA  10          1HB       ALA  10  -4.995   8.787  -7.231
   63   2HB   ALA  10          2HB       ALA  10  -6.560   8.048  -6.840
   64   3HB   ALA  10          3HB       ALA  10  -6.292   8.765  -8.450
   65    NH1  ARG  11           NH1      ARG  11  -6.594  12.879 -15.624
   66    NH2  ARG  11           NH2      ARG  11  -6.999  14.987 -14.882
   67    H    ARG  11           H        ARG  11  -7.392  11.488  -8.867
   68    HA   ARG  11           HA       ARG  11  -4.936  12.942  -9.673
   69   1HB   ARG  11          1HB       ARG  11  -7.639  13.965 -10.581
   70   2HB   ARG  11          2HB       ARG  11  -6.136  13.772 -11.470
   71   1HG   ARG  11          1HG       ARG  11  -6.754  11.101 -10.887
   72   2HG   ARG  11          2HG       ARG  11  -8.359  11.804 -11.103
   73   1HD   ARG  11          1HD       ARG  11  -6.050  11.729 -13.124
   74   2HD   ARG  11          2HD       ARG  11  -7.671  11.057 -13.312
   75    HE   ARG  11           HE       ARG  11  -8.306  13.743 -13.120
   76   1HH1  ARG  11          1HH1      ARG  11  -7.363  15.588 -14.134
   77   2HH1  ARG  11          2HH1      ARG  11  -6.612  15.291 -15.782
   78   1HH2  ARG  11          1HH2      ARG  11  -6.582  11.874 -15.416
   79   2HH2  ARG  11          2HH2      ARG  11  -6.306  13.328 -16.500
   80    H    ALA  12           H        ALA  12  -8.092  14.213  -8.570
   81    HA   ALA  12           HA       ALA  12  -7.430  16.940  -8.155
   82   1HB   ALA  12          1HB       ALA  12  -9.339  17.084  -6.571
   83   2HB   ALA  12          2HB       ALA  12  -9.752  16.097  -7.987
   84   3HB   ALA  12          3HB       ALA  12  -9.397  15.310  -6.428
   85    H    PHE  13           H        PHE  13  -6.736  14.180  -6.080
   86    HA   PHE  13           HA       PHE  13  -5.874  15.720  -3.702
   87   1HB   PHE  13          1HB       PHE  13  -6.827  13.377  -3.660
   88   2HB   PHE  13          2HB       PHE  13  -5.359  12.762  -4.373
   89    HD1  PHE  13           HD1      PHE  13  -6.935  14.080  -1.291
   90    HD2  PHE  13           HD2      PHE  13  -3.197  12.795  -2.997
   91    HE1  PHE  13           HE1      PHE  13  -5.978  13.831   0.963
   92    HE2  PHE  13           HE2      PHE  13  -2.261  12.550  -0.736
   93    HZ   PHE  13           HZ       PHE  13  -3.644  13.068   1.245
   94    H    LEU  14           H        LEU  14  -4.201  13.883  -6.268
   95    HA   LEU  14           HA       LEU  14  -1.461  14.845  -5.340
   96   1HB   LEU  14          1HB       LEU  14  -1.891  12.909  -7.658
   97   2HB   LEU  14          2HB       LEU  14  -0.485  13.097  -6.631
   98    HG   LEU  14           HG       LEU  14  -3.119  12.051  -5.457
   99   1HD1  LEU  14          1HD1      LEU  14  -0.201  11.525  -4.613
  100   2HD1  LEU  14          2HD1      LEU  14  -1.240  12.767  -3.891
  101   3HD1  LEU  14          3HD1      LEU  14  -1.674  11.047  -3.730
  102   1HD2  LEU  14          1HD2      LEU  14  -2.472   9.726  -5.939
  103   2HD2  LEU  14          2HD2      LEU  14  -2.468  10.607  -7.486
  104   3HD2  LEU  14          3HD2      LEU  14  -0.936  10.244  -6.679
  105    H    SER  15           H        SER  15  -0.955  16.752  -6.097
  106    HA   SER  15           HA       SER  15  -1.970  18.067  -8.505
  107   1HB   SER  15          1HB       SER  15  -0.625  19.890  -7.941
  108   2HB   SER  15          2HB       SER  15  -0.879  19.116  -6.375
  109    HG   SER  15           HG       SER  15   1.244  19.510  -6.547
  110    H    GLU  16           H        GLU  16   0.228  19.092  -9.789
  111    HA   GLU  16           HA       GLU  16   0.967  16.880 -11.655
  112   1HB   GLU  16          1HB       GLU  16   1.405  19.894 -11.690
  113   2HB   GLU  16          2HB       GLU  16   0.354  18.926 -12.705
  114   1HG   GLU  16          1HG       GLU  16   2.750  17.830 -13.476
  115   2HG   GLU  16          2HG       GLU  16   3.355  19.380 -12.916
  116    H    GLU  17           H        GLU  17   2.503  18.868  -9.199
  117    HA   GLU  17           HA       GLU  17   5.321  18.133  -9.845
  118   1HB   GLU  17          1HB       GLU  17   4.170  19.480  -7.347
  119   2HB   GLU  17          2HB       GLU  17   5.880  19.172  -7.582
  120   1HG   GLU  17          1HG       GLU  17   4.078  21.198  -8.957
  121   2HG   GLU  17          2HG       GLU  17   5.391  20.542  -9.919
  122    H    MET  18           H        MET  18   2.789  16.998  -7.671
  123    HA   MET  18           HA       MET  18   4.414  14.985  -6.204
  124   1HB   MET  18          1HB       MET  18   1.508  14.393  -6.289
  125   2HB   MET  18          2HB       MET  18   1.820  16.072  -5.887
  126   1HG   MET  18          1HG       MET  18   2.448  13.590  -4.279
  127   2HG   MET  18          2HG       MET  18   3.626  14.908  -4.164
  128   1HE   MET  18          1HE       MET  18   3.429  16.163  -2.000
  129   2HE   MET  18          2HE       MET  18   1.937  16.172  -1.014
  130   3HE   MET  18          3HE       MET  18   2.702  14.618  -1.459
  131    H    ILE  19           H        ILE  19   2.414  15.056  -9.105
  132    HA   ILE  19           HA       ILE  19   2.084  12.194  -9.555
  133    HB   ILE  19           HB       ILE  19   1.746  14.642 -11.264
  134   1HG1  ILE  19          1HG1      ILE  19  -0.518  14.005 -11.367
  135   2HG1  ILE  19          2HG1      ILE  19  -0.174  12.290 -11.292
  136   1HG2  ILE  19          1HG2      ILE  19   1.357  13.341 -13.372
  137   2HG2  ILE  19          2HG2      ILE  19   3.034  13.176 -12.856
  138   3HG2  ILE  19          3HG2      ILE  19   1.892  11.842 -12.573
  139   1HD1  ILE  19          1HD1      ILE  19  -0.098  14.174  -8.861
  140   2HD1  ILE  19          2HD1      ILE  19  -1.303  12.924  -9.232
  141   3HD1  ILE  19          3HD1      ILE  19   0.363  12.450  -8.828
  142    H    ALA  20           H        ALA  20   4.674  14.478 -10.271
  143    HA   ALA  20           HA       ALA  20   6.221  12.902 -12.174
  144   1HB   ALA  20          1HB       ALA  20   8.081  14.483 -11.679
  145   2HB   ALA  20          2HB       ALA  20   6.544  15.341 -11.899
  146   3HB   ALA  20          3HB       ALA  20   7.209  15.114 -10.262
  147    H    GLU  21           H        GLU  21   6.080  12.919  -8.660
  148    HA   GLU  21           HA       GLU  21   8.629  11.604  -8.070
  149   1HB   GLU  21          1HB       GLU  21   7.226  10.963  -5.848
  150   2HB   GLU  21          2HB       GLU  21   6.117  12.165  -6.479
  151   1HG   GLU  21          1HG       GLU  21   7.476  13.492  -5.104
  152   2HG   GLU  21          2HG       GLU  21   8.267  13.734  -6.652
  153    H    PHE  22           H        PHE  22   5.371  10.426  -8.767
  154    HA   PHE  22           HA       PHE  22   6.028   7.546  -8.133
  155   1HB   PHE  22          1HB       PHE  22   3.416   8.789  -9.198
  156   2HB   PHE  22          2HB       PHE  22   3.633   7.108  -8.796
  157    HD1  PHE  22           HD1      PHE  22   3.059  10.453  -7.378
  158    HD2  PHE  22           HD2      PHE  22   4.048   6.382  -6.387
  159    HE1  PHE  22           HE1      PHE  22   2.562  10.897  -5.011
  160    HE2  PHE  22           HE2      PHE  22   3.545   6.848  -4.023
  161    HZ   PHE  22           HZ       PHE  22   2.784   9.095  -3.333
  162    H    LYS  23           H        LYS  23   5.660   9.699 -10.875
  163    HA   LYS  23           HA       LYS  23   5.346   7.640 -13.012
  164   1HB   LYS  23          1HB       LYS  23   5.167   9.375 -14.522
  165   2HB   LYS  23          2HB       LYS  23   4.680  10.212 -13.064
  166   1HG   LYS  23          1HG       LYS  23   7.205  10.986 -12.886
  167   2HG   LYS  23          2HG       LYS  23   6.099  11.766 -14.004
  168   1HD   LYS  23          1HD       LYS  23   7.077   9.807 -15.683
  169   2HD   LYS  23          2HD       LYS  23   8.473   9.990 -14.615
  170   1HE   LYS  23          1HE       LYS  23   8.543  11.517 -16.666
  171   2HE   LYS  23          2HE       LYS  23   7.105  12.357 -16.067
  172   1HZ   LYS  23          1HZ       LYS  23   9.375  12.105 -14.220
  173   2HZ   LYS  23          2HZ       LYS  23   8.297  13.344 -14.400
  174   3HZ   LYS  23          3HZ       LYS  23   9.533  13.161 -15.481
  175    H    ALA  24           H        ALA  24   8.002   9.299 -11.410
  176    HA   ALA  24           HA       ALA  24  10.265   8.680 -13.095
  177   1HB   ALA  24          1HB       ALA  24  11.640   8.792 -11.026
  178   2HB   ALA  24          2HB       ALA  24  10.461  10.116 -11.088
  179   3HB   ALA  24          3HB       ALA  24  10.179   8.722 -10.014
  180    H    ALA  25           H        ALA  25   8.873   6.761 -10.409
  181    HA   ALA  25           HA       ALA  25  10.525   4.328 -11.082
  182   1HB   ALA  25          1HB       ALA  25   9.553   3.369  -9.001
  183   2HB   ALA  25          2HB       ALA  25  10.241   4.977  -8.705
  184   3HB   ALA  25          3HB       ALA  25   8.474   4.773  -8.817
  185    H    PHE  26           H        PHE  26   8.129   5.455 -12.738
  186    HA   PHE  26           HA       PHE  26   6.183   3.140 -12.775
  187   1HB   PHE  26          1HB       PHE  26   5.390   5.513 -13.112
  188   2HB   PHE  26          2HB       PHE  26   6.307   5.628 -14.590
  189    HD1  PHE  26           HD1      PHE  26   3.609   3.497 -12.962
  190    HD2  PHE  26           HD2      PHE  26   5.219   5.030 -16.645
  191    HE1  PHE  26           HE1      PHE  26   1.720   2.524 -14.206
  192    HE2  PHE  26           HE2      PHE  26   3.322   4.052 -17.872
  193    HZ   PHE  26           HZ       PHE  26   1.556   2.826 -16.654
  194    H    ASP  27           H        ASP  27   8.784   4.581 -14.699
  195    HA   ASP  27           HA       ASP  27   8.701   2.616 -16.922
  196   1HB   ASP  27          1HB       ASP  27  11.154   4.322 -16.271
  197   2HB   ASP  27          2HB       ASP  27   9.710   5.045 -16.941
  198    H    MET  28           H        MET  28  10.497   2.981 -13.901
  199    HA   MET  28           HA       MET  28  12.518   0.965 -14.076
  200   1HB   MET  28          1HB       MET  28  12.479   2.320 -12.079
  201   2HB   MET  28          2HB       MET  28  10.854   1.812 -11.655
  202   1HG   MET  28          1HG       MET  28  13.114  -0.264 -11.747
  203   2HG   MET  28          2HG       MET  28  11.567  -0.353 -10.888
  204   1HE   MET  28          1HE       MET  28  12.745  -1.038  -8.605
  205   2HE   MET  28          2HE       MET  28  12.840   0.326  -7.451
  206   3HE   MET  28          3HE       MET  28  11.354   0.077  -8.415
  207    H    PHE  29           H        PHE  29   9.134   0.566 -12.997
  208    HA   PHE  29           HA       PHE  29   9.289  -2.400 -12.758
  209   1HB   PHE  29          1HB       PHE  29   6.849  -0.522 -12.720
  210   2HB   PHE  29          2HB       PHE  29   6.746  -2.246 -12.481
  211    HD1  PHE  29           HD1      PHE  29   9.349   0.179 -11.135
  212    HD2  PHE  29           HD2      PHE  29   6.129  -2.518 -10.189
  213    HE1  PHE  29           HE1      PHE  29   9.801   0.463  -8.733
  214    HE2  PHE  29           HE2      PHE  29   6.604  -2.224  -7.793
  215    HZ   PHE  29           HZ       PHE  29   8.429  -0.732  -7.060
  216    H    ASP  30           H        ASP  30   8.335  -0.051 -15.196
  217    HA   ASP  30           HA       ASP  30   7.023  -1.785 -17.143
  218   1HB   ASP  30          1HB       ASP  30   8.741   0.480 -18.183
  219   2HB   ASP  30          2HB       ASP  30   7.447   0.901 -17.084
  220    H    ALA  31           H        ALA  31   8.491  -1.595 -19.463
  221    HA   ALA  31           HA       ALA  31  11.180  -2.915 -19.104
  222   1HB   ALA  31          1HB       ALA  31  10.556  -5.039 -20.262
  223   2HB   ALA  31          2HB       ALA  31   9.681  -4.843 -18.731
  224   3HB   ALA  31          3HB       ALA  31   8.842  -4.560 -20.279
  225    H    ASP  32           H        ASP  32   8.513  -2.576 -21.469
  226    HA   ASP  32           HA       ASP  32  10.441  -2.068 -23.744
  227   1HB   ASP  32          1HB       ASP  32   8.068  -1.816 -25.017
  228   2HB   ASP  32          2HB       ASP  32   8.871  -3.346 -24.749
  229    H    GLY  33           H        GLY  33   7.519  -0.456 -22.424
  230   1HA   GLY  33          1HA       GLY  33   7.639   1.964 -21.587
  231   2HA   GLY  33          2HA       GLY  33   8.883   2.245 -22.783
  232    H    GLY  34           H        GLY  34   5.839   0.474 -23.253
  233   1HA   GLY  34          1HA       GLY  34   4.924   2.086 -25.583
  234   2HA   GLY  34          2HA       GLY  34   3.985   0.829 -24.767
  235    H    GLY  35           H        GLY  35   4.167   1.897 -22.123
  236   1HA   GLY  35          1HA       GLY  35   3.702   4.482 -21.328
  237   2HA   GLY  35          2HA       GLY  35   2.231   4.250 -22.282
  238    H    ASP  36           H        ASP  36   1.935   1.441 -21.665
  239    HA   ASP  36           HA       ASP  36   0.995   1.590 -18.751
  240   1HB   ASP  36          1HB       ASP  36  -0.298  -0.417 -20.599
  241   2HB   ASP  36          2HB       ASP  36  -0.952   0.430 -19.216
  242    H    ILE  37           H        ILE  37   1.232  -0.242 -17.474
  243    HA   ILE  37           HA       ILE  37   3.595  -1.995 -18.138
  244    HB   ILE  37           HB       ILE  37   2.299  -2.586 -15.558
  245   1HG1  ILE  37          1HG1      ILE  37   3.054   0.315 -16.103
  246   2HG1  ILE  37          2HG1      ILE  37   1.724  -0.338 -15.165
  247   1HG2  ILE  37          1HG2      ILE  37   4.620  -2.569 -14.730
  248   2HG2  ILE  37          2HG2      ILE  37   4.537  -3.455 -16.260
  249   3HG2  ILE  37          3HG2      ILE  37   5.198  -1.802 -16.229
  250   1HD1  ILE  37          1HD1      ILE  37   4.655  -0.286 -14.226
  251   2HD1  ILE  37          2HD1      ILE  37   3.306   0.706 -13.630
  252   3HD1  ILE  37          3HD1      ILE  37   3.314  -1.046 -13.327
  253    H    SER  38           H        SER  38   3.363  -4.335 -17.222
  254    HA   SER  38           HA       SER  38   0.668  -5.593 -17.894
  255   1HB   SER  38          1HB       SER  38   2.610  -5.513 -19.853
  256   2HB   SER  38          2HB       SER  38   1.308  -6.701 -19.754
  257    HG   SER  38           HG       SER  38   2.715  -8.150 -19.362
  258    H    THR  39           H        THR  39   1.324  -8.192 -17.718
  259    HA   THR  39           HA       THR  39   1.945  -8.576 -14.797
  260    HB   THR  39           HB       THR  39   1.527 -11.144 -15.863
  261    HG1  THR  39           HG1      THR  39   0.786 -10.491 -17.751
  262   1HG2  THR  39          1HG2      THR  39  -0.654 -11.101 -14.735
  263   2HG2  THR  39          2HG2      THR  39   0.532 -10.258 -13.712
  264   3HG2  THR  39          3HG2      THR  39  -0.652  -9.323 -14.664
  265    H    LYS  40           H        LYS  40   3.253  -9.468 -17.976
  266    HA   LYS  40           HA       LYS  40   5.485 -11.112 -17.049
  267   1HB   LYS  40          1HB       LYS  40   4.443 -10.970 -19.398
  268   2HB   LYS  40          2HB       LYS  40   5.408  -9.549 -19.703
  269   1HG   LYS  40          1HG       LYS  40   6.946 -11.055 -20.494
  270   2HG   LYS  40          2HG       LYS  40   7.348 -11.364 -18.826
  271   1HD   LYS  40          1HD       LYS  40   5.458 -13.288 -18.986
  272   2HD   LYS  40          2HD       LYS  40   5.628 -13.021 -20.696
  273   1HE   LYS  40          1HE       LYS  40   7.847 -14.013 -18.850
  274   2HE   LYS  40          2HE       LYS  40   7.038 -14.926 -20.115
  275   1HZ   LYS  40          1HZ       LYS  40   9.139 -12.903 -20.330
  276   2HZ   LYS  40          2HZ       LYS  40   8.028 -12.905 -21.552
  277   3HZ   LYS  40          3HZ       LYS  40   8.900 -14.270 -21.225
  278    H    GLU  41           H        GLU  41   5.027  -7.659 -17.633
  279    HA   GLU  41           HA       GLU  41   7.845  -6.810 -17.475
  280   1HB   GLU  41          1HB       GLU  41   7.155  -4.710 -17.916
  281   2HB   GLU  41          2HB       GLU  41   5.873  -4.734 -16.724
  282   1HG   GLU  41          1HG       GLU  41   5.457  -6.321 -19.300
  283   2HG   GLU  41          2HG       GLU  41   4.268  -5.604 -18.234
  284    H    LEU  42           H        LEU  42   5.149  -6.859 -15.150
  285    HA   LEU  42           HA       LEU  42   6.496  -5.532 -12.911
  286   1HB   LEU  42          1HB       LEU  42   4.325  -7.629 -12.459
  287   2HB   LEU  42          2HB       LEU  42   3.919  -6.155 -13.309
  288    HG   LEU  42           HG       LEU  42   3.712  -6.459 -10.595
  289   1HD1  LEU  42          1HD1      LEU  42   4.389  -3.748 -11.897
  290   2HD1  LEU  42          2HD1      LEU  42   2.825  -4.559 -12.072
  291   3HD1  LEU  42          3HD1      LEU  42   3.373  -4.033 -10.460
  292   1HD2  LEU  42          1HD2      LEU  42   5.512  -5.279  -9.384
  293   2HD2  LEU  42          2HD2      LEU  42   6.250  -6.616 -10.302
  294   3HD2  LEU  42          3HD2      LEU  42   6.391  -4.954 -10.901
  295    H    GLY  43           H        GLY  43   6.248  -8.890 -13.973
  296   1HA   GLY  43          1HA       GLY  43   7.359 -10.931 -13.280
  297   2HA   GLY  43          2HA       GLY  43   7.279 -10.269 -11.642
  298    H    THR  44           H        THR  44   8.909  -8.590 -14.253
  299    HA   THR  44           HA       THR  44  11.592  -9.714 -13.914
  300    HB   THR  44           HB       THR  44  10.967  -6.964 -15.100
  301    HG1  THR  44           HG1      THR  44  10.380  -9.486 -15.924
  302   1HG2  THR  44          1HG2      THR  44  12.968  -7.383 -16.540
  303   2HG2  THR  44          2HG2      THR  44  13.415  -7.321 -14.822
  304   3HG2  THR  44          3HG2      THR  44  13.305  -8.893 -15.655
  305    H    VAL  45           H        VAL  45   9.999  -6.799 -12.658
  306    HA   VAL  45           HA       VAL  45  12.366  -5.714 -11.249
  307    HB   VAL  45           HB       VAL  45   9.633  -4.820 -11.742
  308   1HG1  VAL  45          1HG1      VAL  45  12.058  -3.171 -10.791
  309   2HG1  VAL  45          2HG1      VAL  45  11.830  -3.684 -12.468
  310   3HG1  VAL  45          3HG1      VAL  45  10.642  -2.598 -11.712
  311   1HG2  VAL  45          1HG2      VAL  45   9.131  -3.533  -9.730
  312   2HG2  VAL  45          2HG2      VAL  45   9.363  -5.216  -9.202
  313   3HG2  VAL  45          3HG2      VAL  45  10.650  -4.030  -8.939
  314    H    MET  46           H        MET  46   9.642  -7.805 -10.436
  315    HA   MET  46           HA       MET  46   9.988  -7.982  -7.534
  316   1HB   MET  46          1HB       MET  46   8.760  -9.990  -9.507
  317   2HB   MET  46          2HB       MET  46   8.820 -10.266  -7.775
  318   1HG   MET  46          1HG       MET  46   7.074  -8.355  -9.331
  319   2HG   MET  46          2HG       MET  46   7.641  -7.767  -7.759
  320   1HE   MET  46          1HE       MET  46   5.125  -7.677  -6.820
  321   2HE   MET  46          2HE       MET  46   4.765  -9.043  -5.723
  322   3HE   MET  46          3HE       MET  46   6.338  -8.200  -5.609
  323    NH1  ARG  47           NH1      ARG  47  14.383 -14.280 -13.808
  324    NH2  ARG  47           NH2      ARG  47  16.335 -15.432 -13.638
  325    H    ARG  47           H        ARG  47  11.479  -9.620 -10.276
  326    HA   ARG  47           HA       ARG  47  12.788 -11.855  -8.964
  327   1HB   ARG  47          1HB       ARG  47  12.546 -11.449 -11.499
  328   2HB   ARG  47          2HB       ARG  47  13.913 -10.350 -11.382
  329   1HG   ARG  47          1HG       ARG  47  14.917 -12.638 -10.080
  330   2HG   ARG  47          2HG       ARG  47  13.890 -13.333 -11.334
  331   1HD   ARG  47          1HD       ARG  47  15.132 -11.605 -12.978
  332   2HD   ARG  47          2HD       ARG  47  16.319 -11.499 -11.687
  333    HE   ARG  47           HE       ARG  47  17.163 -13.640 -12.276
  334   1HH1  ARG  47          1HH1      ARG  47  13.849 -13.441 -13.557
  335   2HH1  ARG  47          2HH1      ARG  47  14.061 -15.064 -14.387
  336   1HH2  ARG  47          1HH2      ARG  47  17.288 -15.475 -13.259
  337   2HH2  ARG  47          2HH2      ARG  47  15.876 -16.135 -14.228
  338    H    MET  48           H        MET  48  13.672  -8.464  -9.290
  339    HA   MET  48           HA       MET  48  16.481  -8.432  -8.744
  340   1HB   MET  48          1HB       MET  48  15.661  -6.190  -7.292
  341   2HB   MET  48          2HB       MET  48  14.295  -6.430  -8.365
  342   1HG   MET  48          1HG       MET  48  15.451  -5.729 -10.237
  343   2HG   MET  48          2HG       MET  48  16.928  -6.600  -9.792
  344   1HE   MET  48          1HE       MET  48  15.074  -3.190  -9.895
  345   2HE   MET  48          2HE       MET  48  16.546  -2.193  -9.704
  346   3HE   MET  48          3HE       MET  48  16.475  -3.441 -10.982
  347    H    LEU  49           H        LEU  49  13.757  -8.819  -6.530
  348    HA   LEU  49           HA       LEU  49  14.963  -8.688  -3.939
  349   1HB   LEU  49          1HB       LEU  49  13.310 -10.722  -3.404
  350   2HB   LEU  49          2HB       LEU  49  12.720 -10.450  -5.029
  351    HG   LEU  49           HG       LEU  49  11.421  -8.716  -4.372
  352   1HD1  LEU  49          1HD1      LEU  49  10.913  -8.468  -1.940
  353   2HD1  LEU  49          2HD1      LEU  49  11.070 -10.180  -2.375
  354   3HD1  LEU  49          3HD1      LEU  49  12.395  -9.360  -1.511
  355   1HD2  LEU  49          1HD2      LEU  49  13.810  -7.490  -2.834
  356   2HD2  LEU  49          2HD2      LEU  49  13.320  -7.093  -4.500
  357   3HD2  LEU  49          3HD2      LEU  49  12.253  -6.683  -3.149
  358    H    GLY  50           H        GLY  50  14.395 -11.789  -5.624
  359   1HA   GLY  50          1HA       GLY  50  16.840 -13.009  -6.103
  360   2HA   GLY  50          2HA       GLY  50  16.871 -12.990  -4.334
  361    H    GLN  51           H        GLN  51  14.612 -13.828  -6.968
  362    HA   GLN  51           HA       GLN  51  13.919 -16.497  -5.675
  363   1HB   GLN  51          1HB       GLN  51  12.077 -14.112  -5.742
  364   2HB   GLN  51          2HB       GLN  51  11.370 -15.637  -6.242
  365   1HG   GLN  51          1HG       GLN  51  12.523 -16.544  -3.956
  366   2HG   GLN  51          2HG       GLN  51  12.471 -14.853  -3.512
  367   1HE2  GLN  51          1HE2      GLN  51   9.202 -15.719  -2.235
  368   2HE2  GLN  51          2HE2      GLN  51  10.933 -15.231  -1.871
  369    H    ASN  52           H        ASN  52  11.824 -17.183  -7.248
  370    HA   ASN  52           HA       ASN  52  12.359 -16.505 -10.121
  371   1HB   ASN  52          1HB       ASN  52  13.905 -18.495  -9.290
  372   2HB   ASN  52          2HB       ASN  52  12.470 -19.488  -9.432
  373   1HD2  ASN  52          1HD2      ASN  52  14.312 -19.673 -12.707
  374   2HD2  ASN  52          2HD2      ASN  52  14.596 -20.125 -10.951
  375    HA   PRO  53           HA       PRO  53   7.829 -17.366  -9.048
  376   1HB   PRO  53          1HB       PRO  53   6.640 -15.304 -10.442
  377   2HB   PRO  53          2HB       PRO  53   7.481 -15.101  -8.898
  378   1HG   PRO  53          1HG       PRO  53   8.559 -14.532 -11.701
  379   2HG   PRO  53          2HG       PRO  53   8.682 -13.508 -10.252
  380   1HD   PRO  53          1HD       PRO  53  10.534 -14.780  -9.406
  381   2HD   PRO  53          2HD       PRO  53  10.723 -15.249 -11.122
  382    H    THR  54           H        THR  54   5.807 -17.438 -10.648
  383    HA   THR  54           HA       THR  54   6.577 -18.748 -13.303
  384    HB   THR  54           HB       THR  54   6.079 -20.474 -11.523
  385    HG1  THR  54           HG1      THR  54   5.907 -21.138 -13.531
  386   1HG2  THR  54          1HG2      THR  54   3.735 -21.016 -10.950
  387   2HG2  THR  54          2HG2      THR  54   4.143 -19.398 -10.336
  388   3HG2  THR  54          3HG2      THR  54   3.145 -19.569 -11.803
  389    H    LYS  55           H        LYS  55   4.524 -19.047 -14.657
  390    HA   LYS  55           HA       LYS  55   3.361 -16.386 -15.176
  391   1HB   LYS  55          1HB       LYS  55   1.925 -17.756 -16.913
  392   2HB   LYS  55          2HB       LYS  55   2.870 -19.149 -16.431
  393   1HG   LYS  55          1HG       LYS  55   3.501 -17.209 -18.406
  394   2HG   LYS  55          2HG       LYS  55   4.645 -16.879 -17.117
  395   1HD   LYS  55          1HD       LYS  55   4.423 -19.308 -18.930
  396   2HD   LYS  55          2HD       LYS  55   5.847 -18.458 -18.352
  397   1HE   LYS  55          1HE       LYS  55   5.054 -19.507 -15.961
  398   2HE   LYS  55          2HE       LYS  55   4.323 -20.717 -17.012
  399   1HZ   LYS  55          1HZ       LYS  55   7.132 -20.186 -16.480
  400   2HZ   LYS  55          2HZ       LYS  55   6.802 -20.517 -18.064
  401   3HZ   LYS  55          3HZ       LYS  55   6.389 -21.603 -16.890
  402    H    GLU  56           H        GLU  56   2.266 -19.377 -13.670
  403    HA   GLU  56           HA       GLU  56  -0.602 -18.745 -13.497
  404   1HB   GLU  56          1HB       GLU  56  -0.574 -20.611 -11.680
  405   2HB   GLU  56          2HB       GLU  56   1.129 -20.807 -12.048
  406   1HG   GLU  56          1HG       GLU  56   0.138 -20.995 -14.611
  407   2HG   GLU  56          2HG       GLU  56  -1.302 -21.490 -13.739
  408    H    GLU  57           H        GLU  57   2.178 -18.339 -11.333
  409    HA   GLU  57           HA       GLU  57   0.625 -17.384  -8.981
  410   1HB   GLU  57          1HB       GLU  57   3.585 -17.623  -9.580
  411   2HB   GLU  57          2HB       GLU  57   2.608 -18.483  -8.410
  412   1HG   GLU  57          1HG       GLU  57   4.284 -16.203  -7.947
  413   2HG   GLU  57          2HG       GLU  57   2.651 -15.569  -7.783
  414    H    LEU  58           H        LEU  58   2.325 -15.928 -11.699
  415    HA   LEU  58           HA       LEU  58   2.493 -13.176 -10.656
  416   1HB   LEU  58          1HB       LEU  58   3.439 -14.632 -12.952
  417   2HB   LEU  58          2HB       LEU  58   2.518 -13.281 -13.580
  418    HG   LEU  58           HG       LEU  58   4.671 -12.862 -11.425
  419   1HD1  LEU  58          1HD1      LEU  58   6.312 -12.305 -13.261
  420   2HD1  LEU  58          2HD1      LEU  58   5.852 -14.013 -13.308
  421   3HD1  LEU  58          3HD1      LEU  58   5.150 -12.877 -14.485
  422   1HD2  LEU  58          1HD2      LEU  58   3.500 -10.959 -13.557
  423   2HD2  LEU  58          2HD2      LEU  58   3.097 -10.963 -11.822
  424   3HD2  LEU  58          3HD2      LEU  58   4.738 -10.542 -12.345
  425    H    ASP  59           H        ASP  59   0.261 -14.940 -12.779
  426    HA   ASP  59           HA       ASP  59  -1.435 -12.725 -13.622
  427   1HB   ASP  59          1HB       ASP  59  -1.464 -14.868 -14.838
  428   2HB   ASP  59          2HB       ASP  59  -2.109 -15.712 -13.449
  429    H    ALA  60           H        ALA  60  -1.431 -14.802 -10.780
  430    HA   ALA  60           HA       ALA  60  -4.047 -13.897  -9.681
  431   1HB   ALA  60          1HB       ALA  60  -3.410 -15.221  -7.671
  432   2HB   ALA  60          2HB       ALA  60  -3.175 -16.153  -9.162
  433   3HB   ALA  60          3HB       ALA  60  -1.768 -15.464  -8.312
  434    H    ILE  61           H        ILE  61  -0.658 -13.016  -9.329
  435    HA   ILE  61           HA       ILE  61  -0.790 -11.236  -6.998
  436    HB   ILE  61           HB       ILE  61   1.175 -11.700  -9.202
  437   1HG1  ILE  61          1HG1      ILE  61   1.015 -12.187  -6.368
  438   2HG1  ILE  61          2HG1      ILE  61   2.302 -12.628  -7.470
  439   1HG2  ILE  61          1HG2      ILE  61   2.532  -9.640  -8.732
  440   2HG2  ILE  61          2HG2      ILE  61   0.968  -9.208  -9.419
  441   3HG2  ILE  61          3HG2      ILE  61   1.245  -9.012  -7.672
  442   1HD1  ILE  61          1HD1      ILE  61   2.221  -9.998  -5.877
  443   2HD1  ILE  61          2HD1      ILE  61   3.282 -11.399  -5.613
  444   3HD1  ILE  61          3HD1      ILE  61   3.464 -10.420  -7.087
  445    H    ILE  62           H        ILE  62  -1.460 -10.870 -10.450
  446    HA   ILE  62           HA       ILE  62  -1.907  -7.914 -10.368
  447    HB   ILE  62           HB       ILE  62  -1.772  -9.981 -12.471
  448   1HG1  ILE  62          1HG1      ILE  62  -0.011  -8.382 -12.515
  449   2HG1  ILE  62          2HG1      ILE  62  -1.064  -7.029 -12.158
  450   1HG2  ILE  62          1HG2      ILE  62  -3.257  -8.856 -14.154
  451   2HG2  ILE  62          2HG2      ILE  62  -4.212  -9.460 -12.802
  452   3HG2  ILE  62          3HG2      ILE  62  -3.842  -7.724 -12.911
  453   1HD1  ILE  62          1HD1      ILE  62  -1.993  -6.988 -14.457
  454   2HD1  ILE  62          2HD1      ILE  62  -0.218  -6.932 -14.497
  455   3HD1  ILE  62          3HD1      ILE  62  -1.061  -8.450 -14.884
  456    H    GLU  63           H        GLU  63  -3.805 -10.893 -10.269
  457    HA   GLU  63           HA       GLU  63  -6.495 -10.010 -10.491
  458   1HB   GLU  63          1HB       GLU  63  -5.677 -12.401 -10.119
  459   2HB   GLU  63          2HB       GLU  63  -5.594 -12.062  -8.401
  460   1HG   GLU  63          1HG       GLU  63  -8.205 -11.297  -8.843
  461   2HG   GLU  63          2HG       GLU  63  -8.028 -12.418 -10.182
  462    H    GLU  64           H        GLU  64  -4.560 -10.150  -7.482
  463    HA   GLU  64           HA       GLU  64  -6.439  -8.941  -5.643
  464   1HB   GLU  64          1HB       GLU  64  -3.983  -8.098  -4.641
  465   2HB   GLU  64          2HB       GLU  64  -3.496  -9.452  -5.642
  466   1HG   GLU  64          1HG       GLU  64  -5.806  -9.797  -3.651
  467   2HG   GLU  64          2HG       GLU  64  -4.777 -11.036  -4.349
  468    H    VAL  65           H        VAL  65  -4.074  -7.530  -7.871
  469    HA   VAL  65           HA       VAL  65  -5.034  -4.703  -7.237
  470    HB   VAL  65           HB       VAL  65  -3.064  -3.840  -8.377
  471   1HG1  VAL  65          1HG1      VAL  65  -1.292  -4.595  -6.781
  472   2HG1  VAL  65          2HG1      VAL  65  -2.841  -4.377  -5.946
  473   3HG1  VAL  65          3HG1      VAL  65  -2.264  -6.017  -6.328
  474   1HG2  VAL  65          1HG2      VAL  65  -2.176  -6.753  -8.942
  475   2HG2  VAL  65          2HG2      VAL  65  -2.654  -5.544 -10.158
  476   3HG2  VAL  65          3HG2      VAL  65  -1.188  -5.294  -9.199
  477    H    ASP  66           H        ASP  66  -6.988  -5.927  -8.378
  478    HA   ASP  66           HA       ASP  66  -7.270  -4.662 -11.089
  479   1HB   ASP  66          1HB       ASP  66  -8.227  -7.281 -11.654
  480   2HB   ASP  66          2HB       ASP  66  -6.682  -7.546 -10.878
  481    H    GLU  67           H        GLU  67  -8.668  -3.530  -9.595
  482    HA   GLU  67           HA       GLU  67 -11.167  -4.779  -8.521
  483   1HB   GLU  67          1HB       GLU  67  -9.824  -2.412  -7.970
  484   2HB   GLU  67          2HB       GLU  67 -11.172  -1.816  -8.919
  485   1HG   GLU  67          1HG       GLU  67 -11.303  -2.121  -6.228
  486   2HG   GLU  67          2HG       GLU  67 -11.765  -3.764  -6.639
  487    H    ASP  68           H        ASP  68 -10.094  -3.110 -11.429
  488    HA   ASP  68           HA       ASP  68 -12.834  -2.854 -12.636
  489   1HB   ASP  68          1HB       ASP  68 -11.822  -1.155 -13.693
  490   2HB   ASP  68          2HB       ASP  68 -11.121  -2.353 -14.757
  491    H    GLY  69           H        GLY  69 -10.034  -4.983 -12.807
  492   1HA   GLY  69          1HA       GLY  69  -9.960  -7.344 -13.476
  493   2HA   GLY  69          2HA       GLY  69 -11.671  -7.235 -13.910
  494    H    SER  70           H        SER  70  -8.849  -5.348 -14.994
  495    HA   SER  70           HA       SER  70  -9.596  -5.666 -17.913
  496   1HB   SER  70          1HB       SER  70  -8.930  -3.478 -17.626
  497   2HB   SER  70          2HB       SER  70  -7.395  -4.188 -18.134
  498    HG   SER  70           HG       SER  70  -7.784  -2.845 -16.023
  499    H    GLY  71           H        GLY  71  -6.434  -5.829 -16.250
  500   1HA   GLY  71          1HA       GLY  71  -5.598  -8.223 -17.971
  501   2HA   GLY  71          2HA       GLY  71  -5.510  -8.391 -16.212
  502    H    THR  72           H        THR  72  -4.892  -5.395 -17.954
  503    HA   THR  72           HA       THR  72  -1.935  -5.512 -17.171
  504    HB   THR  72           HB       THR  72  -1.692  -3.591 -18.928
  505    HG1  THR  72           HG1      THR  72  -3.159  -3.913 -20.661
  506   1HG2  THR  72          1HG2      THR  72  -1.255  -5.132 -20.798
  507   2HG2  THR  72          2HG2      THR  72  -0.644  -5.863 -19.298
  508   3HG2  THR  72          3HG2      THR  72  -2.168  -6.444 -20.020
  509    H    ILE  73           H        ILE  73  -1.033  -3.659 -16.242
  510    HA   ILE  73           HA       ILE  73  -2.984  -1.871 -14.730
  511    HB   ILE  73           HB       ILE  73  -0.012  -2.381 -14.195
  512   1HG1  ILE  73          1HG1      ILE  73  -1.928  -4.255 -13.727
  513   2HG1  ILE  73          2HG1      ILE  73  -2.234  -3.278 -12.306
  514   1HG2  ILE  73          1HG2      ILE  73  -0.303  -1.115 -12.069
  515   2HG2  ILE  73          2HG2      ILE  73  -0.740  -0.081 -13.436
  516   3HG2  ILE  73          3HG2      ILE  73  -2.017  -0.807 -12.430
  517   1HD1  ILE  73          1HD1      ILE  73   0.080  -3.568 -11.464
  518   2HD1  ILE  73          2HD1      ILE  73  -0.674  -5.141 -11.795
  519   3HD1  ILE  73          3HD1      ILE  73   0.525  -4.481 -12.932
  520    H    ASP  74           H        ASP  74  -2.458   0.402 -14.558
  521    HA   ASP  74           HA       ASP  74  -0.785   1.611 -16.798
  522   1HB   ASP  74          1HB       ASP  74  -2.467   2.912 -17.768
  523   2HB   ASP  74          2HB       ASP  74  -3.517   2.841 -16.372
  524    H    PHE  75           H        PHE  75  -0.808   4.093 -16.487
  525    HA   PHE  75           HA       PHE  75   0.329   4.730 -13.856
  526   1HB   PHE  75          1HB       PHE  75   0.960   5.848 -16.070
  527   2HB   PHE  75          2HB       PHE  75  -0.549   6.719 -16.035
  528    HD1  PHE  75           HD1      PHE  75   0.661   6.309 -12.651
  529    HD2  PHE  75           HD2      PHE  75   1.221   8.693 -16.190
  530    HE1  PHE  75           HE1      PHE  75   1.648   8.109 -11.295
  531    HE2  PHE  75           HE2      PHE  75   2.214  10.479 -14.815
  532    HZ   PHE  75           HZ       PHE  75   2.408  10.201 -12.369
  533    H    GLU  76           H        GLU  76  -2.818   5.171 -15.366
  534    HA   GLU  76           HA       GLU  76  -4.012   7.096 -13.527
  535   1HB   GLU  76          1HB       GLU  76  -5.267   7.013 -15.419
  536   2HB   GLU  76          2HB       GLU  76  -6.250   6.026 -14.357
  537   1HG   GLU  76          1HG       GLU  76  -4.547   5.123 -16.731
  538   2HG   GLU  76          2HG       GLU  76  -4.946   3.974 -15.471
  539    H    GLU  77           H        GLU  77  -4.372   3.544 -13.704
  540    HA   GLU  77           HA       GLU  77  -5.850   3.303 -11.137
  541   1HB   GLU  77          1HB       GLU  77  -6.401   1.287 -11.875
  542   2HB   GLU  77          2HB       GLU  77  -5.554   1.662 -13.358
  543   1HG   GLU  77          1HG       GLU  77  -4.295   0.191 -10.953
  544   2HG   GLU  77          2HG       GLU  77  -3.455   0.556 -12.456
  545    H    PHE  78           H        PHE  78  -2.496   3.339 -12.041
  546    HA   PHE  78           HA       PHE  78  -1.341   1.851  -9.784
  547   1HB   PHE  78          1HB       PHE  78  -0.068   4.060 -11.519
  548   2HB   PHE  78          2HB       PHE  78  -0.064   2.356 -11.894
  549    HD1  PHE  78           HD1      PHE  78   0.600   1.208  -9.104
  550    HD2  PHE  78           HD2      PHE  78   2.232   4.578 -11.224
  551    HE1  PHE  78           HE1      PHE  78   2.738   0.936  -7.914
  552    HE2  PHE  78           HE2      PHE  78   4.363   4.288 -10.027
  553    HZ   PHE  78           HZ       PHE  78   4.625   2.463  -8.383
  554    H    LEU  79           H        LEU  79  -2.202   5.240 -10.342
  555    HA   LEU  79           HA       LEU  79  -1.063   6.327  -7.833
  556   1HB   LEU  79          1HB       LEU  79  -2.526   8.365  -8.365
  557   2HB   LEU  79          2HB       LEU  79  -3.157   7.506  -9.753
  558    HG   LEU  79           HG       LEU  79  -0.555   7.289 -10.441
  559   1HD1  LEU  79          1HD1      LEU  79  -0.805   9.360 -11.811
  560   2HD1  LEU  79          2HD1      LEU  79  -2.316   8.431 -11.802
  561   3HD1  LEU  79          3HD1      LEU  79  -2.172   9.897 -10.801
  562   1HD2  LEU  79          1HD2      LEU  79  -0.529   9.825  -8.670
  563   2HD2  LEU  79          2HD2      LEU  79   0.416   8.342  -8.392
  564   3HD2  LEU  79          3HD2      LEU  79   0.752   9.344  -9.811
  565    H    VAL  80           H        VAL  80  -4.164   4.989  -8.820
  566    HA   VAL  80           HA       VAL  80  -5.693   5.742  -6.400
  567    HB   VAL  80           HB       VAL  80  -6.529   3.376  -8.095
  568   1HG1  VAL  80          1HG1      VAL  80  -6.929   6.268  -9.080
  569   2HG1  VAL  80          2HG1      VAL  80  -5.674   5.197  -9.717
  570   3HG1  VAL  80          3HG1      VAL  80  -7.387   4.757  -9.907
  571   1HG2  VAL  80          1HG2      VAL  80  -8.808   4.213  -7.742
  572   2HG2  VAL  80          2HG2      VAL  80  -8.006   4.204  -6.154
  573   3HG2  VAL  80          3HG2      VAL  80  -8.213   5.730  -7.025
  574    H    MET  81           H        MET  81  -3.642   3.060  -7.378
  575    HA   MET  81           HA       MET  81  -4.329   1.061  -5.331
  576   1HB   MET  81          1HB       MET  81  -1.573   1.407  -6.646
  577   2HB   MET  81          2HB       MET  81  -2.937   0.650  -7.447
  578   1HG   MET  81          1HG       MET  81  -1.532  -0.374  -4.903
  579   2HG   MET  81          2HG       MET  81  -3.041  -1.067  -5.520
  580   1HE   MET  81          1HE       MET  81  -1.017  -3.155  -5.230
  581   2HE   MET  81          2HE       MET  81   0.232  -3.390  -6.489
  582   3HE   MET  81          3HE       MET  81   0.412  -2.075  -5.292
  583    H    MET  82           H        MET  82  -1.752   3.534  -5.512
  584    HA   MET  82           HA       MET  82  -0.718   2.992  -2.774
  585   1HB   MET  82          1HB       MET  82   0.552   5.281  -3.327
  586   2HB   MET  82          2HB       MET  82  -0.033   5.004  -4.956
  587   1HG   MET  82          1HG       MET  82   1.031   2.538  -4.598
  588   2HG   MET  82          2HG       MET  82   2.018   3.917  -5.098
  589   1HE   MET  82          1HE       MET  82   3.044   1.224  -1.787
  590   2HE   MET  82          2HE       MET  82   3.550   1.327  -3.499
  591   3HE   MET  82          3HE       MET  82   1.838   1.008  -3.095
  592    H    VAL  83           H        VAL  83  -3.027   5.183  -4.241
  593    HA   VAL  83           HA       VAL  83  -3.082   7.262  -2.158
  594    HB   VAL  83           HB       VAL  83  -4.765   6.644  -4.569
  595   1HG1  VAL  83          1HG1      VAL  83  -6.506   8.342  -3.988
  596   2HG1  VAL  83          2HG1      VAL  83  -6.573   6.973  -2.869
  597   3HG1  VAL  83          3HG1      VAL  83  -5.832   8.504  -2.345
  598   1HG2  VAL  83          1HG2      VAL  83  -3.567   9.291  -3.510
  599   2HG2  VAL  83          2HG2      VAL  83  -2.855   8.261  -4.774
  600   3HG2  VAL  83          3HG2      VAL  83  -4.401   9.070  -5.070
  601    NH1  ARG  84           NH1      ARG  84  -9.882  -0.455  -2.523
  602    NH2  ARG  84           NH2      ARG  84 -11.846   0.158  -3.487
  603    H    ARG  84           H        ARG  84  -4.819   4.241  -2.732
  604    HA   ARG  84           HA       ARG  84  -6.950   4.591  -0.673
  605   1HB   ARG  84          1HB       ARG  84  -6.258   2.593  -2.714
  606   2HB   ARG  84          2HB       ARG  84  -6.541   1.793  -1.175
  607   1HG   ARG  84          1HG       ARG  84  -8.584   3.889  -1.922
  608   2HG   ARG  84          2HG       ARG  84  -8.804   2.355  -1.075
  609   1HD   ARG  84          1HD       ARG  84  -8.146   1.260  -3.443
  610   2HD   ARG  84          2HD       ARG  84  -8.593   2.836  -4.100
  611    HE   ARG  84           HE       ARG  84 -10.934   2.467  -3.156
  612   1HH1  ARG  84          1HH1      ARG  84  -8.938  -0.181  -2.229
  613   2HH1  ARG  84          2HH1      ARG  84 -10.308  -1.384  -2.436
  614   1HH2  ARG  84          1HH2      ARG  84 -12.424   0.913  -3.872
  615   2HH2  ARG  84          2HH2      ARG  84 -12.113  -0.827  -3.380
  616    H    GLN  85           H        GLN  85  -3.757   3.060  -0.845
  617    HA   GLN  85           HA       GLN  85  -3.875   1.690   1.792
  618   1HB   GLN  85          1HB       GLN  85  -1.606   2.233  -0.188
  619   2HB   GLN  85          2HB       GLN  85  -1.283   1.562   1.400
  620   1HG   GLN  85          1HG       GLN  85  -2.236   0.207  -1.002
  621   2HG   GLN  85          2HG       GLN  85  -3.450  -0.002   0.241
  622   1HE2  GLN  85          1HE2      GLN  85  -0.655  -1.548   2.416
  623   2HE2  GLN  85          2HE2      GLN  85  -1.698  -0.043   2.540
  624    H    MET  86           H        MET  86  -2.800   4.810   0.572
  625    HA   MET  86           HA       MET  86  -1.161   5.716   2.825
  626   1HB   MET  86          1HB       MET  86  -0.761   7.502   1.526
  627   2HB   MET  86          2HB       MET  86  -1.735   6.714   0.300
  628   1HG   MET  86          1HG       MET  86  -3.106   8.535   2.356
  629   2HG   MET  86          2HG       MET  86  -3.731   7.954   0.807
  630   1HE   MET  86          1HE       MET  86  -4.129   9.768  -0.898
  631   2HE   MET  86          2HE       MET  86  -2.747  10.566  -1.705
  632   3HE   MET  86          3HE       MET  86  -2.832   8.781  -1.642
  633    H    LYS  87           H        LYS  87  -4.603   6.002   2.032
  634    HA   LYS  87           HA       LYS  87  -5.568   7.888   3.951
  635   1HB   LYS  87          1HB       LYS  87  -7.667   6.135   4.059
  636   2HB   LYS  87          2HB       LYS  87  -6.847   5.469   2.655
  637   1HG   LYS  87          1HG       LYS  87  -6.922   7.676   1.490
  638   2HG   LYS  87          2HG       LYS  87  -8.521   7.053   1.861
  639   1HD   LYS  87          1HD       LYS  87  -7.835   8.686   4.118
  640   2HD   LYS  87          2HD       LYS  87  -7.175   9.539   2.727
  641   1HE   LYS  87          1HE       LYS  87 -10.131   8.654   2.980
  642   2HE   LYS  87          2HE       LYS  87  -9.533  10.294   3.267
  643   1HZ   LYS  87          1HZ       LYS  87  -9.049  10.578   1.018
  644   2HZ   LYS  87          2HZ       LYS  87 -10.454   9.711   0.963
  645   3HZ   LYS  87          3HZ       LYS  87  -9.010   8.962   0.675
  646    H    GLU  88           H        GLU  88  -4.813   7.923   5.954
  647    HA   GLU  88           HA       GLU  88  -4.290   5.490   7.623
  648   1HB   GLU  88          1HB       GLU  88  -4.311   8.302   8.772
  649   2HB   GLU  88          2HB       GLU  88  -3.059   7.861   7.628
  650   1HG   GLU  88          1HG       GLU  88  -2.173   6.125   9.107
  651   2HG   GLU  88          2HG       GLU  88  -3.600   6.150  10.128
  652    H    ASP  89           H        ASP  89  -6.732   8.008   7.271
  653    HA   ASP  89           HA       ASP  89  -8.300   7.356   9.712
  654   1HB   ASP  89          1HB       ASP  89  -9.697   8.798   7.466
  655   2HB   ASP  89          2HB       ASP  89  -8.255   9.570   8.083
  656    H    ALA  90           H        ALA  90 -10.494   6.550   9.651
  657    HA   ALA  90           HA       ALA  90 -11.414   4.821   7.348
  658   1HB   ALA  90          1HB       ALA  90 -11.437   2.696   8.682
  659   2HB   ALA  90          2HB       ALA  90  -9.777   3.291   8.476
  660   3HB   ALA  90          3HB       ALA  90 -10.607   3.503  10.037
   
  Start of MODEL          23
 Raw file had  660 H/Q atoms
  Start of MODEL   23
    1   1H    ALA   1          1H        ALA   1 -14.891  14.518 -13.465
    2   2H    ALA   1          2H        ALA   1 -16.546  14.746 -13.267
    3   3H    ALA   1          3H        ALA   1 -15.636  14.073 -12.024
    4    HA   ALA   1           HA       ALA   1 -16.422  12.908 -14.610
    5   1HB   ALA   1          1HB       ALA   1 -14.747  11.219 -14.498
    6   2HB   ALA   1          2HB       ALA   1 -14.370  11.532 -12.793
    7   3HB   ALA   1          3HB       ALA   1 -13.837  12.680 -14.047
    8    H    SER   2           H        SER   2 -17.897  11.314 -14.333
    9    HA   SER   2           HA       SER   2 -18.551  10.260 -11.538
   10   1HB   SER   2          1HB       SER   2 -20.900  10.849 -13.350
   11   2HB   SER   2          2HB       SER   2 -20.811  10.783 -11.588
   12    HG   SER   2           HG       SER   2 -20.683  12.835 -11.744
   13    H    MET   3           H        MET   3 -17.035   9.157 -13.731
   14    HA   MET   3           HA       MET   3 -18.764   6.744 -14.507
   15   1HB   MET   3          1HB       MET   3 -16.374   7.285 -16.230
   16   2HB   MET   3          2HB       MET   3 -17.963   6.679 -16.657
   17   1HG   MET   3          1HG       MET   3 -18.560   9.342 -15.979
   18   2HG   MET   3          2HG       MET   3 -16.929   9.490 -16.645
   19   1HE   MET   3          1HE       MET   3 -19.694  10.769 -18.626
   20   2HE   MET   3          2HE       MET   3 -20.257   9.888 -17.175
   21   3HE   MET   3          3HE       MET   3 -20.766   9.343 -18.800
   22    H    THR   4           H        THR   4 -15.332   7.755 -14.281
   23    HA   THR   4           HA       THR   4 -14.650   5.087 -12.990
   24    HB   THR   4           HB       THR   4 -12.214   5.801 -13.689
   25    HG1  THR   4           HG1      THR   4 -13.107   6.845 -15.939
   26   1HG2  THR   4          1HG2      THR   4 -14.233   4.764 -15.773
   27   2HG2  THR   4          2HG2      THR   4 -13.233   3.769 -14.691
   28   3HG2  THR   4          3HG2      THR   4 -12.468   4.741 -15.975
   29    H    ASP   5           H        ASP   5 -15.020   5.498 -10.876
   30    HA   ASP   5           HA       ASP   5 -14.311   8.027  -9.487
   31   1HB   ASP   5          1HB       ASP   5 -14.813   6.361  -7.380
   32   2HB   ASP   5          2HB       ASP   5 -15.596   5.430  -8.637
   33    H    GLN   6           H        GLN   6 -12.811   4.912 -10.008
   34    HA   GLN   6           HA       GLN   6 -10.824   4.612  -8.020
   35   1HB   GLN   6          1HB       GLN   6  -9.327   3.605  -9.810
   36   2HB   GLN   6          2HB       GLN   6 -10.448   4.175 -11.032
   37   1HG   GLN   6          1HG       GLN   6 -11.176   2.183  -8.799
   38   2HG   GLN   6          2HG       GLN   6 -12.285   2.750 -10.028
   39   1HE2  GLN   6          1HE2      GLN   6  -9.166   0.412 -11.514
   40   2HE2  GLN   6          2HE2      GLN   6  -8.845   1.662 -10.209
   41    H    GLN   7           H        GLN   7  -9.755   5.952 -11.123
   42    HA   GLN   7           HA       GLN   7  -7.439   7.368  -9.965
   43   1HB   GLN   7          1HB       GLN   7  -7.233   8.444 -12.283
   44   2HB   GLN   7          2HB       GLN   7  -7.171   6.688 -12.221
   45   1HG   GLN   7          1HG       GLN   7  -8.658   6.707 -13.925
   46   2HG   GLN   7          2HG       GLN   7  -9.885   7.022 -12.708
   47   1HE2  GLN   7          1HE2      GLN   7 -10.571   9.838 -14.922
   48   2HE2  GLN   7          2HE2      GLN   7 -11.038   8.124 -14.464
   49    H    ALA   8           H        ALA   8 -10.746   8.278 -10.749
   50    HA   ALA   8           HA       ALA   8 -10.750  11.107 -10.866
   51   1HB   ALA   8          1HB       ALA   8 -13.051  11.045  -9.918
   52   2HB   ALA   8          2HB       ALA   8 -12.808   9.751 -11.107
   53   3HB   ALA   8          3HB       ALA   8 -12.815   9.370  -9.366
   54    H    GLU   9           H        GLU   9 -11.699   9.575  -7.806
   55    HA   GLU   9           HA       GLU   9 -11.269  11.801  -6.069
   56   1HB   GLU   9          1HB       GLU   9 -11.231   8.799  -5.431
   57   2HB   GLU   9          2HB       GLU   9 -10.933  10.001  -4.184
   58   1HG   GLU   9          1HG       GLU   9 -13.251  11.090  -5.086
   59   2HG   GLU   9          2HG       GLU   9 -13.535   9.456  -5.676
   60    H    ALA  10           H        ALA  10  -9.054   8.999  -6.385
   61    HA   ALA  10           HA       ALA  10  -6.921   9.821  -4.689
   62   1HB   ALA  10          1HB       ALA  10  -5.443   8.322  -6.018
   63   2HB   ALA  10          2HB       ALA  10  -7.024   7.573  -5.726
   64   3HB   ALA  10          3HB       ALA  10  -6.643   8.249  -7.331
   65    NH1  ARG  11           NH1      ARG  11  -9.117  15.850 -13.733
   66    NH2  ARG  11           NH2      ARG  11  -8.815  17.692 -12.437
   67    H    ARG  11           H        ARG  11  -7.744  10.943  -7.904
   68    HA   ARG  11           HA       ARG  11  -5.203  12.208  -8.715
   69   1HB   ARG  11          1HB       ARG  11  -6.637  11.877 -10.541
   70   2HB   ARG  11          2HB       ARG  11  -8.076  12.346  -9.649
   71   1HG   ARG  11          1HG       ARG  11  -7.105  14.793  -9.644
   72   2HG   ARG  11          2HG       ARG  11  -5.987  14.221 -10.885
   73   1HD   ARG  11          1HD       ARG  11  -7.624  14.063 -12.518
   74   2HD   ARG  11          2HD       ARG  11  -8.856  13.454 -11.411
   75    HE   ARG  11           HE       ARG  11  -8.987  15.985 -10.578
   76   1HH1  ARG  11          1HH1      ARG  11  -9.144  14.826 -13.790
   77   2HH1  ARG  11          2HH1      ARG  11  -9.265  16.513 -14.501
   78   1HH2  ARG  11          1HH2      ARG  11  -8.609  18.073 -11.507
   79   2HH2  ARG  11          2HH2      ARG  11  -8.985  18.226 -13.297
   80    H    ALA  12           H        ALA  12  -8.244  13.575  -7.417
   81    HA   ALA  12           HA       ALA  12  -7.364  16.349  -7.192
   82   1HB   ALA  12          1HB       ALA  12  -9.335  16.696  -5.718
   83   2HB   ALA  12          2HB       ALA  12  -9.762  15.736  -7.149
   84   3HB   ALA  12          3HB       ALA  12  -9.572  14.938  -5.567
   85    H    PHE  13           H        PHE  13  -7.075  13.564  -5.052
   86    HA   PHE  13           HA       PHE  13  -6.273  14.935  -2.591
   87   1HB   PHE  13          1HB       PHE  13  -7.153  12.535  -2.855
   88   2HB   PHE  13          2HB       PHE  13  -5.563  12.053  -3.388
   89    HD1  PHE  13           HD1      PHE  13  -7.485  13.486  -0.484
   90    HD2  PHE  13           HD2      PHE  13  -3.758  11.732  -1.733
   91    HE1  PHE  13           HE1      PHE  13  -6.833  13.167   1.868
   92    HE2  PHE  13           HE2      PHE  13  -3.125  11.422   0.624
   93    HZ   PHE  13           HZ       PHE  13  -4.655  12.139   2.426
   94    H    LEU  14           H        LEU  14  -4.481  13.459  -5.287
   95    HA   LEU  14           HA       LEU  14  -1.772  14.253  -4.188
   96   1HB   LEU  14          1HB       LEU  14  -0.805  13.023  -6.064
   97   2HB   LEU  14          2HB       LEU  14  -2.342  12.922  -6.894
   98    HG   LEU  14           HG       LEU  14  -3.076  11.573  -4.640
   99   1HD1  LEU  14          1HD1      LEU  14  -2.613   9.456  -5.879
  100   2HD1  LEU  14          2HD1      LEU  14  -3.241  10.699  -6.976
  101   3HD1  LEU  14          3HD1      LEU  14  -1.503  10.310  -6.980
  102   1HD2  LEU  14          1HD2      LEU  14  -0.039  11.011  -4.829
  103   2HD2  LEU  14          2HD2      LEU  14  -0.881  11.775  -3.458
  104   3HD2  LEU  14          3HD2      LEU  14  -1.209  10.082  -3.858
  105    H    SER  15           H        SER  15  -0.276  15.400  -5.619
  106    HA   SER  15           HA       SER  15  -1.659  17.710  -7.095
  107   1HB   SER  15          1HB       SER  15  -0.203  19.279  -6.112
  108   2HB   SER  15          2HB       SER  15   0.998  18.070  -5.652
  109    HG   SER  15           HG       SER  15  -0.112  18.588  -3.860
  110    H    GLU  16           H        GLU  16   0.641  18.935  -8.024
  111    HA   GLU  16           HA       GLU  16   1.391  17.192 -10.354
  112   1HB   GLU  16          1HB       GLU  16   0.768  19.441 -10.901
  113   2HB   GLU  16          2HB       GLU  16   1.862  20.145  -9.727
  114   1HG   GLU  16          1HG       GLU  16   3.827  19.179 -11.148
  115   2HG   GLU  16          2HG       GLU  16   2.635  18.736 -12.358
  116    H    GLU  17           H        GLU  17   2.920  18.783  -7.589
  117    HA   GLU  17           HA       GLU  17   5.653  17.631  -8.155
  118   1HB   GLU  17          1HB       GLU  17   5.027  20.001  -7.104
  119   2HB   GLU  17          2HB       GLU  17   4.982  19.120  -5.588
  120   1HG   GLU  17          1HG       GLU  17   7.367  19.682  -7.414
  121   2HG   GLU  17          2HG       GLU  17   7.426  18.249  -6.402
  122    H    MET  18           H        MET  18   3.298  15.875  -7.558
  123    HA   MET  18           HA       MET  18   4.586  14.233  -5.311
  124   1HB   MET  18          1HB       MET  18   2.012  13.416  -5.013
  125   2HB   MET  18          2HB       MET  18   1.680  15.041  -5.583
  126   1HG   MET  18          1HG       MET  18   2.729  16.084  -3.679
  127   2HG   MET  18          2HG       MET  18   3.614  14.614  -3.239
  128   1HE   MET  18          1HE       MET  18   2.241  15.878  -0.866
  129   2HE   MET  18          2HE       MET  18   1.268  14.544  -0.178
  130   3HE   MET  18          3HE       MET  18   2.912  14.218  -0.803
  131    H    ILE  19           H        ILE  19   2.405  14.299  -8.129
  132    HA   ILE  19           HA       ILE  19   2.331  11.406  -8.622
  133    HB   ILE  19           HB       ILE  19   1.445  13.836 -10.141
  134   1HG1  ILE  19          1HG1      ILE  19   0.199  11.220  -9.161
  135   2HG1  ILE  19          2HG1      ILE  19  -0.566  12.062 -10.492
  136   1HG2  ILE  19          1HG2      ILE  19   0.968  12.584 -12.259
  137   2HG2  ILE  19          2HG2      ILE  19   2.705  12.641 -11.966
  138   3HG2  ILE  19          3HG2      ILE  19   1.805  11.146 -11.625
  139   1HD1  ILE  19          1HD1      ILE  19  -0.939  14.108  -9.142
  140   2HD1  ILE  19          2HD1      ILE  19  -1.595  12.682  -8.311
  141   3HD1  ILE  19          3HD1      ILE  19  -0.056  13.390  -7.766
  142    H    ALA  20           H        ALA  20   4.434  14.057  -9.640
  143    HA   ALA  20           HA       ALA  20   6.047  12.783 -11.667
  144   1HB   ALA  20          1HB       ALA  20   7.774  14.502 -11.141
  145   2HB   ALA  20          2HB       ALA  20   6.151  15.214 -11.218
  146   3HB   ALA  20          3HB       ALA  20   6.927  14.936  -9.638
  147    H    GLU  21           H        GLU  21   6.210  12.643  -8.138
  148    HA   GLU  21           HA       GLU  21   8.888  11.531  -7.794
  149   1HB   GLU  21          1HB       GLU  21   7.760  10.608  -5.550
  150   2HB   GLU  21          2HB       GLU  21   6.424  11.640  -6.021
  151   1HG   GLU  21          1HG       GLU  21   9.281  12.768  -5.874
  152   2HG   GLU  21          2HG       GLU  21   7.767  13.656  -5.849
  153    H    PHE  22           H        PHE  22   5.723  10.115  -8.425
  154    HA   PHE  22           HA       PHE  22   6.601   7.261  -8.140
  155   1HB   PHE  22          1HB       PHE  22   3.965   8.316  -9.334
  156   2HB   PHE  22          2HB       PHE  22   4.317   6.670  -8.880
  157    HD1  PHE  22           HD1      PHE  22   3.977  10.116  -7.365
  158    HD2  PHE  22           HD2      PHE  22   4.001   5.874  -6.631
  159    HE1  PHE  22           HE1      PHE  22   3.127  10.494  -5.088
  160    HE2  PHE  22           HE2      PHE  22   3.186   6.277  -4.344
  161    HZ   PHE  22           HZ       PHE  22   2.729   8.580  -3.575
  162    H    LYS  23           H        LYS  23   6.155   9.652 -10.677
  163    HA   LYS  23           HA       LYS  23   6.095   8.167 -13.116
  164   1HB   LYS  23          1HB       LYS  23   7.316  10.854 -12.393
  165   2HB   LYS  23          2HB       LYS  23   7.791  10.145 -13.921
  166   1HG   LYS  23          1HG       LYS  23   5.238   9.942 -14.469
  167   2HG   LYS  23          2HG       LYS  23   4.965  10.921 -13.038
  168   1HD   LYS  23          1HD       LYS  23   5.151  12.079 -15.435
  169   2HD   LYS  23          2HD       LYS  23   5.784  12.888 -13.997
  170   1HE   LYS  23          1HE       LYS  23   8.097  12.240 -14.518
  171   2HE   LYS  23          2HE       LYS  23   7.577  11.109 -15.775
  172   1HZ   LYS  23          1HZ       LYS  23   7.109  12.829 -17.219
  173   2HZ   LYS  23          2HZ       LYS  23   8.372  13.498 -16.390
  174   3HZ   LYS  23          3HZ       LYS  23   6.822  13.949 -16.038
  175    H    ALA  24           H        ALA  24   8.922   9.040 -11.127
  176    HA   ALA  24           HA       ALA  24  11.055   8.044 -12.811
  177   1HB   ALA  24          1HB       ALA  24  12.448   8.006 -10.751
  178   2HB   ALA  24          2HB       ALA  24  11.483   9.491 -10.848
  179   3HB   ALA  24          3HB       ALA  24  11.000   8.188  -9.732
  180    H    ALA  25           H        ALA  25   9.452   6.442 -10.036
  181    HA   ALA  25           HA       ALA  25  10.847   3.843 -10.397
  182   1HB   ALA  25          1HB       ALA  25   9.421   3.069  -8.512
  183   2HB   ALA  25          2HB       ALA  25  10.161   4.639  -8.148
  184   3HB   ALA  25          3HB       ALA  25   8.439   4.551  -8.598
  185    H    PHE  26           H        PHE  26   8.188   5.275 -11.962
  186    HA   PHE  26           HA       PHE  26   6.396   2.909 -12.258
  187   1HB   PHE  26          1HB       PHE  26   5.433   5.172 -12.393
  188   2HB   PHE  26          2HB       PHE  26   6.420   5.589 -13.767
  189    HD1  PHE  26           HD1      PHE  26   3.637   3.312 -12.630
  190    HD2  PHE  26           HD2      PHE  26   5.694   4.962 -16.030
  191    HE1  PHE  26           HE1      PHE  26   1.841   2.519 -14.115
  192    HE2  PHE  26           HE2      PHE  26   3.891   4.154 -17.500
  193    HZ   PHE  26           HZ       PHE  26   1.955   2.953 -16.546
  194    H    ASP  27           H        ASP  27   8.843   4.569 -14.241
  195    HA   ASP  27           HA       ASP  27   8.691   2.748 -16.570
  196   1HB   ASP  27          1HB       ASP  27   9.586   4.807 -17.195
  197   2HB   ASP  27          2HB       ASP  27  10.563   4.977 -15.755
  198    H    MET  28           H        MET  28  10.525   2.868 -13.572
  199    HA   MET  28           HA       MET  28  12.534   0.792 -14.102
  200   1HB   MET  28          1HB       MET  28  12.371   2.438 -12.037
  201   2HB   MET  28          2HB       MET  28  11.345   1.208 -11.322
  202   1HG   MET  28          1HG       MET  28  14.172   0.543 -12.349
  203   2HG   MET  28          2HG       MET  28  13.139  -0.454 -11.311
  204   1HE   MET  28          1HE       MET  28  12.139   0.586  -8.874
  205   2HE   MET  28          2HE       MET  28  12.831   2.053  -8.119
  206   3HE   MET  28          3HE       MET  28  11.835   2.197  -9.598
  207    H    PHE  29           H        PHE  29   9.209   0.727 -12.874
  208    HA   PHE  29           HA       PHE  29   9.072  -2.169 -12.260
  209   1HB   PHE  29          1HB       PHE  29   7.495  -0.360 -11.326
  210   2HB   PHE  29          2HB       PHE  29   6.703  -0.307 -12.878
  211    HD1  PHE  29           HD1      PHE  29   6.932  -2.082  -9.707
  212    HD2  PHE  29           HD2      PHE  29   5.559  -2.495 -13.767
  213    HE1  PHE  29           HE1      PHE  29   5.446  -3.924  -9.030
  214    HE2  PHE  29           HE2      PHE  29   4.087  -4.339 -13.068
  215    HZ   PHE  29           HZ       PHE  29   4.017  -5.047 -10.704
  216    H    ASP  30           H        ASP  30   8.419  -0.124 -15.063
  217    HA   ASP  30           HA       ASP  30   7.193  -2.144 -16.813
  218   1HB   ASP  30          1HB       ASP  30   8.530   0.537 -17.438
  219   2HB   ASP  30          2HB       ASP  30   6.823   0.161 -17.384
  220    H    ALA  31           H        ALA  31   8.081  -3.467 -18.325
  221    HA   ALA  31           HA       ALA  31  11.110  -3.959 -18.194
  222   1HB   ALA  31          1HB       ALA  31  10.606  -6.363 -18.643
  223   2HB   ALA  31          2HB       ALA  31   9.818  -5.792 -17.159
  224   3HB   ALA  31          3HB       ALA  31   8.859  -6.027 -18.643
  225    H    ASP  32           H        ASP  32   8.214  -3.976 -20.254
  226    HA   ASP  32           HA       ASP  32   9.806  -4.373 -22.801
  227   1HB   ASP  32          1HB       ASP  32   7.909  -5.081 -23.836
  228   2HB   ASP  32          2HB       ASP  32   7.395  -5.398 -22.196
  229    H    GLY  33           H        GLY  33   7.353  -2.046 -21.599
  230   1HA   GLY  33          1HA       GLY  33   7.765   0.454 -21.524
  231   2HA   GLY  33          2HA       GLY  33   8.943   0.247 -22.800
  232    H    GLY  34           H        GLY  34   6.180   1.669 -22.255
  233   1HA   GLY  34          1HA       GLY  34   5.132   1.870 -24.996
  234   2HA   GLY  34          2HA       GLY  34   4.162   0.675 -24.124
  235    H    GLY  35           H        GLY  35   3.153   1.292 -22.120
  236   1HA   GLY  35          1HA       GLY  35   2.930   4.172 -21.302
  237   2HA   GLY  35          2HA       GLY  35   1.469   3.591 -22.111
  238    H    ASP  36           H        ASP  36   1.202   1.042 -21.307
  239    HA   ASP  36           HA       ASP  36   0.784   1.228 -18.280
  240   1HB   ASP  36          1HB       ASP  36  -0.779  -0.747 -19.988
  241   2HB   ASP  36          2HB       ASP  36  -1.166  -0.085 -18.417
  242    H    ILE  37           H        ILE  37   0.836  -0.902 -17.176
  243    HA   ILE  37           HA       ILE  37   3.273  -2.511 -18.055
  244    HB   ILE  37           HB       ILE  37   2.258  -3.192 -15.383
  245   1HG1  ILE  37          1HG1      ILE  37   2.644  -0.269 -15.921
  246   2HG1  ILE  37          2HG1      ILE  37   1.767  -1.080 -14.638
  247   1HG2  ILE  37          1HG2      ILE  37   4.651  -3.148 -14.794
  248   2HG2  ILE  37          2HG2      ILE  37   4.431  -3.980 -16.339
  249   3HG2  ILE  37          3HG2      ILE  37   5.057  -2.314 -16.314
  250   1HD1  ILE  37          1HD1      ILE  37   4.811  -0.629 -14.650
  251   2HD1  ILE  37          2HD1      ILE  37   3.598   0.183 -13.637
  252   3HD1  ILE  37          3HD1      ILE  37   3.926  -1.550 -13.403
  253    H    SER  38           H        SER  38   3.100  -4.874 -17.129
  254    HA   SER  38           HA       SER  38   0.345  -6.098 -17.556
  255   1HB   SER  38          1HB       SER  38   2.598  -6.328 -19.490
  256   2HB   SER  38          2HB       SER  38   1.916  -7.884 -19.011
  257    HG   SER  38           HG       SER  38   0.719  -5.699 -20.277
  258    H    THR  39           H        THR  39   1.054  -8.718 -17.537
  259    HA   THR  39           HA       THR  39   1.906  -9.174 -14.689
  260    HB   THR  39           HB       THR  39   1.504 -11.720 -15.835
  261    HG1  THR  39           HG1      THR  39   0.610 -10.904 -17.634
  262   1HG2  THR  39          1HG2      THR  39  -0.569 -11.814 -14.523
  263   2HG2  THR  39          2HG2      THR  39   0.673 -10.975 -13.565
  264   3HG2  THR  39          3HG2      THR  39  -0.622 -10.044 -14.363
  265    H    LYS  40           H        LYS  40   2.938 -10.207 -17.955
  266    HA   LYS  40           HA       LYS  40   5.257 -11.748 -17.307
  267   1HB   LYS  40          1HB       LYS  40   4.148 -11.436 -19.576
  268   2HB   LYS  40          2HB       LYS  40   5.006  -9.933 -19.788
  269   1HG   LYS  40          1HG       LYS  40   6.143 -12.788 -19.501
  270   2HG   LYS  40          2HG       LYS  40   7.186 -11.392 -19.448
  271   1HD   LYS  40          1HD       LYS  40   5.481 -12.195 -21.902
  272   2HD   LYS  40          2HD       LYS  40   6.455 -10.761 -21.768
  273   1HE   LYS  40          1HE       LYS  40   8.303 -11.786 -22.457
  274   2HE   LYS  40          2HE       LYS  40   8.254 -12.938 -21.130
  275   1HZ   LYS  40          1HZ       LYS  40   6.456 -14.050 -22.729
  276   2HZ   LYS  40          2HZ       LYS  40   8.073 -14.323 -22.925
  277   3HZ   LYS  40          3HZ       LYS  40   7.298 -13.229 -23.889
  278    H    GLU  41           H        GLU  41   5.022  -8.241 -17.994
  279    HA   GLU  41           HA       GLU  41   7.868  -7.599 -17.619
  280   1HB   GLU  41          1HB       GLU  41   7.157  -5.811 -18.718
  281   2HB   GLU  41          2HB       GLU  41   6.654  -5.180 -17.165
  282   1HG   GLU  41          1HG       GLU  41   4.778  -6.721 -19.067
  283   2HG   GLU  41          2HG       GLU  41   4.319  -5.979 -17.550
  284    H    LEU  42           H        LEU  42   5.013  -7.439 -15.510
  285    HA   LEU  42           HA       LEU  42   6.016  -6.005 -13.243
  286   1HB   LEU  42          1HB       LEU  42   3.884  -6.396 -12.650
  287   2HB   LEU  42          2HB       LEU  42   3.730  -7.727 -13.776
  288    HG   LEU  42           HG       LEU  42   4.871  -9.227 -11.953
  289   1HD1  LEU  42          1HD1      LEU  42   2.084  -8.096 -11.278
  290   2HD1  LEU  42          2HD1      LEU  42   2.388  -9.241 -12.594
  291   3HD1  LEU  42          3HD1      LEU  42   2.706  -9.725 -10.909
  292   1HD2  LEU  42          1HD2      LEU  42   4.720  -8.491  -9.600
  293   2HD2  LEU  42          2HD2      LEU  42   5.684  -7.289 -10.492
  294   3HD2  LEU  42          3HD2      LEU  42   3.997  -6.933 -10.078
  295    H    GLY  43           H        GLY  43   6.168  -9.515 -13.882
  296   1HA   GLY  43          1HA       GLY  43   7.359 -10.518 -11.480
  297   2HA   GLY  43          2HA       GLY  43   7.648 -11.240 -13.068
  298    H    THR  44           H        THR  44   8.910  -9.027 -14.308
  299    HA   THR  44           HA       THR  44  11.658  -9.644 -13.904
  300    HB   THR  44           HB       THR  44  10.417  -7.131 -15.107
  301    HG1  THR  44           HG1      THR  44  10.965  -8.117 -16.965
  302   1HG2  THR  44          1HG2      THR  44  12.637  -6.590 -16.124
  303   2HG2  THR  44          2HG2      THR  44  12.680  -6.413 -14.357
  304   3HG2  THR  44          3HG2      THR  44  13.415  -7.843 -15.125
  305    H    VAL  45           H        VAL  45   9.865  -6.842 -12.610
  306    HA   VAL  45           HA       VAL  45  12.117  -5.662 -11.126
  307    HB   VAL  45           HB       VAL  45   9.322  -4.970 -11.590
  308   1HG1  VAL  45          1HG1      VAL  45   8.825  -3.742  -9.475
  309   2HG1  VAL  45          2HG1      VAL  45   8.935  -5.479  -9.166
  310   3HG1  VAL  45          3HG1      VAL  45  10.286  -4.418  -8.707
  311   1HG2  VAL  45          1HG2      VAL  45  11.694  -3.234 -10.632
  312   2HG2  VAL  45          2HG2      VAL  45  11.233  -3.521 -12.326
  313   3HG2  VAL  45          3HG2      VAL  45  10.139  -2.628 -11.260
  314    H    MET  46           H        MET  46   9.620  -8.038 -10.398
  315    HA   MET  46           HA       MET  46   9.790  -8.171  -7.501
  316   1HB   MET  46          1HB       MET  46   9.193 -10.534  -9.379
  317   2HB   MET  46          2HB       MET  46   8.869 -10.469  -7.656
  318   1HG   MET  46          1HG       MET  46   7.600  -8.196  -9.149
  319   2HG   MET  46          2HG       MET  46   7.040  -9.797  -9.660
  320   1HE   MET  46          1HE       MET  46   6.991  -7.035  -6.917
  321   2HE   MET  46          2HE       MET  46   6.560  -7.914  -5.421
  322   3HE   MET  46          3HE       MET  46   8.190  -8.108  -6.128
  323    NH1  ARG  47           NH1      ARG  47  13.986 -14.288 -12.094
  324    NH2  ARG  47           NH2      ARG  47  12.882 -13.228 -13.774
  325    H    ARG  47           H        ARG  47  11.823  -9.485 -10.049
  326    HA   ARG  47           HA       ARG  47  13.344 -11.437  -8.423
  327   1HB   ARG  47          1HB       ARG  47  13.427 -12.009 -10.669
  328   2HB   ARG  47          2HB       ARG  47  13.527 -10.342 -11.222
  329   1HG   ARG  47          1HG       ARG  47  15.897 -11.638  -9.761
  330   2HG   ARG  47          2HG       ARG  47  15.891 -10.164 -10.731
  331   1HD   ARG  47          1HD       ARG  47  16.684 -11.526 -12.432
  332   2HD   ARG  47          2HD       ARG  47  16.165 -12.990 -11.613
  333    HE   ARG  47           HE       ARG  47  14.433 -11.415 -13.521
  334   1HH1  ARG  47          1HH1      ARG  47  14.752 -14.264 -11.412
  335   2HH1  ARG  47          2HH1      ARG  47  13.307 -15.045 -12.229
  336   1HH2  ARG  47          1HH2      ARG  47  12.803 -12.398 -14.373
  337   2HH2  ARG  47          2HH2      ARG  47  12.280 -14.058 -13.791
  338    H    MET  48           H        MET  48  13.675  -8.020  -9.148
  339    HA   MET  48           HA       MET  48  16.447  -7.462  -8.813
  340   1HB   MET  48          1HB       MET  48  13.972  -5.826  -8.361
  341   2HB   MET  48          2HB       MET  48  15.376  -5.291  -7.456
  342   1HG   MET  48          1HG       MET  48  14.909  -5.237 -10.442
  343   2HG   MET  48          2HG       MET  48  16.568  -5.584  -9.928
  344   1HE   MET  48          1HE       MET  48  14.078  -3.537  -7.580
  345   2HE   MET  48          2HE       MET  48  14.280  -1.873  -8.201
  346   3HE   MET  48          3HE       MET  48  13.457  -3.104  -9.203
  347    H    LEU  49           H        LEU  49  14.120  -6.996  -6.133
  348    HA   LEU  49           HA       LEU  49  15.983  -6.757  -3.976
  349   1HB   LEU  49          1HB       LEU  49  13.688  -6.196  -3.542
  350   2HB   LEU  49          2HB       LEU  49  14.146  -7.462  -2.424
  351    HG   LEU  49           HG       LEU  49  12.594  -8.084  -5.004
  352   1HD1  LEU  49          1HD1      LEU  49  11.345  -7.535  -2.239
  353   2HD1  LEU  49          2HD1      LEU  49  11.330  -6.383  -3.587
  354   3HD1  LEU  49          3HD1      LEU  49  10.480  -7.940  -3.744
  355   1HD2  LEU  49          1HD2      LEU  49  11.958 -10.186  -3.896
  356   2HD2  LEU  49          2HD2      LEU  49  13.727 -10.034  -3.760
  357   3HD2  LEU  49          3HD2      LEU  49  12.705  -9.675  -2.361
  358    H    GLY  50           H        GLY  50  14.669  -9.640  -5.525
  359   1HA   GLY  50          1HA       GLY  50  16.770 -11.370  -4.083
  360   2HA   GLY  50          2HA       GLY  50  16.386 -11.548  -5.803
  361    H    GLN  51           H        GLN  51  14.682 -12.708  -6.457
  362    HA   GLN  51           HA       GLN  51  13.269 -14.538  -4.510
  363   1HB   GLN  51          1HB       GLN  51  11.534 -12.692  -6.238
  364   2HB   GLN  51          2HB       GLN  51  11.953 -12.313  -4.579
  365   1HG   GLN  51          1HG       GLN  51   9.775 -13.305  -4.503
  366   2HG   GLN  51          2HG       GLN  51  10.196 -14.596  -5.607
  367   1HE2  GLN  51          1HE2      GLN  51  10.423 -16.612  -2.633
  368   2HE2  GLN  51          2HE2      GLN  51   9.646 -16.303  -4.267
  369    H    ASN  52           H        ASN  52  11.600 -15.836  -5.926
  370    HA   ASN  52           HA       ASN  52  12.486 -16.175  -8.793
  371   1HB   ASN  52          1HB       ASN  52  13.687 -17.801  -6.999
  372   2HB   ASN  52          2HB       ASN  52  12.232 -18.754  -7.186
  373   1HD2  ASN  52          1HD2      ASN  52  14.675 -20.010  -9.730
  374   2HD2  ASN  52          2HD2      ASN  52  14.234 -20.129  -7.953
  375    HA   PRO  53           HA       PRO  53   7.802 -16.496  -8.152
  376   1HB   PRO  53          1HB       PRO  53   6.954 -14.898 -10.230
  377   2HB   PRO  53          2HB       PRO  53   7.615 -14.275  -8.712
  378   1HG   PRO  53          1HG       PRO  53   9.057 -14.605 -11.387
  379   2HG   PRO  53          2HG       PRO  53   9.089 -13.203 -10.293
  380   1HD   PRO  53          1HD       PRO  53  10.739 -14.232  -8.886
  381   2HD   PRO  53          2HD       PRO  53  11.077 -15.220 -10.338
  382    H    THR  54           H        THR  54   6.002 -16.970  -9.933
  383    HA   THR  54           HA       THR  54   6.971 -18.880 -12.099
  384    HB   THR  54           HB       THR  54   5.988 -19.835  -9.624
  385    HG1  THR  54           HG1      THR  54   6.624 -20.822 -12.142
  386   1HG2  THR  54          1HG2      THR  54   3.989 -21.174 -10.198
  387   2HG2  THR  54          2HG2      THR  54   3.612 -19.441 -10.341
  388   3HG2  THR  54          3HG2      THR  54   3.890 -20.417 -11.806
  389    H    LYS  55           H        LYS  55   5.041 -19.594 -13.439
  390    HA   LYS  55           HA       LYS  55   3.876 -17.188 -14.647
  391   1HB   LYS  55          1HB       LYS  55   4.474 -19.175 -16.013
  392   2HB   LYS  55          2HB       LYS  55   3.299 -20.170 -15.178
  393   1HG   LYS  55          1HG       LYS  55   1.847 -17.919 -16.254
  394   2HG   LYS  55          2HG       LYS  55   2.934 -18.461 -17.521
  395   1HD   LYS  55          1HD       LYS  55   1.972 -20.912 -16.956
  396   2HD   LYS  55          2HD       LYS  55   1.062 -19.795 -17.961
  397   1HE   LYS  55          1HE       LYS  55  -0.063 -21.108 -15.881
  398   2HE   LYS  55          2HE       LYS  55   0.501 -19.711 -14.967
  399   1HZ   LYS  55          1HZ       LYS  55  -1.826 -19.736 -16.172
  400   2HZ   LYS  55          2HZ       LYS  55  -0.962 -19.207 -17.477
  401   3HZ   LYS  55          3HZ       LYS  55  -0.958 -18.334 -16.075
  402    H    GLU  56           H        GLU  56   2.418 -19.963 -12.925
  403    HA   GLU  56           HA       GLU  56  -0.337 -18.964 -12.944
  404   1HB   GLU  56          1HB       GLU  56   0.237 -20.816 -10.713
  405   2HB   GLU  56          2HB       GLU  56   0.936 -21.381 -12.217
  406   1HG   GLU  56          1HG       GLU  56  -1.200 -21.604 -13.288
  407   2HG   GLU  56          2HG       GLU  56  -1.986 -20.468 -12.204
  408    H    GLU  57           H        GLU  57   2.223 -18.981 -10.459
  409    HA   GLU  57           HA       GLU  57   0.715 -17.789  -8.262
  410   1HB   GLU  57          1HB       GLU  57   3.615 -17.122  -8.277
  411   2HB   GLU  57          2HB       GLU  57   3.275 -18.822  -8.517
  412   1HG   GLU  57          1HG       GLU  57   2.676 -17.085  -6.067
  413   2HG   GLU  57          2HG       GLU  57   1.686 -18.515  -6.334
  414    H    LEU  58           H        LEU  58   2.464 -16.419 -10.993
  415    HA   LEU  58           HA       LEU  58   2.622 -13.636 -10.016
  416   1HB   LEU  58          1HB       LEU  58   3.693 -15.144 -12.185
  417   2HB   LEU  58          2HB       LEU  58   2.717 -13.907 -12.952
  418    HG   LEU  58           HG       LEU  58   4.397 -12.760 -10.779
  419   1HD1  LEU  58          1HD1      LEU  58   4.487 -12.181 -13.814
  420   2HD1  LEU  58          2HD1      LEU  58   3.309 -11.443 -12.719
  421   3HD1  LEU  58          3HD1      LEU  58   5.046 -11.119 -12.497
  422   1HD2  LEU  58          1HD2      LEU  58   6.627 -13.170 -11.751
  423   2HD2  LEU  58          2HD2      LEU  58   5.861 -14.743 -11.413
  424   3HD2  LEU  58          3HD2      LEU  58   5.927 -14.133 -13.077
  425    H    ASP  59           H        ASP  59   0.406 -15.503 -12.044
  426    HA   ASP  59           HA       ASP  59  -1.281 -13.262 -12.961
  427   1HB   ASP  59          1HB       ASP  59  -1.138 -15.408 -14.228
  428   2HB   ASP  59          2HB       ASP  59  -1.929 -16.262 -12.924
  429    H    ALA  60           H        ALA  60  -1.288 -15.417 -10.185
  430    HA   ALA  60           HA       ALA  60  -3.916 -14.573  -9.060
  431   1HB   ALA  60          1HB       ALA  60  -3.192 -15.815  -7.026
  432   2HB   ALA  60          2HB       ALA  60  -2.954 -16.783  -8.494
  433   3HB   ALA  60          3HB       ALA  60  -1.556 -16.020  -7.694
  434    H    ILE  61           H        ILE  61  -0.570 -13.522  -8.858
  435    HA   ILE  61           HA       ILE  61  -0.750 -11.707  -6.554
  436    HB   ILE  61           HB       ILE  61   1.253 -12.252  -8.678
  437   1HG1  ILE  61          1HG1      ILE  61   2.365 -12.988  -6.839
  438   2HG1  ILE  61          2HG1      ILE  61   1.058 -12.444  -5.810
  439   1HG2  ILE  61          1HG2      ILE  61   2.554 -10.122  -8.396
  440   2HG2  ILE  61          2HG2      ILE  61   0.990  -9.799  -9.142
  441   3HG2  ILE  61          3HG2      ILE  61   1.237  -9.426  -7.420
  442   1HD1  ILE  61          1HD1      ILE  61   2.098 -10.219  -5.460
  443   2HD1  ILE  61          2HD1      ILE  61   3.243 -11.519  -5.064
  444   3HD1  ILE  61          3HD1      ILE  61   3.413 -10.631  -6.596
  445    H    ILE  62           H        ILE  62  -1.415 -11.431 -10.012
  446    HA   ILE  62           HA       ILE  62  -1.936  -8.487  -9.974
  447    HB   ILE  62           HB       ILE  62  -2.138 -10.622 -12.131
  448   1HG1  ILE  62          1HG1      ILE  62   0.063  -9.942 -12.272
  449   2HG1  ILE  62          2HG1      ILE  62  -0.216  -8.450 -11.399
  450   1HG2  ILE  62          1HG2      ILE  62  -2.930  -8.910 -13.789
  451   2HG2  ILE  62          2HG2      ILE  62  -4.138  -9.145 -12.528
  452   3HG2  ILE  62          3HG2      ILE  62  -3.099  -7.702 -12.491
  453   1HD1  ILE  62          1HD1      ILE  62  -1.028  -7.273 -13.424
  454   2HD1  ILE  62          2HD1      ILE  62   0.559  -8.012 -13.723
  455   3HD1  ILE  62          3HD1      ILE  62  -0.907  -8.779 -14.376
  456    H    GLU  63           H        GLU  63  -3.767 -11.502  -9.858
  457    HA   GLU  63           HA       GLU  63  -6.464 -10.716 -10.226
  458   1HB   GLU  63          1HB       GLU  63  -6.115 -13.013  -9.885
  459   2HB   GLU  63          2HB       GLU  63  -5.234 -12.797  -8.386
  460   1HG   GLU  63          1HG       GLU  63  -7.277 -12.361  -7.122
  461   2HG   GLU  63          2HG       GLU  63  -8.222 -12.090  -8.576
  462    H    GLU  64           H        GLU  64  -4.376 -10.206  -7.417
  463    HA   GLU  64           HA       GLU  64  -6.425  -8.669  -5.843
  464   1HB   GLU  64          1HB       GLU  64  -3.509  -8.470  -5.116
  465   2HB   GLU  64          2HB       GLU  64  -4.211 -10.075  -5.061
  466   1HG   GLU  64          1HG       GLU  64  -5.297  -9.636  -3.091
  467   2HG   GLU  64          2HG       GLU  64  -6.008  -8.155  -3.709
  468    H    VAL  65           H        VAL  65  -6.763  -6.565  -5.958
  469    HA   VAL  65           HA       VAL  65  -6.249  -4.193  -6.145
  470    HB   VAL  65           HB       VAL  65  -3.869  -4.816  -7.948
  471   1HG1  VAL  65          1HG1      VAL  65  -3.683  -4.491  -4.883
  472   2HG1  VAL  65          2HG1      VAL  65  -3.633  -6.059  -5.711
  473   3HG1  VAL  65          3HG1      VAL  65  -2.360  -4.854  -6.019
  474   1HG2  VAL  65          1HG2      VAL  65  -3.050  -2.589  -7.351
  475   2HG2  VAL  65          2HG2      VAL  65  -4.758  -2.391  -7.814
  476   3HG2  VAL  65          3HG2      VAL  65  -4.304  -2.378  -6.104
  477    H    ASP  66           H        ASP  66  -6.188  -6.521  -8.795
  478    HA   ASP  66           HA       ASP  66  -7.365  -4.574 -10.780
  479   1HB   ASP  66          1HB       ASP  66  -6.204  -7.350 -10.991
  480   2HB   ASP  66          2HB       ASP  66  -7.483  -6.964 -12.118
  481    H    GLU  67           H        GLU  67  -9.132  -4.293  -9.160
  482    HA   GLU  67           HA       GLU  67 -11.251  -6.430  -8.990
  483   1HB   GLU  67          1HB       GLU  67 -10.511  -4.746  -7.109
  484   2HB   GLU  67          2HB       GLU  67 -11.541  -3.583  -7.923
  485   1HG   GLU  67          1HG       GLU  67 -13.163  -4.400  -6.508
  486   2HG   GLU  67          2HG       GLU  67 -13.341  -5.663  -7.713
  487    H    ASP  68           H        ASP  68 -10.488  -5.156 -11.603
  488    HA   ASP  68           HA       ASP  68 -13.170  -3.908 -12.397
  489   1HB   ASP  68          1HB       ASP  68 -11.405  -3.060 -14.403
  490   2HB   ASP  68          2HB       ASP  68 -12.099  -2.089 -13.124
  491    H    GLY  69           H        GLY  69 -10.305  -5.382 -13.980
  492   1HA   GLY  69          1HA       GLY  69 -10.800  -7.848 -14.900
  493   2HA   GLY  69          2HA       GLY  69 -12.172  -7.084 -15.715
  494    H    SER  70           H        SER  70  -8.856  -5.888 -15.229
  495    HA   SER  70           HA       SER  70  -8.484  -5.658 -18.269
  496   1HB   SER  70          1HB       SER  70  -7.201  -3.670 -17.985
  497   2HB   SER  70          2HB       SER  70  -8.635  -3.466 -16.976
  498    HG   SER  70           HG       SER  70  -7.454  -3.882 -15.186
  499    H    GLY  71           H        GLY  71  -6.676  -5.997 -15.187
  500   1HA   GLY  71          1HA       GLY  71  -5.114  -7.899 -14.679
  501   2HA   GLY  71          2HA       GLY  71  -4.922  -8.164 -16.417
  502    H    THR  72           H        THR  72  -4.604  -5.339 -17.045
  503    HA   THR  72           HA       THR  72  -1.652  -5.071 -16.501
  504    HB   THR  72           HB       THR  72  -1.835  -3.034 -18.062
  505    HG1  THR  72           HG1      THR  72  -4.330  -3.389 -17.731
  506   1HG2  THR  72          1HG2      THR  72  -1.880  -4.334 -20.152
  507   2HG2  THR  72          2HG2      THR  72  -0.950  -5.236 -18.934
  508   3HG2  THR  72          3HG2      THR  72  -2.612  -5.738 -19.343
  509    H    ILE  73           H        ILE  73  -0.728  -3.550 -15.262
  510    HA   ILE  73           HA       ILE  73  -2.500  -1.886 -13.425
  511    HB   ILE  73           HB       ILE  73   0.440  -2.689 -13.156
  512   1HG1  ILE  73          1HG1      ILE  73  -0.907  -4.615 -12.609
  513   2HG1  ILE  73          2HG1      ILE  73  -0.410  -3.919 -11.081
  514   1HG2  ILE  73          1HG2      ILE  73   0.475  -1.554 -10.938
  515   2HG2  ILE  73          2HG2      ILE  73   0.073  -0.377 -12.196
  516   3HG2  ILE  73          3HG2      ILE  73  -1.208  -1.012 -11.135
  517   1HD1  ILE  73          1HD1      ILE  73  -3.221  -3.603 -12.286
  518   2HD1  ILE  73          2HD1      ILE  73  -2.742  -4.597 -10.894
  519   3HD1  ILE  73          3HD1      ILE  73  -2.663  -2.822 -10.781
  520    H    ASP  74           H        ASP  74  -3.037  -0.350 -14.992
  521    HA   ASP  74           HA       ASP  74  -1.082   1.254 -16.509
  522   1HB   ASP  74          1HB       ASP  74  -2.849   2.468 -17.396
  523   2HB   ASP  74          2HB       ASP  74  -3.768   2.484 -15.909
  524    H    PHE  75           H        PHE  75  -1.254   3.773 -16.195
  525    HA   PHE  75           HA       PHE  75   0.161   4.435 -13.689
  526   1HB   PHE  75          1HB       PHE  75  -1.020   6.481 -15.656
  527   2HB   PHE  75          2HB       PHE  75   0.415   5.565 -16.031
  528    HD1  PHE  75           HD1      PHE  75   2.510   5.834 -14.536
  529    HD2  PHE  75           HD2      PHE  75  -0.928   8.386 -14.102
  530    HE1  PHE  75           HE1      PHE  75   3.877   7.489 -13.331
  531    HE2  PHE  75           HE2      PHE  75   0.459  10.032 -12.905
  532    HZ   PHE  75           HZ       PHE  75   2.859   9.593 -12.528
  533    H    GLU  76           H        GLU  76  -3.134   4.750 -14.890
  534    HA   GLU  76           HA       GLU  76  -4.185   6.578 -12.833
  535   1HB   GLU  76          1HB       GLU  76  -6.480   5.553 -13.628
  536   2HB   GLU  76          2HB       GLU  76  -5.526   4.765 -14.866
  537   1HG   GLU  76          1HG       GLU  76  -6.651   7.353 -15.006
  538   2HG   GLU  76          2HG       GLU  76  -4.960   7.689 -14.697
  539    H    GLU  77           H        GLU  77  -4.019   3.064 -13.181
  540    HA   GLU  77           HA       GLU  77  -5.612   2.417 -10.744
  541   1HB   GLU  77          1HB       GLU  77  -5.289   0.931 -12.848
  542   2HB   GLU  77          2HB       GLU  77  -3.738   0.486 -12.173
  543   1HG   GLU  77          1HG       GLU  77  -6.149   0.170 -10.348
  544   2HG   GLU  77          2HG       GLU  77  -4.681  -0.797 -10.422
  545    H    PHE  78           H        PHE  78  -2.229   2.895 -11.532
  546    HA   PHE  78           HA       PHE  78  -1.018   1.754  -9.117
  547   1HB   PHE  78          1HB       PHE  78   0.288   2.231 -11.197
  548   2HB   PHE  78          2HB       PHE  78   0.065   3.950 -10.998
  549    HD1  PHE  78           HD1      PHE  78   2.548   4.311 -10.947
  550    HD2  PHE  78           HD2      PHE  78   0.695   1.741  -8.036
  551    HE1  PHE  78           HE1      PHE  78   4.611   4.326  -9.603
  552    HE2  PHE  78           HE2      PHE  78   2.772   1.755  -6.715
  553    HZ   PHE  78           HZ       PHE  78   4.730   3.045  -7.492
  554    H    LEU  79           H        LEU  79  -2.419   4.874  -9.932
  555    HA   LEU  79           HA       LEU  79  -1.498   6.318  -7.486
  556   1HB   LEU  79          1HB       LEU  79  -3.555   7.040  -9.651
  557   2HB   LEU  79          2HB       LEU  79  -3.257   8.065  -8.264
  558    HG   LEU  79           HG       LEU  79  -1.576   7.630 -10.719
  559   1HD1  LEU  79          1HD1      LEU  79  -1.074  10.053 -10.387
  560   2HD1  LEU  79          2HD1      LEU  79  -2.822   9.762 -10.319
  561   3HD1  LEU  79          3HD1      LEU  79  -1.911  10.039  -8.813
  562   1HD2  LEU  79          1HD2      LEU  79  -0.192   8.135  -7.998
  563   2HD2  LEU  79          2HD2      LEU  79   0.031   6.708  -9.040
  564   3HD2  LEU  79          3HD2      LEU  79   0.576   8.297  -9.598
  565    H    VAL  80           H        VAL  80  -4.369   4.571  -8.549
  566    HA   VAL  80           HA       VAL  80  -6.197   5.293  -6.372
  567    HB   VAL  80           HB       VAL  80  -6.170   2.946  -8.311
  568   1HG1  VAL  80          1HG1      VAL  80  -8.259   5.188  -7.990
  569   2HG1  VAL  80          2HG1      VAL  80  -6.882   5.304  -9.093
  570   3HG1  VAL  80          3HG1      VAL  80  -8.096   4.027  -9.333
  571   1HG2  VAL  80          1HG2      VAL  80  -8.336   2.139  -7.495
  572   2HG2  VAL  80          2HG2      VAL  80  -7.222   2.127  -6.108
  573   3HG2  VAL  80          3HG2      VAL  80  -8.424   3.417  -6.258
  574    H    MET  81           H        MET  81  -3.807   2.707  -6.832
  575    HA   MET  81           HA       MET  81  -4.293   1.151  -4.380
  576   1HB   MET  81          1HB       MET  81  -1.502   1.351  -5.587
  577   2HB   MET  81          2HB       MET  81  -2.786   0.608  -6.523
  578   1HG   MET  81          1HG       MET  81  -3.181  -0.839  -4.257
  579   2HG   MET  81          2HG       MET  81  -1.972  -1.296  -5.469
  580   1HE   MET  81          1HE       MET  81   0.558  -0.023  -5.416
  581   2HE   MET  81          2HE       MET  81   1.441  -0.507  -3.937
  582   3HE   MET  81          3HE       MET  81   0.518  -1.726  -4.861
  583    H    MET  82           H        MET  82  -1.598   3.385  -5.118
  584    HA   MET  82           HA       MET  82  -0.448   3.591  -2.504
  585   1HB   MET  82          1HB       MET  82   0.115   6.104  -3.433
  586   2HB   MET  82          2HB       MET  82  -0.393   5.370  -4.943
  587   1HG   MET  82          1HG       MET  82   1.899   4.897  -5.002
  588   2HG   MET  82          2HG       MET  82   1.311   3.407  -4.253
  589   1HE   MET  82          1HE       MET  82   4.462   4.945  -3.966
  590   2HE   MET  82          2HE       MET  82   3.962   3.252  -3.678
  591   3HE   MET  82          3HE       MET  82   4.752   4.181  -2.371
  592    H    VAL  83           H        VAL  83  -3.283   5.172  -3.845
  593    HA   VAL  83           HA       VAL  83  -3.577   7.337  -1.878
  594    HB   VAL  83           HB       VAL  83  -5.262   6.255  -4.099
  595   1HG1  VAL  83          1HG1      VAL  83  -7.321   7.501  -3.418
  596   2HG1  VAL  83          2HG1      VAL  83  -6.977   6.195  -2.276
  597   3HG1  VAL  83          3HG1      VAL  83  -6.597   7.875  -1.833
  598   1HG2  VAL  83          1HG2      VAL  83  -4.675   9.146  -3.173
  599   2HG2  VAL  83          2HG2      VAL  83  -3.821   8.277  -4.469
  600   3HG2  VAL  83          3HG2      VAL  83  -5.534   8.679  -4.664
  601    NH1  ARG  84           NH1      ARG  84 -10.030   0.207  -3.951
  602    NH2  ARG  84           NH2      ARG  84 -10.549  -0.895  -2.034
  603    H    ARG  84           H        ARG  84  -5.095   4.123  -2.246
  604    HA   ARG  84           HA       ARG  84  -6.998   4.122  -0.075
  605   1HB   ARG  84          1HB       ARG  84  -5.399   1.865  -1.386
  606   2HB   ARG  84          2HB       ARG  84  -6.391   1.542   0.028
  607   1HG   ARG  84          1HG       ARG  84  -7.714   3.053  -2.251
  608   2HG   ARG  84          2HG       ARG  84  -8.435   1.953  -1.073
  609   1HD   ARG  84          1HD       ARG  84  -6.407   0.559  -2.745
  610   2HD   ARG  84          2HD       ARG  84  -7.655   1.300  -3.747
  611    HE   ARG  84           HE       ARG  84  -8.055  -0.941  -1.760
  612   1HH1  ARG  84          1HH1      ARG  84 -10.229  -1.264  -1.132
  613   2HH1  ARG  84          2HH1      ARG  84 -11.498  -0.954  -2.420
  614   1HH2  ARG  84          1HH2      ARG  84  -9.330   0.736  -4.484
  615   2HH2  ARG  84          2HH2      ARG  84 -10.996   0.007  -4.234
  616    H    GLN  85           H        GLN  85  -3.618   2.927  -0.040
  617    HA   GLN  85           HA       GLN  85  -3.533   2.316   2.849
  618   1HB   GLN  85          1HB       GLN  85  -0.975   2.260   2.449
  619   2HB   GLN  85          2HB       GLN  85  -1.307   2.654   0.773
  620   1HG   GLN  85          1HG       GLN  85  -2.508   0.183   2.159
  621   2HG   GLN  85          2HG       GLN  85  -2.591   0.556   0.452
  622   1HE2  GLN  85          1HE2      GLN  85   0.184  -1.834   0.484
  623   2HE2  GLN  85          2HE2      GLN  85  -1.644  -1.772   0.633
  624    H    MET  86           H        MET  86  -2.746   5.106   0.848
  625    HA   MET  86           HA       MET  86  -1.158   6.708   2.658
  626   1HB   MET  86          1HB       MET  86  -2.555   7.176   0.118
  627   2HB   MET  86          2HB       MET  86  -2.796   8.546   1.186
  628   1HG   MET  86          1HG       MET  86  -0.304   7.652  -0.213
  629   2HG   MET  86          2HG       MET  86  -0.029   8.095   1.480
  630   1HE   MET  86          1HE       MET  86  -3.024   9.526  -0.758
  631   2HE   MET  86          2HE       MET  86  -2.259  10.970  -1.485
  632   3HE   MET  86          3HE       MET  86  -1.722   9.336  -1.975
  633    H    LYS  87           H        LYS  87  -4.642   6.250   2.364
  634    HA   LYS  87           HA       LYS  87  -5.387   8.260   4.478
  635   1HB   LYS  87          1HB       LYS  87  -7.717   7.220   4.269
  636   2HB   LYS  87          2HB       LYS  87  -7.073   6.112   3.066
  637   1HG   LYS  87          1HG       LYS  87  -7.602   9.081   2.814
  638   2HG   LYS  87          2HG       LYS  87  -6.257   8.443   1.883
  639   1HD   LYS  87          1HD       LYS  87  -8.203   8.407   0.444
  640   2HD   LYS  87          2HD       LYS  87  -7.821   6.738   0.853
  641   1HE   LYS  87          1HE       LYS  87  -9.766   7.848   2.810
  642   2HE   LYS  87          2HE       LYS  87 -10.369   8.016   1.155
  643   1HZ   LYS  87          1HZ       LYS  87  -9.417   5.499   1.118
  644   2HZ   LYS  87          2HZ       LYS  87 -10.982   5.890   1.474
  645   3HZ   LYS  87          3HZ       LYS  87  -9.904   5.604   2.693
  646    H    GLU  88           H        GLU  88  -5.717   7.873   6.561
  647    HA   GLU  88           HA       GLU  88  -5.582   5.015   7.643
  648   1HB   GLU  88          1HB       GLU  88  -4.110   7.331   8.994
  649   2HB   GLU  88          2HB       GLU  88  -3.339   6.295   7.810
  650   1HG   GLU  88          1HG       GLU  88  -3.575   4.315   9.256
  651   2HG   GLU  88          2HG       GLU  88  -4.667   5.153  10.345
  652    H    ASP  89           H        ASP  89  -7.841   6.598   7.058
  653    HA   ASP  89           HA       ASP  89  -9.093   6.837   9.828
  654   1HB   ASP  89          1HB       ASP  89 -10.425   8.890   8.537
  655   2HB   ASP  89          2HB       ASP  89  -8.830   9.077   7.846
  656    H    ALA  90           H        ALA  90 -10.294   5.068   9.659
  657    HA   ALA  90           HA       ALA  90 -12.847   4.963   8.361
  658   1HB   ALA  90          1HB       ALA  90 -12.523   3.376   6.446
  659   2HB   ALA  90          2HB       ALA  90 -11.653   4.895   6.156
  660   3HB   ALA  90          3HB       ALA  90 -10.755   3.440   6.652
   
  Start of MODEL          24
 Raw file had  660 H/Q atoms
  Start of MODEL   24
    1   1H    ALA   1          1H        ALA   1 -20.362  -2.048 -16.334
    2   2H    ALA   1          2H        ALA   1 -20.144  -3.386 -15.339
    3   3H    ALA   1          3H        ALA   1 -21.552  -3.232 -16.245
    4    HA   ALA   1           HA       ALA   1 -21.727  -0.978 -14.961
    5   1HB   ALA   1          1HB       ALA   1 -22.691  -3.786 -14.223
    6   2HB   ALA   1          2HB       ALA   1 -23.610  -2.435 -14.913
    7   3HB   ALA   1          3HB       ALA   1 -23.138  -2.403 -13.195
    8    H    SER   2           H        SER   2 -19.123  -1.115 -14.630
    9    HA   SER   2           HA       SER   2 -18.528  -1.766 -11.692
   10   1HB   SER   2          1HB       SER   2 -16.222  -1.175 -13.518
   11   2HB   SER   2          2HB       SER   2 -16.384  -2.367 -12.226
   12    HG   SER   2           HG       SER   2 -16.471  -3.568 -13.960
   13    H    MET   3           H        MET   3 -19.630   0.203 -11.111
   14    HA   MET   3           HA       MET   3 -18.441   2.872 -11.916
   15   1HB   MET   3          1HB       MET   3 -21.030   1.971 -10.905
   16   2HB   MET   3          2HB       MET   3 -20.410   3.220  -9.841
   17   1HG   MET   3          1HG       MET   3 -21.469   4.601 -11.372
   18   2HG   MET   3          2HG       MET   3 -19.921   4.481 -12.220
   19   1HE   MET   3          1HE       MET   3 -19.929   1.771 -14.396
   20   2HE   MET   3          2HE       MET   3 -19.345   3.433 -14.090
   21   3HE   MET   3          3HE       MET   3 -20.481   3.124 -15.435
   22    H    THR   4           H        THR   4 -16.479   3.032 -10.993
   23    HA   THR   4           HA       THR   4 -16.304   3.217  -7.988
   24    HB   THR   4           HB       THR   4 -15.784   0.867  -8.502
   25    HG1  THR   4           HG1      THR   4 -15.012   1.506  -6.683
   26   1HG2  THR   4          1HG2      THR   4 -13.228   0.483  -9.148
   27   2HG2  THR   4          2HG2      THR   4 -13.428   1.966 -10.108
   28   3HG2  THR   4          3HG2      THR   4 -14.454   0.545 -10.432
   29    H    ASP   5           H        ASP   5 -15.204   4.944  -7.414
   30    HA   ASP   5           HA       ASP   5 -13.594   6.566  -9.387
   31   1HB   ASP   5          1HB       ASP   5 -13.740   8.399  -7.930
   32   2HB   ASP   5          2HB       ASP   5 -13.869   7.415  -6.490
   33    H    GLN   6           H        GLN   6 -12.371   4.225  -9.073
   34    HA   GLN   6           HA       GLN   6 -10.102   4.406  -7.075
   35   1HB   GLN   6          1HB       GLN   6  -9.784   2.358  -9.181
   36   2HB   GLN   6          2HB       GLN   6 -11.380   2.272  -8.459
   37   1HG   GLN   6          1HG       GLN   6  -9.019   2.472  -6.556
   38   2HG   GLN   6          2HG       GLN   6 -10.570   1.697  -6.315
   39   1HE2  GLN   6          1HE2      GLN   6  -7.628  -0.420  -8.383
   40   2HE2  GLN   6          2HE2      GLN   6  -7.675   1.413  -8.448
   41    H    GLN   7           H        GLN   7 -10.172   6.656  -8.591
   42    HA   GLN   7           HA       GLN   7  -7.527   6.795  -9.939
   43   1HB   GLN   7          1HB       GLN   7  -8.038   6.309 -12.090
   44   2HB   GLN   7          2HB       GLN   7  -9.134   7.683 -12.098
   45   1HG   GLN   7          1HG       GLN   7  -9.917   5.117 -12.676
   46   2HG   GLN   7          2HG       GLN   7 -10.299   5.131 -10.961
   47   1HE2  GLN   7          1HE2      GLN   7 -12.245   7.998 -13.314
   48   2HE2  GLN   7          2HE2      GLN   7 -10.471   7.618 -13.586
   49    H    ALA   8           H        ALA   8 -10.799   8.147  -9.588
   50    HA   ALA   8           HA       ALA   8 -10.039  10.985  -9.959
   51   1HB   ALA   8          1HB       ALA   8 -12.356  11.482  -9.195
   52   2HB   ALA   8          2HB       ALA   8 -12.341  10.202 -10.423
   53   3HB   ALA   8          3HB       ALA   8 -12.594   9.787  -8.708
   54    H    GLU   9           H        GLU   9 -10.360   8.789  -7.220
   55    HA   GLU   9           HA       GLU   9 -10.320  10.791  -5.050
   56   1HB   GLU   9          1HB       GLU   9 -10.250   9.020  -3.486
   57   2HB   GLU   9          2HB       GLU   9 -11.209   8.411  -4.827
   58   1HG   GLU   9          1HG       GLU   9  -9.063   7.217  -5.712
   59   2HG   GLU   9          2HG       GLU   9  -8.302   7.626  -4.179
   60    H    ALA  10           H        ALA  10  -7.833   8.697  -6.513
   61    HA   ALA  10           HA       ALA  10  -5.625   9.537  -4.726
   62   1HB   ALA  10          1HB       ALA  10  -4.167   8.238  -6.269
   63   2HB   ALA  10          2HB       ALA  10  -5.614   7.316  -5.821
   64   3HB   ALA  10          3HB       ALA  10  -5.501   8.064  -7.434
   65    NH1  ARG  11           NH1      ARG  11  -9.735  13.267 -13.577
   66    NH2  ARG  11           NH2      ARG  11 -10.882  14.846 -12.415
   67    H    ARG  11           H        ARG  11  -6.886  10.575  -7.839
   68    HA   ARG  11           HA       ARG  11  -4.571  12.207  -8.744
   69   1HB   ARG  11          1HB       ARG  11  -5.754  11.911 -10.657
   70   2HB   ARG  11          2HB       ARG  11  -7.211  11.467  -9.780
   71   1HG   ARG  11          1HG       ARG  11  -8.016  13.717  -9.623
   72   2HG   ARG  11          2HG       ARG  11  -6.443  14.425  -9.999
   73   1HD   ARG  11          1HD       ARG  11  -6.600  13.963 -12.320
   74   2HD   ARG  11          2HD       ARG  11  -7.717  12.613 -12.110
   75    HE   ARG  11           HE       ARG  11  -8.573  15.532 -11.696
   76   1HH1  ARG  11          1HH1      ARG  11  -8.836  12.809 -13.762
   77   2HH1  ARG  11          2HH1      ARG  11 -10.632  13.067 -14.034
   78   1HH2  ARG  11          1HH2      ARG  11 -10.861  15.581 -11.699
   79   2HH2  ARG  11          2HH2      ARG  11 -11.694  14.548 -12.966
   80    H    ALA  12           H        ALA  12  -7.659  12.866  -7.106
   81    HA   ALA  12           HA       ALA  12  -7.364  15.829  -7.053
   82   1HB   ALA  12          1HB       ALA  12  -9.399  15.797  -5.624
   83   2HB   ALA  12          2HB       ALA  12  -9.609  14.785  -7.066
   84   3HB   ALA  12          3HB       ALA  12  -9.311  14.024  -5.483
   85    H    PHE  13           H        PHE  13  -6.621  13.131  -4.908
   86    HA   PHE  13           HA       PHE  13  -6.019  14.654  -2.473
   87   1HB   PHE  13          1HB       PHE  13  -6.577  12.217  -2.520
   88   2HB   PHE  13          2HB       PHE  13  -5.066  11.850  -3.310
   89    HD1  PHE  13           HD1      PHE  13  -3.728  14.262  -1.378
   90    HD2  PHE  13           HD2      PHE  13  -5.836  10.564  -0.732
   91    HE1  PHE  13           HE1      PHE  13  -2.687  14.042   0.841
   92    HE2  PHE  13           HE2      PHE  13  -4.787  10.366   1.484
   93    HZ   PHE  13           HZ       PHE  13  -3.214  12.099   2.275
   94    H    LEU  14           H        LEU  14  -4.080  13.441  -5.192
   95    HA   LEU  14           HA       LEU  14  -1.481  14.563  -4.084
   96   1HB   LEU  14          1HB       LEU  14  -1.836  13.103  -6.757
   97   2HB   LEU  14          2HB       LEU  14  -0.346  13.393  -5.887
   98    HG   LEU  14           HG       LEU  14  -2.504  11.695  -4.547
   99   1HD1  LEU  14          1HD1      LEU  14   0.572  11.503  -4.446
  100   2HD1  LEU  14          2HD1      LEU  14  -0.410  12.409  -3.280
  101   3HD1  LEU  14          3HD1      LEU  14  -0.590  10.641  -3.406
  102   1HD2  LEU  14          1HD2      LEU  14  -1.717   9.633  -5.635
  103   2HD2  LEU  14          2HD2      LEU  14  -2.175  10.770  -6.927
  104   3HD2  LEU  14          3HD2      LEU  14  -0.465  10.519  -6.545
  105    H    SER  15           H        SER  15  -0.099  15.640  -5.850
  106    HA   SER  15           HA       SER  15  -1.751  17.713  -7.402
  107   1HB   SER  15          1HB       SER  15  -0.209  19.413  -6.866
  108   2HB   SER  15          2HB       SER  15   1.076  18.287  -6.423
  109    HG   SER  15           HG       SER  15   0.341  18.763  -4.527
  110    H    GLU  16           H        GLU  16  -0.137  18.781  -9.083
  111    HA   GLU  16           HA       GLU  16   0.520  16.730 -11.112
  112   1HB   GLU  16          1HB       GLU  16   1.308  19.675 -11.301
  113   2HB   GLU  16          2HB       GLU  16  -0.358  19.161 -11.478
  114   1HG   GLU  16          1HG       GLU  16   0.515  19.351 -13.711
  115   2HG   GLU  16          2HG       GLU  16   2.028  18.560 -13.304
  116    H    GLU  17           H        GLU  17   2.310  18.697  -8.814
  117    HA   GLU  17           HA       GLU  17   5.025  18.067  -9.931
  118   1HB   GLU  17          1HB       GLU  17   4.054  19.720  -7.582
  119   2HB   GLU  17          2HB       GLU  17   4.950  20.220  -9.003
  120   1HG   GLU  17          1HG       GLU  17   6.258  18.357  -6.940
  121   2HG   GLU  17          2HG       GLU  17   7.047  19.379  -8.129
  122    H    MET  18           H        MET  18   2.919  17.014  -7.303
  123    HA   MET  18           HA       MET  18   4.881  15.312  -5.850
  124   1HB   MET  18          1HB       MET  18   2.668  14.234  -4.895
  125   2HB   MET  18          2HB       MET  18   1.837  15.530  -5.736
  126   1HG   MET  18          1HG       MET  18   3.558  17.132  -4.413
  127   2HG   MET  18          2HG       MET  18   2.090  16.517  -3.636
  128   1HE   MET  18          1HE       MET  18   2.330  13.667  -2.720
  129   2HE   MET  18          2HE       MET  18   3.253  13.780  -1.192
  130   3HE   MET  18          3HE       MET  18   2.008  15.006  -1.573
  131    H    ILE  19           H        ILE  19   2.520  14.896  -8.442
  132    HA   ILE  19           HA       ILE  19   2.525  11.957  -8.621
  133    HB   ILE  19           HB       ILE  19   1.371  14.169 -10.172
  134   1HG1  ILE  19          1HG1      ILE  19   0.620  11.276  -9.496
  135   2HG1  ILE  19          2HG1      ILE  19  -0.262  12.109 -10.758
  136   1HG2  ILE  19          1HG2      ILE  19   1.215  13.039 -12.405
  137   2HG2  ILE  19          2HG2      ILE  19   2.897  13.399 -12.023
  138   3HG2  ILE  19          3HG2      ILE  19   2.293  11.736 -11.847
  139   1HD1  ILE  19          1HD1      ILE  19  -1.032  13.888  -9.213
  140   2HD1  ILE  19          2HD1      ILE  19  -1.428  12.283  -8.566
  141   3HD1  ILE  19          3HD1      ILE  19  -0.058  13.194  -7.888
  142    H    ALA  20           H        ALA  20   4.536  14.558  -9.914
  143    HA   ALA  20           HA       ALA  20   6.044  13.226 -11.955
  144   1HB   ALA  20          1HB       ALA  20   7.789  14.970 -11.599
  145   2HB   ALA  20          2HB       ALA  20   6.159  15.670 -11.583
  146   3HB   ALA  20          3HB       ALA  20   7.045  15.442 -10.054
  147    H    GLU  21           H        GLU  21   6.450  13.184  -8.443
  148    HA   GLU  21           HA       GLU  21   9.153  12.075  -8.283
  149   1HB   GLU  21          1HB       GLU  21   6.898  11.915  -6.213
  150   2HB   GLU  21          2HB       GLU  21   8.568  11.480  -5.907
  151   1HG   GLU  21          1HG       GLU  21   7.336  14.240  -6.301
  152   2HG   GLU  21          2HG       GLU  21   9.008  14.031  -6.794
  153    H    PHE  22           H        PHE  22   5.925  10.649  -8.469
  154    HA   PHE  22           HA       PHE  22   6.817   7.811  -8.094
  155   1HB   PHE  22          1HB       PHE  22   4.073   8.854  -9.030
  156   2HB   PHE  22          2HB       PHE  22   4.449   7.213  -8.581
  157    HD1  PHE  22           HD1      PHE  22   3.045  10.188  -7.320
  158    HD2  PHE  22           HD2      PHE  22   5.631   6.970  -6.102
  159    HE1  PHE  22           HE1      PHE  22   2.626  10.731  -4.959
  160    HE2  PHE  22           HE2      PHE  22   5.198   7.529  -3.745
  161    HZ   PHE  22           HZ       PHE  22   3.709   9.415  -3.168
  162    H    LYS  23           H        LYS  23   6.275  10.053 -10.721
  163    HA   LYS  23           HA       LYS  23   5.680   8.426 -13.004
  164   1HB   LYS  23          1HB       LYS  23   6.541  11.126 -12.608
  165   2HB   LYS  23          2HB       LYS  23   7.740  10.441 -13.683
  166   1HG   LYS  23          1HG       LYS  23   5.518   9.581 -15.024
  167   2HG   LYS  23          2HG       LYS  23   4.789  10.920 -14.153
  168   1HD   LYS  23          1HD       LYS  23   6.495  12.516 -15.094
  169   2HD   LYS  23          2HD       LYS  23   5.508  11.747 -16.343
  170   1HE   LYS  23          1HE       LYS  23   8.428  11.091 -15.607
  171   2HE   LYS  23          2HE       LYS  23   7.453   9.978 -16.578
  172   1HZ   LYS  23          1HZ       LYS  23   8.397  12.680 -17.270
  173   2HZ   LYS  23          2HZ       LYS  23   7.009  12.132 -17.979
  174   3HZ   LYS  23          3HZ       LYS  23   8.421  11.297 -18.173
  175    H    ALA  24           H        ALA  24   8.813   9.080 -11.457
  176    HA   ALA  24           HA       ALA  24  10.579   7.833 -13.411
  177   1HB   ALA  24          1HB       ALA  24  12.281   7.812 -11.599
  178   2HB   ALA  24          2HB       ALA  24  11.427   9.365 -11.661
  179   3HB   ALA  24          3HB       ALA  24  11.036   8.186 -10.383
  180    H    ALA  25           H        ALA  25   9.369   6.563 -10.285
  181    HA   ALA  25           HA       ALA  25  10.528   3.905 -10.410
  182   1HB   ALA  25          1HB       ALA  25   8.908   3.305  -8.619
  183   2HB   ALA  25          2HB       ALA  25   9.657   4.882  -8.305
  184   3HB   ALA  25          3HB       ALA  25   7.983   4.798  -8.910
  185    H    PHE  26           H        PHE  26   7.626   5.263 -11.828
  186    HA   PHE  26           HA       PHE  26   6.098   2.783 -12.306
  187   1HB   PHE  26          1HB       PHE  26   4.832   4.811 -12.371
  188   2HB   PHE  26          2HB       PHE  26   5.892   5.586 -13.518
  189    HD1  PHE  26           HD1      PHE  26   2.987   3.385 -13.084
  190    HD2  PHE  26           HD2      PHE  26   5.859   4.741 -15.985
  191    HE1  PHE  26           HE1      PHE  26   1.501   2.664 -14.909
  192    HE2  PHE  26           HE2      PHE  26   4.356   4.021 -17.797
  193    HZ   PHE  26           HZ       PHE  26   2.179   2.980 -17.264
  194    H    ASP  27           H        ASP  27   8.312   4.746 -14.296
  195    HA   ASP  27           HA       ASP  27   8.262   3.088 -16.728
  196   1HB   ASP  27          1HB       ASP  27   9.071   5.307 -17.041
  197   2HB   ASP  27          2HB       ASP  27  10.210   5.204 -15.719
  198    H    MET  28           H        MET  28  10.136   3.058 -13.742
  199    HA   MET  28           HA       MET  28  12.291   1.251 -14.407
  200   1HB   MET  28          1HB       MET  28  11.784   2.536 -12.120
  201   2HB   MET  28          2HB       MET  28  10.985   1.042 -11.665
  202   1HG   MET  28          1HG       MET  28  13.118  -0.253 -12.041
  203   2HG   MET  28          2HG       MET  28  13.939   1.239 -12.530
  204   1HE   MET  28          1HE       MET  28  12.030   3.185 -10.439
  205   2HE   MET  28          2HE       MET  28  13.225   3.412  -9.128
  206   3HE   MET  28          3HE       MET  28  13.738   3.555 -10.835
  207    H    PHE  29           H        PHE  29   8.973   0.593 -13.316
  208    HA   PHE  29           HA       PHE  29   9.256  -2.362 -13.182
  209   1HB   PHE  29          1HB       PHE  29   6.692  -0.657 -13.264
  210   2HB   PHE  29          2HB       PHE  29   6.728  -2.378 -12.985
  211    HD1  PHE  29           HD1      PHE  29   5.411  -0.923 -10.937
  212    HD2  PHE  29           HD2      PHE  29   9.661  -1.465 -11.360
  213    HE1  PHE  29           HE1      PHE  29   5.716  -0.504  -8.531
  214    HE2  PHE  29           HE2      PHE  29   9.943  -1.036  -8.954
  215    HZ   PHE  29           HZ       PHE  29   7.979  -0.548  -7.539
  216    H    ASP  30           H        ASP  30   8.092   0.009 -15.537
  217    HA   ASP  30           HA       ASP  30   6.920  -1.744 -17.553
  218   1HB   ASP  30          1HB       ASP  30   6.956   0.917 -17.405
  219   2HB   ASP  30          2HB       ASP  30   8.410   0.784 -18.366
  220    H    ALA  31           H        ALA  31   7.830  -3.310 -18.625
  221    HA   ALA  31           HA       ALA  31  10.857  -3.445 -19.000
  222   1HB   ALA  31          1HB       ALA  31  10.509  -5.893 -19.357
  223   2HB   ALA  31          2HB       ALA  31   9.843  -5.353 -17.803
  224   3HB   ALA  31          3HB       ALA  31   8.750  -5.699 -19.168
  225    H    ASP  32           H        ASP  32   7.775  -3.429 -20.694
  226    HA   ASP  32           HA       ASP  32   8.949  -4.037 -23.409
  227   1HB   ASP  32          1HB       ASP  32   6.574  -4.790 -22.596
  228   2HB   ASP  32          2HB       ASP  32   6.823  -4.296 -24.255
  229    H    GLY  33           H        GLY  33   7.407  -1.311 -21.698
  230   1HA   GLY  33          1HA       GLY  33   8.351   1.021 -21.772
  231   2HA   GLY  33          2HA       GLY  33   9.098   0.624 -23.302
  232    H    GLY  34           H        GLY  34   5.764  -0.224 -22.584
  233   1HA   GLY  34          1HA       GLY  34   3.758   0.372 -23.891
  234   2HA   GLY  34          2HA       GLY  34   4.679   1.645 -24.704
  235    H    GLY  35           H        GLY  35   2.072   1.756 -23.365
  236   1HA   GLY  35          1HA       GLY  35   2.608   4.086 -21.429
  237   2HA   GLY  35          2HA       GLY  35   1.205   3.990 -22.501
  238    H    ASP  36           H        ASP  36   2.437   1.218 -20.740
  239    HA   ASP  36           HA       ASP  36   0.679   1.455 -18.363
  240   1HB   ASP  36          1HB       ASP  36  -0.240  -1.011 -19.729
  241   2HB   ASP  36          2HB       ASP  36  -1.130   0.169 -18.796
  242    H    ILE  37           H        ILE  37   0.474  -1.344 -17.881
  243    HA   ILE  37           HA       ILE  37   3.241  -2.541 -18.169
  244    HB   ILE  37           HB       ILE  37   2.215  -2.896 -15.410
  245   1HG1  ILE  37          1HG1      ILE  37   2.808  -0.100 -16.346
  246   2HG1  ILE  37          2HG1      ILE  37   1.834  -0.662 -15.001
  247   1HG2  ILE  37          1HG2      ILE  37   4.613  -2.910 -14.839
  248   2HG2  ILE  37          2HG2      ILE  37   4.329  -3.933 -16.255
  249   3HG2  ILE  37          3HG2      ILE  37   5.050  -2.318 -16.461
  250   1HD1  ILE  37          1HD1      ILE  37   4.904  -0.443 -14.955
  251   2HD1  ILE  37          2HD1      ILE  37   3.730   0.586 -14.107
  252   3HD1  ILE  37          3HD1      ILE  37   3.915  -1.118 -13.633
  253    H    SER  38           H        SER  38   3.101  -4.784 -16.851
  254    HA   SER  38           HA       SER  38   0.412  -6.147 -17.237
  255   1HB   SER  38          1HB       SER  38   1.999  -6.186 -19.408
  256   2HB   SER  38          2HB       SER  38   0.964  -7.545 -18.963
  257    HG   SER  38           HG       SER  38   3.131  -8.109 -19.418
  258    H    THR  39           H        THR  39   1.225  -8.730 -16.957
  259    HA   THR  39           HA       THR  39   2.040  -8.872 -14.060
  260    HB   THR  39           HB       THR  39   1.674 -11.503 -14.714
  261    HG1  THR  39           HG1      THR  39   0.070 -11.677 -16.156
  262   1HG2  THR  39          1HG2      THR  39  -0.597 -11.365 -13.792
  263   2HG2  THR  39          2HG2      THR  39   0.459 -10.272 -12.868
  264   3HG2  THR  39          3HG2      THR  39  -0.674  -9.611 -14.077
  265    H    LYS  40           H        LYS  40   3.193  -9.933 -17.248
  266    HA   LYS  40           HA       LYS  40   5.524 -11.484 -16.328
  267   1HB   LYS  40          1HB       LYS  40   5.391 -10.153 -19.060
  268   2HB   LYS  40          2HB       LYS  40   4.267 -11.436 -18.698
  269   1HG   LYS  40          1HG       LYS  40   5.928 -13.036 -18.958
  270   2HG   LYS  40          2HG       LYS  40   7.088 -12.143 -18.010
  271   1HD   LYS  40          1HD       LYS  40   8.029 -11.033 -19.913
  272   2HD   LYS  40          2HD       LYS  40   7.695 -12.663 -20.419
  273   1HE   LYS  40          1HE       LYS  40   6.035 -12.133 -21.921
  274   2HE   LYS  40          2HE       LYS  40   5.483 -10.705 -21.056
  275   1HZ   LYS  40          1HZ       LYS  40   7.773 -10.985 -22.904
  276   2HZ   LYS  40          2HZ       LYS  40   7.793  -9.765 -21.791
  277   3HZ   LYS  40          3HZ       LYS  40   6.571  -9.852 -22.900
  278    H    GLU  41           H        GLU  41   4.870  -8.110 -17.112
  279    HA   GLU  41           HA       GLU  41   7.658  -7.154 -17.281
  280   1HB   GLU  41          1HB       GLU  41   6.854  -5.036 -17.668
  281   2HB   GLU  41          2HB       GLU  41   5.508  -5.189 -16.559
  282   1HG   GLU  41          1HG       GLU  41   5.510  -6.746 -19.206
  283   2HG   GLU  41          2HG       GLU  41   4.153  -6.381 -18.162
  284    H    LEU  42           H        LEU  42   5.164  -7.068 -14.733
  285    HA   LEU  42           HA       LEU  42   6.740  -5.546 -12.751
  286   1HB   LEU  42          1HB       LEU  42   4.364  -7.411 -12.180
  287   2HB   LEU  42          2HB       LEU  42   4.174  -5.794 -12.821
  288    HG   LEU  42           HG       LEU  42   5.785  -6.022 -10.263
  289   1HD1  LEU  42          1HD1      LEU  42   2.715  -6.295 -10.198
  290   2HD1  LEU  42          2HD1      LEU  42   3.828  -7.650  -9.953
  291   3HD1  LEU  42          3HD1      LEU  42   3.828  -6.287  -8.806
  292   1HD2  LEU  42          1HD2      LEU  42   4.681  -3.886  -9.698
  293   2HD2  LEU  42          2HD2      LEU  42   5.265  -3.777 -11.378
  294   3HD2  LEU  42          3HD2      LEU  42   3.543  -4.054 -11.060
  295    H    GLY  43           H        GLY  43   6.225  -8.969 -13.452
  296   1HA   GLY  43          1HA       GLY  43   7.149 -10.298 -11.083
  297   2HA   GLY  43          2HA       GLY  43   7.345 -10.969 -12.705
  298    H    THR  44           H        THR  44   8.975  -8.689 -13.629
  299    HA   THR  44           HA       THR  44  11.616  -9.886 -13.003
  300    HB   THR  44           HB       THR  44  10.700  -7.703 -14.888
  301    HG1  THR  44           HG1      THR  44  10.661  -9.808 -15.542
  302   1HG2  THR  44          1HG2      THR  44  13.048  -7.303 -15.651
  303   2HG2  THR  44          2HG2      THR  44  12.799  -6.703 -13.998
  304   3HG2  THR  44          3HG2      THR  44  13.671  -8.234 -14.266
  305    H    VAL  45           H        VAL  45  10.092  -6.716 -12.430
  306    HA   VAL  45           HA       VAL  45  12.336  -5.364 -11.164
  307    HB   VAL  45           HB       VAL  45   9.721  -4.618 -11.849
  308   1HG1  VAL  45          1HG1      VAL  45  11.717  -2.850 -10.301
  309   2HG1  VAL  45          2HG1      VAL  45  11.903  -3.256 -12.011
  310   3HG1  VAL  45          3HG1      VAL  45  10.483  -2.328 -11.477
  311   1HG2  VAL  45          1HG2      VAL  45   8.679  -3.527  -9.930
  312   2HG2  VAL  45          2HG2      VAL  45   8.952  -5.220  -9.455
  313   3HG2  VAL  45          3HG2      VAL  45  10.034  -3.956  -8.853
  314    H    MET  46           H        MET  46   9.716  -7.389  -9.876
  315    HA   MET  46           HA       MET  46  10.037  -6.998  -7.033
  316   1HB   MET  46          1HB       MET  46   9.085  -9.477  -8.571
  317   2HB   MET  46          2HB       MET  46   9.155  -9.431  -6.819
  318   1HG   MET  46          1HG       MET  46   7.197  -8.098  -8.666
  319   2HG   MET  46          2HG       MET  46   7.720  -7.090  -7.306
  320   1HE   MET  46          1HE       MET  46   5.398  -6.985  -6.081
  321   2HE   MET  46          2HE       MET  46   5.222  -8.160  -4.745
  322   3HE   MET  46          3HE       MET  46   6.746  -7.244  -4.929
  323    NH1  ARG  47           NH1      ARG  47  18.081 -12.349 -10.593
  324    NH2  ARG  47           NH2      ARG  47  18.405 -14.313  -9.497
  325    H    ARG  47           H        ARG  47  11.773  -9.065  -9.314
  326    HA   ARG  47           HA       ARG  47  13.322 -10.658  -7.378
  327   1HB   ARG  47          1HB       ARG  47  14.540 -10.205 -10.092
  328   2HB   ARG  47          2HB       ARG  47  12.893 -10.821 -10.096
  329   1HG   ARG  47          1HG       ARG  47  13.452 -12.851  -9.004
  330   2HG   ARG  47          2HG       ARG  47  14.909 -12.187  -8.265
  331   1HD   ARG  47          1HD       ARG  47  14.533 -13.267 -11.091
  332   2HD   ARG  47          2HD       ARG  47  15.642 -11.918 -10.899
  333    HE   ARG  47           HE       ARG  47  16.020 -14.521  -9.360
  334   1HH1  ARG  47          1HH1      ARG  47  17.412 -11.668 -10.968
  335   2HH1  ARG  47          2HH1      ARG  47  19.105 -12.292 -10.634
  336   1HH2  ARG  47          1HH2      ARG  47  17.988 -15.130  -9.036
  337   2HH2  ARG  47          2HH2      ARG  47  19.406 -14.119  -9.614
  338    H    MET  48           H        MET  48  13.913  -7.649  -9.149
  339    HA   MET  48           HA       MET  48  16.725  -7.241  -8.756
  340   1HB   MET  48          1HB       MET  48  15.787  -4.627  -8.467
  341   2HB   MET  48          2HB       MET  48  14.434  -5.393  -9.278
  342   1HG   MET  48          1HG       MET  48  16.758  -6.290 -10.727
  343   2HG   MET  48          2HG       MET  48  15.513  -5.149 -11.264
  344   1HE   MET  48          1HE       MET  48  15.586  -2.472  -9.940
  345   2HE   MET  48          2HE       MET  48  16.971  -1.638 -10.702
  346   3HE   MET  48          3HE       MET  48  15.887  -2.653 -11.696
  347    H    LEU  49           H        LEU  49  14.027  -6.762  -6.535
  348    HA   LEU  49           HA       LEU  49  15.884  -6.585  -4.138
  349   1HB   LEU  49          1HB       LEU  49  15.772  -4.237  -4.779
  350   2HB   LEU  49          2HB       LEU  49  14.898  -4.488  -3.284
  351    HG   LEU  49           HG       LEU  49  12.831  -4.701  -5.180
  352   1HD1  LEU  49          1HD1      LEU  49  12.118  -2.462  -4.337
  353   2HD1  LEU  49          2HD1      LEU  49  12.719  -3.469  -3.007
  354   3HD1  LEU  49          3HD1      LEU  49  13.741  -2.168  -3.665
  355   1HD2  LEU  49          1HD2      LEU  49  14.738  -2.466  -6.148
  356   2HD2  LEU  49          2HD2      LEU  49  14.276  -3.920  -7.066
  357   3HD2  LEU  49          3HD2      LEU  49  13.055  -2.698  -6.684
  358    H    GLY  50           H        GLY  50  14.579  -8.728  -4.427
  359   1HA   GLY  50          1HA       GLY  50  12.838  -8.949  -2.081
  360   2HA   GLY  50          2HA       GLY  50  11.797  -8.929  -3.512
  361    H    GLN  51           H        GLN  51  11.708 -10.633  -4.864
  362    HA   GLN  51           HA       GLN  51  13.498 -13.054  -4.664
  363   1HB   GLN  51          1HB       GLN  51  11.978 -14.609  -3.717
  364   2HB   GLN  51          2HB       GLN  51  11.991 -13.228  -2.637
  365   1HG   GLN  51          1HG       GLN  51   9.775 -13.990  -4.623
  366   2HG   GLN  51          2HG       GLN  51   9.814 -12.421  -3.850
  367   1HE2  GLN  51          1HE2      GLN  51   8.749 -15.751  -1.615
  368   2HE2  GLN  51          2HE2      GLN  51   9.607 -15.922  -3.228
  369    H    ASN  52           H        ASN  52  12.073 -14.898  -5.894
  370    HA   ASN  52           HA       ASN  52  11.020 -13.605  -8.451
  371   1HB   ASN  52          1HB       ASN  52  13.380 -14.695  -8.553
  372   2HB   ASN  52          2HB       ASN  52  12.599 -16.253  -8.393
  373   1HD2  ASN  52          1HD2      ASN  52  13.085 -15.455 -12.069
  374   2HD2  ASN  52          2HD2      ASN  52  14.129 -15.716 -10.583
  375    HA   PRO  53           HA       PRO  53   7.445 -16.289  -6.645
  376   1HB   PRO  53          1HB       PRO  53   5.921 -14.501  -8.556
  377   2HB   PRO  53          2HB       PRO  53   5.614 -14.942  -6.870
  378   1HG   PRO  53          1HG       PRO  53   6.607 -12.471  -7.580
  379   2HG   PRO  53          2HG       PRO  53   6.908 -13.191  -5.982
  380   1HD   PRO  53          1HD       PRO  53   9.204 -13.061  -6.641
  381   2HD   PRO  53          2HD       PRO  53   8.805 -12.935  -8.378
  382    H    THR  54           H        THR  54   5.790 -17.507  -7.982
  383    HA   THR  54           HA       THR  54   7.101 -18.782 -10.379
  384    HB   THR  54           HB       THR  54   5.946 -20.052  -8.395
  385    HG1  THR  54           HG1      THR  54   6.792 -21.129 -10.052
  386   1HG2  THR  54          1HG2      THR  54   3.625 -20.797  -8.812
  387   2HG2  THR  54          2HG2      THR  54   3.654 -19.037  -8.557
  388   3HG2  THR  54          3HG2      THR  54   3.474 -19.697 -10.203
  389    H    LYS  55           H        LYS  55   5.826 -19.224 -12.310
  390    HA   LYS  55           HA       LYS  55   5.054 -16.845 -13.675
  391   1HB   LYS  55          1HB       LYS  55   3.857 -18.461 -15.360
  392   2HB   LYS  55          2HB       LYS  55   4.333 -19.771 -14.300
  393   1HG   LYS  55          1HG       LYS  55   5.822 -19.352 -16.318
  394   2HG   LYS  55          2HG       LYS  55   6.343 -17.838 -15.601
  395   1HD   LYS  55          1HD       LYS  55   6.650 -20.469 -14.021
  396   2HD   LYS  55          2HD       LYS  55   7.780 -20.073 -15.305
  397   1HE   LYS  55          1HE       LYS  55   7.405 -17.779 -13.459
  398   2HE   LYS  55          2HE       LYS  55   7.955 -19.216 -12.602
  399   1HZ   LYS  55          1HZ       LYS  55   9.648 -19.266 -14.642
  400   2HZ   LYS  55          2HZ       LYS  55   9.939 -18.348 -13.299
  401   3HZ   LYS  55          3HZ       LYS  55   9.330 -17.645 -14.665
  402    H    GLU  56           H        GLU  56   2.966 -19.313 -12.167
  403    HA   GLU  56           HA       GLU  56   0.391 -17.960 -12.755
  404   1HB   GLU  56          1HB       GLU  56   0.386 -19.860 -10.463
  405   2HB   GLU  56          2HB       GLU  56   1.114 -20.526 -11.911
  406   1HG   GLU  56          1HG       GLU  56  -1.181 -19.461 -13.030
  407   2HG   GLU  56          2HG       GLU  56  -1.040 -21.110 -12.445
  408    H    GLU  57           H        GLU  57   2.724 -18.013 -10.115
  409    HA   GLU  57           HA       GLU  57   1.321 -16.742  -7.961
  410   1HB   GLU  57          1HB       GLU  57   4.198 -15.943  -8.470
  411   2HB   GLU  57          2HB       GLU  57   3.821 -17.620  -8.142
  412   1HG   GLU  57          1HG       GLU  57   4.518 -16.001  -6.152
  413   2HG   GLU  57          2HG       GLU  57   2.859 -15.420  -6.209
  414    H    LEU  58           H        LEU  58   2.791 -15.346 -10.858
  415    HA   LEU  58           HA       LEU  58   2.518 -12.516 -10.063
  416   1HB   LEU  58          1HB       LEU  58   3.529 -14.047 -12.410
  417   2HB   LEU  58          2HB       LEU  58   2.764 -12.538 -12.865
  418    HG   LEU  58           HG       LEU  58   5.134 -12.116 -12.591
  419   1HD1  LEU  58          1HD1      LEU  58   5.043 -13.165  -9.685
  420   2HD1  LEU  58          2HD1      LEU  58   5.642 -14.125 -11.046
  421   3HD1  LEU  58          3HD1      LEU  58   6.478 -12.620 -10.590
  422   1HD2  LEU  58          1HD2      LEU  58   5.161 -10.293 -10.929
  423   2HD2  LEU  58          2HD2      LEU  58   3.550 -10.341 -11.687
  424   3HD2  LEU  58          3HD2      LEU  58   3.778 -11.000 -10.056
  425    H    ASP  59           H        ASP  59   0.641 -14.813 -11.989
  426    HA   ASP  59           HA       ASP  59  -1.300 -12.982 -13.172
  427   1HB   ASP  59          1HB       ASP  59  -1.880 -15.931 -12.559
  428   2HB   ASP  59          2HB       ASP  59  -2.667 -14.912 -13.742
  429    H    ALA  60           H        ALA  60  -1.121 -14.637 -10.073
  430    HA   ALA  60           HA       ALA  60  -3.915 -14.121  -9.210
  431   1HB   ALA  60          1HB       ALA  60  -3.168 -15.010  -7.007
  432   2HB   ALA  60          2HB       ALA  60  -2.653 -16.063  -8.340
  433   3HB   ALA  60          3HB       ALA  60  -1.470 -14.995  -7.541
  434    H    ILE  61           H        ILE  61  -0.740 -12.659  -8.567
  435    HA   ILE  61           HA       ILE  61  -1.396 -10.784  -6.467
  436    HB   ILE  61           HB       ILE  61   0.817 -11.007  -8.453
  437   1HG1  ILE  61          1HG1      ILE  61   1.725 -11.780  -6.503
  438   2HG1  ILE  61          2HG1      ILE  61   0.433 -11.112  -5.528
  439   1HG2  ILE  61          1HG2      ILE  61   1.764  -8.721  -8.025
  440   2HG2  ILE  61          2HG2      ILE  61   0.224  -8.605  -8.874
  441   3HG2  ILE  61          3HG2      ILE  61   0.294  -8.260  -7.131
  442   1HD1  ILE  61          1HD1      ILE  61   1.546  -8.902  -5.352
  443   2HD1  ILE  61          2HD1      ILE  61   2.646 -10.203  -4.846
  444   3HD1  ILE  61          3HD1      ILE  61   2.850  -9.447  -6.444
  445    H    ILE  62           H        ILE  62  -1.799 -10.647  -9.975
  446    HA   ILE  62           HA       ILE  62  -2.802  -7.826 -10.033
  447    HB   ILE  62           HB       ILE  62  -2.292  -9.943 -12.122
  448   1HG1  ILE  62          1HG1      ILE  62  -1.448  -7.024 -11.672
  449   2HG1  ILE  62          2HG1      ILE  62  -0.437  -8.451 -11.748
  450   1HG2  ILE  62          1HG2      ILE  62  -3.444  -8.628 -13.924
  451   2HG2  ILE  62          2HG2      ILE  62  -4.617  -9.198 -12.738
  452   3HG2  ILE  62          3HG2      ILE  62  -4.095  -7.498 -12.711
  453   1HD1  ILE  62          1HD1      ILE  62  -1.825  -7.184 -14.184
  454   2HD1  ILE  62          2HD1      ILE  62  -0.094  -7.171 -13.788
  455   3HD1  ILE  62          3HD1      ILE  62  -0.887  -8.703 -14.221
  456    H    GLU  63           H        GLU  63  -4.101 -11.120 -10.161
  457    HA   GLU  63           HA       GLU  63  -6.858 -10.767 -10.695
  458   1HB   GLU  63          1HB       GLU  63  -5.546 -12.943 -10.109
  459   2HB   GLU  63          2HB       GLU  63  -5.962 -12.621  -8.437
  460   1HG   GLU  63          1HG       GLU  63  -8.151 -12.755 -10.593
  461   2HG   GLU  63          2HG       GLU  63  -7.484 -14.223  -9.899
  462    H    GLU  64           H        GLU  64  -5.055  -9.940  -7.789
  463    HA   GLU  64           HA       GLU  64  -7.390  -9.320  -6.067
  464   1HB   GLU  64          1HB       GLU  64  -4.392  -9.027  -5.791
  465   2HB   GLU  64          2HB       GLU  64  -5.401  -8.053  -4.739
  466   1HG   GLU  64          1HG       GLU  64  -5.657 -11.123  -4.967
  467   2HG   GLU  64          2HG       GLU  64  -4.615 -10.322  -3.803
  468    H    VAL  65           H        VAL  65  -4.959  -7.363  -7.812
  469    HA   VAL  65           HA       VAL  65  -6.729  -4.876  -7.526
  470    HB   VAL  65           HB       VAL  65  -4.747  -4.421  -6.339
  471   1HG1  VAL  65          1HG1      VAL  65  -2.412  -4.736  -7.181
  472   2HG1  VAL  65          2HG1      VAL  65  -3.282  -6.280  -7.143
  473   3HG1  VAL  65          3HG1      VAL  65  -3.023  -5.448  -8.695
  474   1HG2  VAL  65          1HG2      VAL  65  -4.341  -3.110  -9.116
  475   2HG2  VAL  65          2HG2      VAL  65  -5.367  -2.491  -7.800
  476   3HG2  VAL  65          3HG2      VAL  65  -3.612  -2.559  -7.588
  477    H    ASP  66           H        ASP  66  -7.920  -5.718  -9.357
  478    HA   ASP  66           HA       ASP  66  -7.255  -4.458 -11.896
  479   1HB   ASP  66          1HB       ASP  66  -7.058  -7.427 -12.414
  480   2HB   ASP  66          2HB       ASP  66  -5.652  -6.664 -11.707
  481    H    GLU  67           H        GLU  67  -9.374  -4.702 -10.072
  482    HA   GLU  67           HA       GLU  67 -11.519  -6.472 -11.229
  483   1HB   GLU  67          1HB       GLU  67 -12.874  -5.877  -9.362
  484   2HB   GLU  67          2HB       GLU  67 -11.256  -6.174  -8.755
  485   1HG   GLU  67          1HG       GLU  67 -11.981  -3.281  -9.380
  486   2HG   GLU  67          2HG       GLU  67 -10.906  -3.913  -8.145
  487    H    ASP  68           H        ASP  68 -10.318  -4.247 -12.827
  488    HA   ASP  68           HA       ASP  68 -12.646  -2.295 -13.137
  489   1HB   ASP  68          1HB       ASP  68 -10.287  -1.669 -14.807
  490   2HB   ASP  68          2HB       ASP  68 -11.227  -0.649 -13.742
  491    H    GLY  69           H        GLY  69 -10.411  -4.361 -15.019
  492   1HA   GLY  69          1HA       GLY  69 -12.391  -4.404 -17.369
  493   2HA   GLY  69          2HA       GLY  69 -11.797  -5.929 -16.703
  494    H    SER  70           H        SER  70  -9.946  -2.936 -17.056
  495    HA   SER  70           HA       SER  70  -8.702  -3.166 -19.585
  496   1HB   SER  70          1HB       SER  70  -8.348  -1.183 -18.268
  497   2HB   SER  70          2HB       SER  70  -6.762  -1.870 -18.627
  498    HG   SER  70           HG       SER  70  -6.874  -1.321 -16.491
  499    H    GLY  71           H        GLY  71  -7.581  -4.618 -16.512
  500   1HA   GLY  71          1HA       GLY  71  -6.360  -6.710 -16.127
  501   2HA   GLY  71          2HA       GLY  71  -6.383  -6.995 -17.873
  502    H    THR  72           H        THR  72  -5.265  -3.989 -16.456
  503    HA   THR  72           HA       THR  72  -2.358  -4.716 -16.533
  504    HB   THR  72           HB       THR  72  -1.670  -2.873 -18.078
  505    HG1  THR  72           HG1      THR  72  -4.450  -2.764 -18.473
  506   1HG2  THR  72          1HG2      THR  72  -2.104  -3.989 -20.229
  507   2HG2  THR  72          2HG2      THR  72  -1.733  -5.225 -19.006
  508   3HG2  THR  72          3HG2      THR  72  -3.416  -4.967 -19.535
  509    H    ILE  73           H        ILE  73  -1.062  -3.153 -15.493
  510    HA   ILE  73           HA       ILE  73  -2.571  -1.355 -13.553
  511    HB   ILE  73           HB       ILE  73   0.311  -2.382 -13.464
  512   1HG1  ILE  73          1HG1      ILE  73  -0.353  -4.046 -12.007
  513   2HG1  ILE  73          2HG1      ILE  73  -1.873  -3.884 -12.860
  514   1HG2  ILE  73          1HG2      ILE  73   0.548  -1.290 -11.237
  515   2HG2  ILE  73          2HG2      ILE  73   0.161  -0.067 -12.455
  516   3HG2  ILE  73          3HG2      ILE  73  -1.100  -0.628 -11.332
  517   1HD1  ILE  73          1HD1      ILE  73  -2.860  -2.474 -11.074
  518   2HD1  ILE  73          2HD1      ILE  73  -2.230  -3.994 -10.405
  519   3HD1  ILE  73          3HD1      ILE  73  -1.315  -2.484 -10.181
  520    H    ASP  74           H        ASP  74  -3.073   0.255 -15.039
  521    HA   ASP  74           HA       ASP  74  -1.083   1.698 -16.684
  522   1HB   ASP  74          1HB       ASP  74  -3.699   3.028 -15.883
  523   2HB   ASP  74          2HB       ASP  74  -2.789   3.164 -17.370
  524    H    PHE  75           H        PHE  75  -1.088   4.240 -16.328
  525    HA   PHE  75           HA       PHE  75   0.515   4.799 -13.936
  526   1HB   PHE  75          1HB       PHE  75   0.641   6.005 -16.223
  527   2HB   PHE  75          2HB       PHE  75  -0.783   6.901 -15.768
  528    HD1  PHE  75           HD1      PHE  75  -0.680   8.641 -13.958
  529    HD2  PHE  75           HD2      PHE  75   2.844   6.452 -15.104
  530    HE1  PHE  75           HE1      PHE  75   0.733  10.280 -12.785
  531    HE2  PHE  75           HE2      PHE  75   4.239   8.100 -13.920
  532    HZ   PHE  75           HZ       PHE  75   3.190  10.014 -12.764
  533    H    GLU  76           H        GLU  76  -2.858   5.349 -14.839
  534    HA   GLU  76           HA       GLU  76  -3.600   7.072 -12.557
  535   1HB   GLU  76          1HB       GLU  76  -5.771   5.530 -13.940
  536   2HB   GLU  76          2HB       GLU  76  -5.709   7.202 -13.422
  537   1HG   GLU  76          1HG       GLU  76  -3.953   7.494 -15.430
  538   2HG   GLU  76          2HG       GLU  76  -4.617   5.975 -15.992
  539    H    GLU  77           H        GLU  77  -3.594   3.616 -13.179
  540    HA   GLU  77           HA       GLU  77  -5.184   2.857 -10.753
  541   1HB   GLU  77          1HB       GLU  77  -5.341   1.475 -12.772
  542   2HB   GLU  77          2HB       GLU  77  -3.628   1.129 -12.734
  543   1HG   GLU  77          1HG       GLU  77  -5.138   0.357 -10.230
  544   2HG   GLU  77          2HG       GLU  77  -3.822  -0.485 -11.042
  545    H    PHE  78           H        PHE  78  -1.815   3.225 -11.633
  546    HA   PHE  78           HA       PHE  78  -0.538   1.729  -9.490
  547   1HB   PHE  78          1HB       PHE  78   0.697   2.554 -11.494
  548   2HB   PHE  78          2HB       PHE  78   0.490   4.215 -11.003
  549    HD1  PHE  78           HD1      PHE  78   1.158   1.756  -8.298
  550    HD2  PHE  78           HD2      PHE  78   3.025   4.405 -11.128
  551    HE1  PHE  78           HE1      PHE  78   3.312   1.498  -7.135
  552    HE2  PHE  78           HE2      PHE  78   5.172   4.127  -9.957
  553    HZ   PHE  78           HZ       PHE  78   5.322   2.671  -7.966
  554    H    LEU  79           H        LEU  79  -0.717   5.292  -9.698
  555    HA   LEU  79           HA       LEU  79  -0.049   5.901  -6.973
  556   1HB   LEU  79          1HB       LEU  79  -1.918   7.935  -7.765
  557   2HB   LEU  79          2HB       LEU  79  -0.172   8.017  -7.689
  558    HG   LEU  79           HG       LEU  79  -1.599   6.921 -10.182
  559   1HD1  LEU  79          1HD1      LEU  79  -1.464   9.206 -11.177
  560   2HD1  LEU  79          2HD1      LEU  79  -2.505   9.211  -9.742
  561   3HD1  LEU  79          3HD1      LEU  79  -0.853   9.870  -9.640
  562   1HD2  LEU  79          1HD2      LEU  79   1.214   8.154  -9.804
  563   2HD2  LEU  79          2HD2      LEU  79   0.852   6.434 -10.093
  564   3HD2  LEU  79          3HD2      LEU  79   0.512   7.627 -11.355
  565    H    VAL  80           H        VAL  80  -3.120   4.961  -8.398
  566    HA   VAL  80           HA       VAL  80  -4.950   5.624  -6.246
  567    HB   VAL  80           HB       VAL  80  -5.086   3.566  -8.470
  568   1HG1  VAL  80          1HG1      VAL  80  -6.981   5.916  -7.847
  569   2HG1  VAL  80          2HG1      VAL  80  -5.557   6.074  -8.884
  570   3HG1  VAL  80          3HG1      VAL  80  -6.869   4.969  -9.354
  571   1HG2  VAL  80          1HG2      VAL  80  -7.347   2.848  -7.846
  572   2HG2  VAL  80          2HG2      VAL  80  -6.292   2.514  -6.453
  573   3HG2  VAL  80          3HG2      VAL  80  -7.369   3.919  -6.424
  574    H    MET  81           H        MET  81  -3.208   2.574  -6.938
  575    HA   MET  81           HA       MET  81  -3.931   0.914  -4.754
  576   1HB   MET  81          1HB       MET  81  -0.980   0.910  -5.396
  577   2HB   MET  81          2HB       MET  81  -2.069   0.668  -6.749
  578   1HG   MET  81          1HG       MET  81  -3.204  -1.227  -5.312
  579   2HG   MET  81          2HG       MET  81  -1.788  -1.098  -4.256
  580   1HE   MET  81          1HE       MET  81  -1.871  -3.818  -5.079
  581   2HE   MET  81          2HE       MET  81  -0.415  -4.188  -6.051
  582   3HE   MET  81          3HE       MET  81  -0.270  -3.187  -4.578
  583    H    MET  82           H        MET  82  -1.114   3.125  -4.778
  584    HA   MET  82           HA       MET  82  -0.339   2.734  -1.995
  585   1HB   MET  82          1HB       MET  82   0.966   3.846  -4.018
  586   2HB   MET  82          2HB       MET  82   1.343   4.259  -2.356
  587   1HG   MET  82          1HG       MET  82  -0.406   6.271  -2.741
  588   2HG   MET  82          2HG       MET  82  -0.128   5.925  -4.453
  589   1HE   MET  82          1HE       MET  82   2.736   7.076  -1.138
  590   2HE   MET  82          2HE       MET  82   0.949   7.038  -1.167
  591   3HE   MET  82          3HE       MET  82   1.817   8.503  -1.712
  592    H    VAL  83           H        VAL  83  -2.636   4.902  -3.542
  593    HA   VAL  83           HA       VAL  83  -2.938   6.904  -1.418
  594    HB   VAL  83           HB       VAL  83  -3.861   6.729  -4.014
  595   1HG1  VAL  83          1HG1      VAL  83  -6.354   6.928  -3.980
  596   2HG1  VAL  83          2HG1      VAL  83  -5.850   5.324  -3.432
  597   3HG1  VAL  83          3HG1      VAL  83  -6.384   6.533  -2.242
  598   1HG2  VAL  83          1HG2      VAL  83  -4.887   8.707  -1.871
  599   2HG2  VAL  83          2HG2      VAL  83  -3.392   8.885  -2.818
  600   3HG2  VAL  83          3HG2      VAL  83  -4.960   8.946  -3.636
  601    NH1  ARG  84           NH1      ARG  84  -6.048  -1.403  -1.330
  602    NH2  ARG  84           NH2      ARG  84  -7.342  -2.812  -2.555
  603    H    ARG  84           H        ARG  84  -4.493   3.809  -2.142
  604    HA   ARG  84           HA       ARG  84  -6.827   3.842  -0.434
  605   1HB   ARG  84          1HB       ARG  84  -5.045   1.598  -1.473
  606   2HB   ARG  84          2HB       ARG  84  -6.213   1.235  -0.211
  607   1HG   ARG  84          1HG       ARG  84  -7.312   2.803  -2.544
  608   2HG   ARG  84          2HG       ARG  84  -8.077   1.539  -1.577
  609   1HD   ARG  84          1HD       ARG  84  -7.134   1.163  -4.157
  610   2HD   ARG  84          2HD       ARG  84  -5.722   0.615  -3.251
  611    HE   ARG  84           HE       ARG  84  -8.481  -0.661  -3.199
  612   1HH1  ARG  84          1HH1      ARG  84  -8.067  -2.919  -3.272
  613   2HH1  ARG  84          2HH1      ARG  84  -6.888  -3.561  -2.021
  614   1HH2  ARG  84          1HH2      ARG  84  -5.713  -0.445  -1.180
  615   2HH2  ARG  84          2HH2      ARG  84  -5.754  -2.244  -0.821
  616    H    GLN  85           H        GLN  85  -3.436   3.044   0.291
  617    HA   GLN  85           HA       GLN  85  -3.962   2.287   3.143
  618   1HB   GLN  85          1HB       GLN  85  -2.066   1.419   1.485
  619   2HB   GLN  85          2HB       GLN  85  -1.824   1.494   3.221
  620   1HG   GLN  85          1HG       GLN  85  -0.023   2.461   1.433
  621   2HG   GLN  85          2HG       GLN  85  -0.975   3.920   1.587
  622   1HE2  GLN  85          1HE2      GLN  85   1.695   4.170   4.197
  623   2HE2  GLN  85          2HE2      GLN  85   1.486   4.263   2.377
  624    H    MET  86           H        MET  86  -2.722   5.052   1.329
  625    HA   MET  86           HA       MET  86  -1.531   6.672   3.379
  626   1HB   MET  86          1HB       MET  86  -2.965   8.472   1.608
  627   2HB   MET  86          2HB       MET  86  -2.412   7.113   0.647
  628   1HG   MET  86          1HG       MET  86  -0.235   8.053   2.431
  629   2HG   MET  86          2HG       MET  86  -0.242   7.831   0.673
  630   1HE   MET  86          1HE       MET  86  -2.950   9.670  -0.028
  631   2HE   MET  86          2HE       MET  86  -2.158  11.212  -0.467
  632   3HE   MET  86          3HE       MET  86  -1.488   9.665  -1.063
  633    H    LYS  87           H        LYS  87  -4.912   6.111   2.585
  634    HA   LYS  87           HA       LYS  87  -6.358   8.184   3.885
  635   1HB   LYS  87          1HB       LYS  87  -8.020   6.220   4.628
  636   2HB   LYS  87          2HB       LYS  87  -6.967   5.204   3.655
  637   1HG   LYS  87          1HG       LYS  87  -7.536   6.233   1.617
  638   2HG   LYS  87          2HG       LYS  87  -8.023   7.749   2.357
  639   1HD   LYS  87          1HD       LYS  87 -10.127   6.725   3.194
  640   2HD   LYS  87          2HD       LYS  87  -9.955   6.520   1.454
  641   1HE   LYS  87          1HE       LYS  87  -8.854   4.195   3.022
  642   2HE   LYS  87          2HE       LYS  87 -10.590   4.450   3.249
  643   1HZ   LYS  87          1HZ       LYS  87  -9.553   3.119   1.189
  644   2HZ   LYS  87          2HZ       LYS  87  -9.671   4.610   0.488
  645   3HZ   LYS  87          3HZ       LYS  87 -11.016   3.884   1.116
  646    H    GLU  88           H        GLU  88  -6.678   8.847   5.890
  647    HA   GLU  88           HA       GLU  88  -5.644   7.196   8.250
  648   1HB   GLU  88          1HB       GLU  88  -3.991   8.999   7.557
  649   2HB   GLU  88          2HB       GLU  88  -5.184  10.215   7.971
  650   1HG   GLU  88          1HG       GLU  88  -5.166   9.448  10.372
  651   2HG   GLU  88          2HG       GLU  88  -4.053   8.151   9.971
  652    H    ASP  89           H        ASP  89  -8.236   7.212   7.315
  653    HA   ASP  89           HA       ASP  89  -9.759   8.509   9.591
  654   1HB   ASP  89          1HB       ASP  89 -11.446   9.592   8.289
  655   2HB   ASP  89          2HB       ASP  89  -9.900  10.167   7.710
  656    H    ALA  90           H        ALA  90  -9.016   5.937   9.424
  657    HA   ALA  90           HA       ALA  90  -9.808   3.660   9.520
  658   1HB   ALA  90          1HB       ALA  90 -12.231   3.335  10.079
  659   2HB   ALA  90          2HB       ALA  90 -11.524   4.623  11.075
  660   3HB   ALA  90          3HB       ALA  90 -12.578   5.041   9.702
   
  Start of MODEL          25
 Raw file had  660 H/Q atoms
  Start of MODEL   25
    1   1H    ALA   1          1H        ALA   1 -15.928   1.168 -17.230
    2   2H    ALA   1          2H        ALA   1 -16.222   1.004 -15.582
    3   3H    ALA   1          3H        ALA   1 -15.340  -0.171 -16.400
    4    HA   ALA   1           HA       ALA   1 -17.138  -0.985 -17.552
    5   1HB   ALA   1          1HB       ALA   1 -17.048  -1.023 -14.743
    6   2HB   ALA   1          2HB       ALA   1 -18.075  -2.060 -15.752
    7   3HB   ALA   1          3HB       ALA   1 -18.737  -0.557 -15.058
    8    H    SER   2           H        SER   2 -17.933   2.007 -15.791
    9    HA   SER   2           HA       SER   2 -19.610   3.049 -18.051
   10   1HB   SER   2          1HB       SER   2 -21.709   3.334 -16.774
   11   2HB   SER   2          2HB       SER   2 -21.291   1.630 -16.967
   12    HG   SER   2           HG       SER   2 -21.846   1.940 -14.886
   13    H    MET   3           H        MET   3 -18.743   3.378 -14.605
   14    HA   MET   3           HA       MET   3 -18.588   6.414 -14.852
   15   1HB   MET   3          1HB       MET   3 -18.276   4.953 -12.203
   16   2HB   MET   3          2HB       MET   3 -18.865   6.576 -12.514
   17   1HG   MET   3          1HG       MET   3 -20.612   4.501 -13.771
   18   2HG   MET   3          2HG       MET   3 -20.435   4.283 -12.025
   19   1HE   MET   3          1HE       MET   3 -23.431   6.321 -11.073
   20   2HE   MET   3          2HE       MET   3 -22.274   5.006 -10.709
   21   3HE   MET   3          3HE       MET   3 -23.352   4.875 -12.129
   22    H    THR   4           H        THR   4 -16.771   7.291 -13.333
   23    HA   THR   4           HA       THR   4 -14.161   5.806 -13.778
   24    HB   THR   4           HB       THR   4 -13.114   8.028 -14.561
   25    HG1  THR   4           HG1      THR   4 -14.488   9.389 -15.569
   26   1HG2  THR   4          1HG2      THR   4 -13.215   6.184 -16.183
   27   2HG2  THR   4          2HG2      THR   4 -13.737   7.677 -16.995
   28   3HG2  THR   4          3HG2      THR   4 -14.942   6.464 -16.493
   29    H    ASP   5           H        ASP   5 -15.190   5.780 -11.391
   30    HA   ASP   5           HA       ASP   5 -14.684   8.185  -9.696
   31   1HB   ASP   5          1HB       ASP   5 -15.816   7.147  -8.003
   32   2HB   ASP   5          2HB       ASP   5 -16.474   6.244  -9.348
   33    H    GLN   6           H        GLN   6 -13.046   5.194 -10.521
   34    HA   GLN   6           HA       GLN   6 -11.014   4.887  -8.548
   35   1HB   GLN   6          1HB       GLN   6 -11.216   4.196 -11.459
   36   2HB   GLN   6          2HB       GLN   6  -9.575   4.338 -10.857
   37   1HG   GLN   6          1HG       GLN   6 -11.758   2.426  -9.858
   38   2HG   GLN   6          2HG       GLN   6 -10.315   2.720  -8.914
   39   1HE2  GLN   6          1HE2      GLN   6  -8.658   0.126 -10.721
   40   2HE2  GLN   6          2HE2      GLN   6  -9.116   0.901  -9.122
   41    H    GLN   7           H        GLN   7 -10.135   6.343 -11.664
   42    HA   GLN   7           HA       GLN   7  -7.794   7.789 -10.598
   43   1HB   GLN   7          1HB       GLN   7  -7.256   8.232 -12.778
   44   2HB   GLN   7          2HB       GLN   7  -8.839   8.910 -13.128
   45   1HG   GLN   7          1HG       GLN   7  -7.859   6.529 -14.183
   46   2HG   GLN   7          2HG       GLN   7  -8.865   5.913 -12.881
   47   1HE2  GLN   7          1HE2      GLN   7 -11.466   6.176 -15.404
   48   2HE2  GLN   7          2HE2      GLN   7 -10.320   5.069 -14.494
   49    H    ALA   8           H        ALA   8 -11.176   8.608 -11.056
   50    HA   ALA   8           HA       ALA   8 -11.224  11.459 -11.090
   51   1HB   ALA   8          1HB       ALA   8 -13.484  11.308 -10.055
   52   2HB   ALA   8          2HB       ALA   8 -13.266  10.075 -11.311
   53   3HB   ALA   8          3HB       ALA   8 -13.195   9.614  -9.591
   54    H    GLU   9           H        GLU   9 -11.030   9.302  -8.251
   55    HA   GLU   9           HA       GLU   9 -10.853  11.575  -6.292
   56   1HB   GLU   9          1HB       GLU   9 -11.204  10.063  -4.570
   57   2HB   GLU   9          2HB       GLU   9 -12.056   9.286  -5.897
   58   1HG   GLU   9          1HG       GLU   9 -10.094   7.734  -6.298
   59   2HG   GLU   9          2HG       GLU   9  -9.225   8.479  -4.961
   60    H    ALA  10           H        ALA  10  -8.748   8.790  -7.124
   61    HA   ALA  10           HA       ALA  10  -6.459   9.376  -5.510
   62   1HB   ALA  10          1HB       ALA  10  -5.140   8.006  -7.117
   63   2HB   ALA  10          2HB       ALA  10  -6.708   7.255  -6.766
   64   3HB   ALA  10          3HB       ALA  10  -6.452   8.093  -8.317
   65    NH1  ARG  11           NH1      ARG  11  -6.893  14.672 -14.707
   66    NH2  ARG  11           NH2      ARG  11  -5.812  16.668 -14.784
   67    H    ARG  11           H        ARG  11  -7.542  10.869  -8.487
   68    HA   ARG  11           HA       ARG  11  -5.019  12.128  -9.402
   69   1HB   ARG  11          1HB       ARG  11  -7.361  11.734 -10.674
   70   2HB   ARG  11          2HB       ARG  11  -7.749  13.319 -10.022
   71   1HG   ARG  11          1HG       ARG  11  -5.067  13.414 -11.227
   72   2HG   ARG  11          2HG       ARG  11  -6.223  12.750 -12.385
   73   1HD   ARG  11          1HD       ARG  11  -7.726  14.712 -12.123
   74   2HD   ARG  11          2HD       ARG  11  -6.726  15.377 -10.829
   75    HE   ARG  11           HE       ARG  11  -4.967  15.918 -12.534
   76   1HH1  ARG  11          1HH1      ARG  11  -5.258  17.374 -14.286
   77   2HH1  ARG  11          2HH1      ARG  11  -6.093  16.691 -15.771
   78   1HH2  ARG  11          1HH2      ARG  11  -7.227  13.889 -14.135
   79   2HH2  ARG  11          2HH2      ARG  11  -7.037  14.802 -15.715
   80    H    ALA  12           H        ALA  12  -7.958  13.720  -8.144
   81    HA   ALA  12           HA       ALA  12  -6.853  16.292  -7.542
   82   1HB   ALA  12          1HB       ALA  12  -8.787  16.657  -6.024
   83   2HB   ALA  12          2HB       ALA  12  -9.292  15.865  -7.530
   84   3HB   ALA  12          3HB       ALA  12  -9.160  14.916  -6.028
   85    H    PHE  13           H        PHE  13  -6.725  13.304  -5.691
   86    HA   PHE  13           HA       PHE  13  -5.882  14.354  -3.102
   87   1HB   PHE  13          1HB       PHE  13  -5.341  11.567  -4.276
   88   2HB   PHE  13          2HB       PHE  13  -6.851  12.052  -3.550
   89    HD1  PHE  13           HD1      PHE  13  -5.329   9.708  -2.528
   90    HD2  PHE  13           HD2      PHE  13  -4.956  13.849  -1.413
   91    HE1  PHE  13           HE1      PHE  13  -4.472   9.048  -0.317
   92    HE2  PHE  13           HE2      PHE  13  -4.096  13.169   0.789
   93    HZ   PHE  13           HZ       PHE  13  -3.859  10.773   1.345
   94    H    LEU  14           H        LEU  14  -4.076  13.034  -5.881
   95    HA   LEU  14           HA       LEU  14  -1.382  13.718  -4.666
   96   1HB   LEU  14          1HB       LEU  14  -1.860  12.477  -7.428
   97   2HB   LEU  14          2HB       LEU  14  -0.379  12.477  -6.496
   98    HG   LEU  14           HG       LEU  14  -2.879  11.036  -5.448
   99   1HD1  LEU  14          1HD1      LEU  14  -2.061   8.932  -6.516
  100   2HD1  LEU  14          2HD1      LEU  14  -2.453  10.149  -7.745
  101   3HD1  LEU  14          3HD1      LEU  14  -0.751   9.823  -7.332
  102   1HD2  LEU  14          1HD2      LEU  14   0.134  10.584  -4.903
  103   2HD2  LEU  14          2HD2      LEU  14  -1.035  11.320  -3.781
  104   3HD2  LEU  14          3HD2      LEU  14  -1.200   9.616  -4.227
  105    H    SER  15           H        SER  15  -0.391  15.530  -5.067
  106    HA   SER  15           HA       SER  15  -1.495  17.648  -6.857
  107   1HB   SER  15          1HB       SER  15   1.237  18.025  -5.657
  108   2HB   SER  15          2HB       SER  15  -0.082  17.749  -4.516
  109    HG   SER  15           HG       SER  15   0.500  19.915  -5.961
  110    H    GLU  16           H        GLU  16   0.326  18.874  -8.160
  111    HA   GLU  16           HA       GLU  16   1.085  17.103 -10.437
  112   1HB   GLU  16          1HB       GLU  16   0.226  19.326 -10.918
  113   2HB   GLU  16          2HB       GLU  16   1.477  20.104  -9.969
  114   1HG   GLU  16          1HG       GLU  16   1.676  18.825 -12.733
  115   2HG   GLU  16          2HG       GLU  16   3.123  18.851 -11.741
  116    H    GLU  17           H        GLU  17   2.678  18.799  -7.793
  117    HA   GLU  17           HA       GLU  17   5.442  17.786  -8.484
  118   1HB   GLU  17          1HB       GLU  17   5.943  18.890  -6.126
  119   2HB   GLU  17          2HB       GLU  17   4.359  19.620  -6.305
  120   1HG   GLU  17          1HG       GLU  17   5.380  20.333  -8.748
  121   2HG   GLU  17          2HG       GLU  17   6.903  20.117  -7.903
  122    H    MET  18           H        MET  18   3.730  15.695  -8.268
  123    HA   MET  18           HA       MET  18   4.723  14.124  -5.894
  124   1HB   MET  18          1HB       MET  18   2.008  13.437  -5.756
  125   2HB   MET  18          2HB       MET  18   1.933  15.174  -5.984
  126   1HG   MET  18          1HG       MET  18   2.309  13.861  -3.524
  127   2HG   MET  18          2HG       MET  18   3.946  14.418  -3.910
  128   1HE   MET  18          1HE       MET  18   3.030  15.698  -1.389
  129   2HE   MET  18          2HE       MET  18   1.831  17.024  -1.447
  130   3HE   MET  18          3HE       MET  18   1.308  15.337  -1.729
  131    H    ILE  19           H        ILE  19   2.505  14.302  -8.677
  132    HA   ILE  19           HA       ILE  19   2.405  11.449  -9.312
  133    HB   ILE  19           HB       ILE  19   1.618  13.960 -10.747
  134   1HG1  ILE  19          1HG1      ILE  19   0.279  11.291 -10.024
  135   2HG1  ILE  19          2HG1      ILE  19  -0.439  12.332 -11.234
  136   1HG2  ILE  19          1HG2      ILE  19   1.189  12.818 -12.938
  137   2HG2  ILE  19          2HG2      ILE  19   2.916  12.829 -12.586
  138   3HG2  ILE  19          3HG2      ILE  19   1.980  11.336 -12.347
  139   1HD1  ILE  19          1HD1      ILE  19  -0.730  14.200  -9.629
  140   2HD1  ILE  19          2HD1      ILE  19  -1.453  12.709  -8.992
  141   3HD1  ILE  19          3HD1      ILE  19   0.112  13.272  -8.359
  142    H    ALA  20           H        ALA  20   4.613  14.080 -10.138
  143    HA   ALA  20           HA       ALA  20   6.138  12.926 -12.288
  144   1HB   ALA  20          1HB       ALA  20   7.939  14.533 -11.666
  145   2HB   ALA  20          2HB       ALA  20   6.341  15.304 -11.633
  146   3HB   ALA  20          3HB       ALA  20   7.148  14.861 -10.107
  147    H    GLU  21           H        GLU  21   6.498  12.571  -8.772
  148    HA   GLU  21           HA       GLU  21   9.112  11.288  -8.672
  149   1HB   GLU  21          1HB       GLU  21   8.147  10.316  -6.407
  150   2HB   GLU  21          2HB       GLU  21   6.766  11.346  -6.727
  151   1HG   GLU  21          1HG       GLU  21   9.557  12.079  -5.869
  152   2HG   GLU  21          2HG       GLU  21   8.022  12.811  -5.437
  153    H    PHE  22           H        PHE  22   5.841  10.077  -9.166
  154    HA   PHE  22           HA       PHE  22   6.626   7.166  -9.043
  155   1HB   PHE  22          1HB       PHE  22   3.860   8.248  -9.821
  156   2HB   PHE  22          2HB       PHE  22   4.274   6.653  -9.254
  157    HD1  PHE  22           HD1      PHE  22   2.463   9.238  -8.137
  158    HD2  PHE  22           HD2      PHE  22   5.969   7.093  -6.860
  159    HE1  PHE  22           HE1      PHE  22   2.103  10.004  -5.828
  160    HE2  PHE  22           HE2      PHE  22   5.589   7.867  -4.555
  161    HZ   PHE  22           HZ       PHE  22   3.672   9.337  -4.038
  162    H    LYS  23           H        LYS  23   6.212   9.680 -11.403
  163    HA   LYS  23           HA       LYS  23   5.464   8.119 -13.790
  164   1HB   LYS  23          1HB       LYS  23   5.787  10.853 -13.257
  165   2HB   LYS  23          2HB       LYS  23   7.180  10.532 -14.266
  166   1HG   LYS  23          1HG       LYS  23   4.478   9.531 -15.251
  167   2HG   LYS  23          2HG       LYS  23   5.901  10.006 -16.163
  168   1HD   LYS  23          1HD       LYS  23   4.311  11.757 -16.550
  169   2HD   LYS  23          2HD       LYS  23   3.819  11.835 -14.855
  170   1HE   LYS  23          1HE       LYS  23   5.946  12.889 -14.183
  171   2HE   LYS  23          2HE       LYS  23   5.297  13.793 -15.559
  172   1HZ   LYS  23          1HZ       LYS  23   7.772  13.008 -15.525
  173   2HZ   LYS  23          2HZ       LYS  23   6.930  12.982 -16.945
  174   3HZ   LYS  23          3HZ       LYS  23   7.170  11.582 -16.102
  175    H    ALA  24           H        ALA  24   8.538   9.051 -12.291
  176    HA   ALA  24           HA       ALA  24  10.343   8.160 -14.435
  177   1HB   ALA  24          1HB       ALA  24  12.147   8.382 -12.737
  178   2HB   ALA  24          2HB       ALA  24  11.070   9.791 -12.719
  179   3HB   ALA  24          3HB       ALA  24  10.944   8.560 -11.437
  180    H    ALA  25           H        ALA  25   9.950   6.743 -11.170
  181    HA   ALA  25           HA       ALA  25  11.234   4.193 -11.585
  182   1HB   ALA  25          1HB       ALA  25   9.976   3.409  -9.588
  183   2HB   ALA  25          2HB       ALA  25  10.639   5.034  -9.333
  184   3HB   ALA  25          3HB       ALA  25   8.901   4.825  -9.669
  185    H    PHE  26           H        PHE  26   7.997   5.311 -12.366
  186    HA   PHE  26           HA       PHE  26   6.527   2.881 -12.790
  187   1HB   PHE  26          1HB       PHE  26   5.501   5.165 -12.984
  188   2HB   PHE  26          2HB       PHE  26   6.288   5.419 -14.519
  189    HD1  PHE  26           HD1      PHE  26   4.254   2.581 -12.959
  190    HD2  PHE  26           HD2      PHE  26   4.809   5.160 -16.357
  191    HE1  PHE  26           HE1      PHE  26   2.374   1.486 -14.111
  192    HE2  PHE  26           HE2      PHE  26   2.928   4.051 -17.495
  193    HZ   PHE  26           HZ       PHE  26   1.700   2.226 -16.371
  194    H    ASP  27           H        ASP  27   8.523   4.691 -15.137
  195    HA   ASP  27           HA       ASP  27   8.277   2.902 -17.420
  196   1HB   ASP  27          1HB       ASP  27  10.821   4.524 -16.923
  197   2HB   ASP  27          2HB       ASP  27   9.313   5.319 -17.312
  198    H    MET  28           H        MET  28  10.511   2.967 -14.674
  199    HA   MET  28           HA       MET  28  12.477   1.019 -15.427
  200   1HB   MET  28          1HB       MET  28  11.360   1.196 -12.571
  201   2HB   MET  28          2HB       MET  28  12.444   2.394 -13.254
  202   1HG   MET  28          1HG       MET  28  14.299   0.843 -13.397
  203   2HG   MET  28          2HG       MET  28  13.248  -0.571 -13.203
  204   1HE   MET  28          1HE       MET  28  13.372   2.969 -11.275
  205   2HE   MET  28          2HE       MET  28  14.300   2.486  -9.824
  206   3HE   MET  28          3HE       MET  28  15.078   2.443 -11.434
  207    H    PHE  29           H        PHE  29   9.242   0.558 -14.041
  208    HA   PHE  29           HA       PHE  29   9.380  -2.397 -13.785
  209   1HB   PHE  29          1HB       PHE  29   6.900  -2.300 -13.423
  210   2HB   PHE  29          2HB       PHE  29   6.868  -0.621 -13.888
  211    HD1  PHE  29           HD1      PHE  29   9.827  -1.658 -11.933
  212    HD2  PHE  29           HD2      PHE  29   5.802  -0.161 -11.622
  213    HE1  PHE  29           HE1      PHE  29  10.221  -1.052  -9.581
  214    HE2  PHE  29           HE2      PHE  29   6.217   0.429  -9.270
  215    HZ   PHE  29           HZ       PHE  29   8.412  -0.034  -8.239
  216    H    ASP  30           H        ASP  30   8.165  -0.088 -16.188
  217    HA   ASP  30           HA       ASP  30   6.856  -1.880 -18.073
  218   1HB   ASP  30          1HB       ASP  30   7.043   0.797 -18.043
  219   2HB   ASP  30          2HB       ASP  30   8.404   0.522 -19.106
  220    H    ALA  31           H        ALA  31   7.589  -3.172 -19.644
  221    HA   ALA  31           HA       ALA  31  10.590  -3.765 -19.766
  222   1HB   ALA  31          1HB       ALA  31   9.934  -6.048 -20.539
  223   2HB   ALA  31          2HB       ALA  31   9.212  -5.653 -18.967
  224   3HB   ALA  31          3HB       ALA  31   8.210  -5.616 -20.441
  225    H    ASP  32           H        ASP  32   7.679  -3.158 -21.678
  226    HA   ASP  32           HA       ASP  32   9.110  -3.387 -24.336
  227   1HB   ASP  32          1HB       ASP  32   6.650  -2.515 -25.104
  228   2HB   ASP  32          2HB       ASP  32   7.078  -4.196 -24.881
  229    H    GLY  33           H        GLY  33   6.934  -0.919 -22.913
  230   1HA   GLY  33          1HA       GLY  33   7.949   1.424 -22.401
  231   2HA   GLY  33          2HA       GLY  33   8.824   1.265 -23.906
  232    H    GLY  34           H        GLY  34   5.473   0.245 -23.470
  233   1HA   GLY  34          1HA       GLY  34   3.618   0.741 -25.037
  234   2HA   GLY  34          2HA       GLY  34   4.560   2.093 -25.680
  235    H    GLY  35           H        GLY  35   3.575   1.247 -22.356
  236   1HA   GLY  35          1HA       GLY  35   1.767   3.621 -22.000
  237   2HA   GLY  35          2HA       GLY  35   3.350   3.858 -21.247
  238    H    ASP  36           H        ASP  36   1.348   0.930 -21.575
  239    HA   ASP  36           HA       ASP  36   0.590   0.943 -18.655
  240   1HB   ASP  36          1HB       ASP  36  -1.184  -0.370 -19.173
  241   2HB   ASP  36          2HB       ASP  36  -0.241  -1.469 -20.154
  242    H    ILE  37           H        ILE  37   0.485  -1.816 -18.218
  243    HA   ILE  37           HA       ILE  37   3.216  -3.021 -18.633
  244    HB   ILE  37           HB       ILE  37   2.227  -2.597 -15.778
  245   1HG1  ILE  37          1HG1      ILE  37   4.875  -1.426 -16.738
  246   2HG1  ILE  37          2HG1      ILE  37   3.396  -0.553 -17.087
  247   1HG2  ILE  37          1HG2      ILE  37   4.273  -3.749 -15.030
  248   2HG2  ILE  37          2HG2      ILE  37   3.364  -4.798 -16.128
  249   3HG2  ILE  37          3HG2      ILE  37   4.823  -3.961 -16.710
  250   1HD1  ILE  37          1HD1      ILE  37   4.370  -1.265 -14.256
  251   2HD1  ILE  37          2HD1      ILE  37   4.345   0.337 -15.024
  252   3HD1  ILE  37          3HD1      ILE  37   2.814  -0.475 -14.625
  253    H    SER  38           H        SER  38   3.320  -5.250 -17.923
  254    HA   SER  38           HA       SER  38   0.590  -6.663 -17.915
  255   1HB   SER  38          1HB       SER  38   1.541  -6.797 -20.168
  256   2HB   SER  38          2HB       SER  38   3.075  -7.413 -19.550
  257    HG   SER  38           HG       SER  38   2.140  -9.280 -19.006
  258    H    THR  39           H        THR  39   0.857  -8.972 -17.225
  259    HA   THR  39           HA       THR  39   1.829  -9.179 -14.501
  260    HB   THR  39           HB       THR  39   1.773 -11.834 -15.160
  261    HG1  THR  39           HG1      THR  39   1.265 -11.724 -17.206
  262   1HG2  THR  39          1HG2      THR  39  -0.556 -11.923 -14.386
  263   2HG2  THR  39          2HG2      THR  39   0.325 -10.731 -13.403
  264   3HG2  THR  39          3HG2      THR  39  -0.787 -10.185 -14.686
  265    H    LYS  40           H        LYS  40   3.179 -10.759 -17.430
  266    HA   LYS  40           HA       LYS  40   5.582 -11.839 -16.426
  267   1HB   LYS  40          1HB       LYS  40   5.406 -10.462 -19.152
  268   2HB   LYS  40          2HB       LYS  40   4.611 -11.982 -18.834
  269   1HG   LYS  40          1HG       LYS  40   6.565 -13.033 -19.385
  270   2HG   LYS  40          2HG       LYS  40   7.358 -12.317 -18.007
  271   1HD   LYS  40          1HD       LYS  40   7.243 -10.537 -20.464
  272   2HD   LYS  40          2HD       LYS  40   8.449 -10.710 -19.223
  273   1HE   LYS  40          1HE       LYS  40   9.672 -12.271 -20.297
  274   2HE   LYS  40          2HE       LYS  40   8.284 -13.198 -20.850
  275   1HZ   LYS  40          1HZ       LYS  40   8.201 -11.992 -22.793
  276   2HZ   LYS  40          2HZ       LYS  40   9.815 -11.825 -22.486
  277   3HZ   LYS  40          3HZ       LYS  40   8.775 -10.592 -22.132
  278    H    GLU  41           H        GLU  41   5.170  -8.554 -17.802
  279    HA   GLU  41           HA       GLU  41   7.797  -7.497 -17.591
  280   1HB   GLU  41          1HB       GLU  41   6.860  -5.235 -17.517
  281   2HB   GLU  41          2HB       GLU  41   5.292  -5.844 -17.033
  282   1HG   GLU  41          1HG       GLU  41   6.625  -6.386 -19.762
  283   2HG   GLU  41          2HG       GLU  41   5.079  -7.036 -19.262
  284    H    LEU  42           H        LEU  42   5.229  -7.126 -15.118
  285    HA   LEU  42           HA       LEU  42   6.714  -5.701 -13.100
  286   1HB   LEU  42          1HB       LEU  42   4.127  -6.893 -13.275
  287   2HB   LEU  42          2HB       LEU  42   4.865  -7.673 -11.892
  288    HG   LEU  42           HG       LEU  42   5.059  -4.642 -12.016
  289   1HD1  LEU  42          1HD1      LEU  42   2.760  -4.376 -11.048
  290   2HD1  LEU  42          2HD1      LEU  42   2.694  -5.017 -12.696
  291   3HD1  LEU  42          3HD1      LEU  42   2.432  -6.107 -11.312
  292   1HD2  LEU  42          1HD2      LEU  42   4.524  -6.595  -9.676
  293   2HD2  LEU  42          2HD2      LEU  42   6.093  -5.856 -10.082
  294   3HD2  LEU  42          3HD2      LEU  42   4.752  -4.832  -9.538
  295    H    GLY  43           H        GLY  43   6.356  -9.200 -13.642
  296   1HA   GLY  43          1HA       GLY  43   7.565 -10.361 -11.336
  297   2HA   GLY  43          2HA       GLY  43   7.702 -11.083 -12.944
  298    H    THR  44           H        THR  44   9.162  -9.130 -14.277
  299    HA   THR  44           HA       THR  44  11.873 -10.022 -13.712
  300    HB   THR  44           HB       THR  44  10.753  -7.911 -15.573
  301    HG1  THR  44           HG1      THR  44  11.178 -10.399 -15.720
  302   1HG2  THR  44          1HG2      THR  44  13.029  -7.471 -16.512
  303   2HG2  THR  44          2HG2      THR  44  12.884  -6.842 -14.857
  304   3HG2  THR  44          3HG2      THR  44  13.774  -8.357 -15.158
  305    H    VAL  45           H        VAL  45  10.177  -6.985 -12.997
  306    HA   VAL  45           HA       VAL  45  12.460  -5.488 -11.914
  307    HB   VAL  45           HB       VAL  45   9.592  -4.995 -12.243
  308   1HG1  VAL  45          1HG1      VAL  45  11.880  -2.960 -11.882
  309   2HG1  VAL  45          2HG1      VAL  45  11.542  -3.781 -13.411
  310   3HG1  VAL  45          3HG1      VAL  45  10.315  -2.708 -12.700
  311   1HG2  VAL  45          1HG2      VAL  45   9.148  -3.433 -10.420
  312   2HG2  VAL  45          2HG2      VAL  45   9.640  -4.963  -9.658
  313   3HG2  VAL  45          3HG2      VAL  45  10.791  -3.622  -9.754
  314    H    MET  46           H        MET  46  10.064  -7.699 -10.562
  315    HA   MET  46           HA       MET  46  10.505  -7.308  -7.700
  316   1HB   MET  46          1HB       MET  46   9.565  -9.609  -7.383
  317   2HB   MET  46          2HB       MET  46   9.684  -9.911  -9.107
  318   1HG   MET  46          1HG       MET  46   7.681  -8.891  -9.532
  319   2HG   MET  46          2HG       MET  46   8.135  -7.434  -8.631
  320   1HE   MET  46          1HE       MET  46   7.971 -11.275  -7.399
  321   2HE   MET  46          2HE       MET  46   6.348 -11.291  -6.650
  322   3HE   MET  46          3HE       MET  46   6.510 -11.083  -8.418
  323    NH1  ARG  47           NH1      ARG  47  17.327 -10.437 -13.662
  324    NH2  ARG  47           NH2      ARG  47  18.997 -11.972 -13.510
  325    H    ARG  47           H        ARG  47  12.194  -9.148 -10.183
  326    HA   ARG  47           HA       ARG  47  13.820 -10.972  -8.682
  327   1HB   ARG  47          1HB       ARG  47  14.906  -9.474 -11.128
  328   2HB   ARG  47          2HB       ARG  47  13.629 -10.676 -11.258
  329   1HG   ARG  47          1HG       ARG  47  15.305 -12.256  -9.886
  330   2HG   ARG  47          2HG       ARG  47  16.531 -11.104 -10.417
  331   1HD   ARG  47          1HD       ARG  47  15.034 -13.156 -12.038
  332   2HD   ARG  47          2HD       ARG  47  15.131 -11.581 -12.810
  333    HE   ARG  47           HE       ARG  47  17.507 -13.322 -12.202
  334   1HH1  ARG  47          1HH1      ARG  47  16.365 -10.179 -13.419
  335   2HH1  ARG  47          2HH1      ARG  47  17.990  -9.885 -14.218
  336   1HH2  ARG  47          1HH2      ARG  47  19.310 -12.881 -13.153
  337   2HH2  ARG  47          2HH2      ARG  47  19.542 -11.313 -14.077
  338    H    MET  48           H        MET  48  14.345  -7.539  -9.409
  339    HA   MET  48           HA       MET  48  17.061  -7.152  -8.562
  340   1HB   MET  48          1HB       MET  48  16.730  -4.892  -8.698
  341   2HB   MET  48          2HB       MET  48  15.294  -5.419  -9.557
  342   1HG   MET  48          1HG       MET  48  13.819  -4.695  -7.888
  343   2HG   MET  48          2HG       MET  48  14.959  -4.994  -6.566
  344   1HE   MET  48          1HE       MET  48  13.114  -2.278  -6.976
  345   2HE   MET  48          2HE       MET  48  13.929  -0.952  -7.855
  346   3HE   MET  48          3HE       MET  48  13.294  -2.360  -8.756
  347    H    LEU  49           H        LEU  49  14.070  -7.123  -6.632
  348    HA   LEU  49           HA       LEU  49  15.211  -6.532  -4.013
  349   1HB   LEU  49          1HB       LEU  49  13.051  -8.140  -3.361
  350   2HB   LEU  49          2HB       LEU  49  12.615  -7.703  -4.999
  351    HG   LEU  49           HG       LEU  49  13.456  -5.392  -3.242
  352   1HD1  LEU  49          1HD1      LEU  49  11.576  -4.250  -4.423
  353   2HD1  LEU  49          2HD1      LEU  49  12.672  -5.017  -5.587
  354   3HD1  LEU  49          3HD1      LEU  49  11.106  -5.778  -5.211
  355   1HD2  LEU  49          1HD2      LEU  49  10.766  -6.845  -2.762
  356   2HD2  LEU  49          2HD2      LEU  49  12.095  -6.684  -1.588
  357   3HD2  LEU  49          3HD2      LEU  49  11.211  -5.245  -2.117
  358    H    GLY  50           H        GLY  50  14.104  -9.700  -5.264
  359   1HA   GLY  50          1HA       GLY  50  16.267 -11.457  -4.999
  360   2HA   GLY  50          2HA       GLY  50  15.876 -11.171  -3.298
  361    H    GLN  51           H        GLN  51  13.687 -11.400  -6.091
  362    HA   GLN  51           HA       GLN  51  12.513 -14.053  -5.244
  363   1HB   GLN  51          1HB       GLN  51  10.989 -11.429  -4.833
  364   2HB   GLN  51          2HB       GLN  51  11.348 -12.677  -3.655
  365   1HG   GLN  51          1HG       GLN  51   9.619 -13.383  -6.074
  366   2HG   GLN  51          2HG       GLN  51   8.916 -12.461  -4.764
  367   1HE2  GLN  51          1HE2      GLN  51   8.709 -15.303  -2.548
  368   2HE2  GLN  51          2HE2      GLN  51   8.650 -13.475  -2.695
  369    H    ASN  52           H        ASN  52  11.462 -15.011  -6.908
  370    HA   ASN  52           HA       ASN  52  10.666 -13.520  -9.376
  371   1HB   ASN  52          1HB       ASN  52  13.245 -14.063  -9.445
  372   2HB   ASN  52          2HB       ASN  52  12.771 -15.712  -9.791
  373   1HD2  ASN  52          1HD2      ASN  52  13.269 -13.901 -13.067
  374   2HD2  ASN  52          2HD2      ASN  52  14.274 -14.342 -11.597
  375    HA   PRO  53           HA       PRO  53   8.103 -17.423  -8.598
  376   1HB   PRO  53          1HB       PRO  53   6.403 -16.153  -7.592
  377   2HB   PRO  53          2HB       PRO  53   5.632 -16.375  -9.171
  378   1HG   PRO  53          1HG       PRO  53   6.209 -14.253  -9.990
  379   2HG   PRO  53          2HG       PRO  53   6.063 -13.837  -8.267
  380   1HD   PRO  53          1HD       PRO  53   8.443 -13.689  -8.018
  381   2HD   PRO  53          2HD       PRO  53   8.413 -13.474  -9.793
  382    H    THR  54           H        THR  54   6.251 -18.393 -10.082
  383    HA   THR  54           HA       THR  54   7.379 -18.711 -12.834
  384    HB   THR  54           HB       THR  54   6.339 -20.575 -11.278
  385    HG1  THR  54           HG1      THR  54   5.516 -21.422 -13.515
  386   1HG2  THR  54          1HG2      THR  54   4.043 -21.265 -11.885
  387   2HG2  THR  54          2HG2      THR  54   4.004 -19.663 -11.112
  388   3HG2  THR  54          3HG2      THR  54   3.820 -19.805 -12.879
  389    H    LYS  55           H        LYS  55   5.182 -19.145 -14.391
  390    HA   LYS  55           HA       LYS  55   4.417 -16.358 -15.131
  391   1HB   LYS  55          1HB       LYS  55   3.441 -18.966 -16.451
  392   2HB   LYS  55          2HB       LYS  55   5.014 -18.269 -16.783
  393   1HG   LYS  55          1HG       LYS  55   3.682 -16.085 -17.441
  394   2HG   LYS  55          2HG       LYS  55   3.819 -17.418 -18.572
  395   1HD   LYS  55          1HD       LYS  55   1.375 -16.378 -17.096
  396   2HD   LYS  55          2HD       LYS  55   1.535 -16.957 -18.747
  397   1HE   LYS  55          1HE       LYS  55   1.910 -19.349 -17.548
  398   2HE   LYS  55          2HE       LYS  55   1.042 -18.587 -16.219
  399   1HZ   LYS  55          1HZ       LYS  55  -0.610 -19.548 -17.533
  400   2HZ   LYS  55          2HZ       LYS  55   0.084 -19.126 -18.972
  401   3HZ   LYS  55          3HZ       LYS  55  -0.669 -17.980 -18.050
  402    H    GLU  56           H        GLU  56   2.663 -19.343 -14.239
  403    HA   GLU  56           HA       GLU  56  -0.026 -18.169 -14.161
  404   1HB   GLU  56          1HB       GLU  56   0.092 -20.460 -12.395
  405   2HB   GLU  56          2HB       GLU  56   1.137 -20.794 -13.762
  406   1HG   GLU  56          1HG       GLU  56  -1.489 -19.648 -14.617
  407   2HG   GLU  56          2HG       GLU  56  -0.634 -21.059 -15.215
  408    H    GLU  57           H        GLU  57   2.569 -18.582 -11.812
  409    HA   GLU  57           HA       GLU  57   1.179 -17.899  -9.330
  410   1HB   GLU  57          1HB       GLU  57   3.674 -16.947  -8.786
  411   2HB   GLU  57          2HB       GLU  57   4.059 -17.946 -10.171
  412   1HG   GLU  57          1HG       GLU  57   2.708 -19.864  -8.845
  413   2HG   GLU  57          2HG       GLU  57   4.391 -19.515  -8.471
  414    H    LEU  58           H        LEU  58   2.915 -15.909 -11.727
  415    HA   LEU  58           HA       LEU  58   2.503 -13.291 -10.547
  416   1HB   LEU  58          1HB       LEU  58   3.056 -14.261 -13.385
  417   2HB   LEU  58          2HB       LEU  58   2.673 -12.573 -13.111
  418    HG   LEU  58           HG       LEU  58   5.036 -14.160 -11.928
  419   1HD1  LEU  58          1HD1      LEU  58   6.453 -12.474 -13.165
  420   2HD1  LEU  58          2HD1      LEU  58   5.437 -13.400 -14.279
  421   3HD1  LEU  58          3HD1      LEU  58   4.985 -11.732 -13.852
  422   1HD2  LEU  58          1HD2      LEU  58   4.258 -11.236 -11.304
  423   2HD2  LEU  58          2HD2      LEU  58   4.161 -12.610 -10.174
  424   3HD2  LEU  58          3HD2      LEU  58   5.741 -12.065 -10.767
  425    H    ASP  59           H        ASP  59   0.495 -15.356 -12.576
  426    HA   ASP  59           HA       ASP  59  -1.571 -13.428 -13.339
  427   1HB   ASP  59          1HB       ASP  59  -1.184 -15.650 -14.500
  428   2HB   ASP  59          2HB       ASP  59  -1.900 -16.472 -13.132
  429    H    ALA  60           H        ALA  60  -1.083 -15.495 -10.535
  430    HA   ALA  60           HA       ALA  60  -3.736 -15.175  -9.287
  431   1HB   ALA  60          1HB       ALA  60  -2.668 -16.144  -7.257
  432   2HB   ALA  60          2HB       ALA  60  -2.257 -17.073  -8.712
  433   3HB   ALA  60          3HB       ALA  60  -1.054 -15.976  -7.988
  434    H    ILE  61           H        ILE  61  -0.636 -13.477  -9.031
  435    HA   ILE  61           HA       ILE  61  -1.227 -11.785  -6.699
  436    HB   ILE  61           HB       ILE  61   0.940 -11.918  -8.734
  437   1HG1  ILE  61          1HG1      ILE  61   2.050 -12.578  -6.864
  438   2HG1  ILE  61          2HG1      ILE  61   0.639 -12.255  -5.879
  439   1HG2  ILE  61          1HG2      ILE  61   1.863  -9.625  -8.294
  440   2HG2  ILE  61          2HG2      ILE  61   0.304  -9.519  -9.109
  441   3HG2  ILE  61          3HG2      ILE  61   0.407  -9.197  -7.362
  442   1HD1  ILE  61          1HD1      ILE  61   1.346  -9.922  -5.420
  443   2HD1  ILE  61          2HD1      ILE  61   2.644 -11.064  -5.011
  444   3HD1  ILE  61          3HD1      ILE  61   2.748 -10.109  -6.509
  445    H    ILE  62           H        ILE  62  -1.642 -11.445 -10.205
  446    HA   ILE  62           HA       ILE  62  -2.657  -8.642 -10.147
  447    HB   ILE  62           HB       ILE  62  -2.555 -10.747 -12.353
  448   1HG1  ILE  62          1HG1      ILE  62  -0.386  -9.902 -12.297
  449   2HG1  ILE  62          2HG1      ILE  62  -0.854  -8.395 -11.540
  450   1HG2  ILE  62          1HG2      ILE  62  -3.410  -9.039 -13.982
  451   2HG2  ILE  62          2HG2      ILE  62  -4.638  -9.397 -12.769
  452   3HG2  ILE  62          3HG2      ILE  62  -3.702  -7.889 -12.653
  453   1HD1  ILE  62          1HD1      ILE  62  -1.624  -7.415 -13.683
  454   2HD1  ILE  62          2HD1      ILE  62   0.038  -8.022 -13.832
  455   3HD1  ILE  62          3HD1      ILE  62  -1.306  -8.955 -14.528
  456    H    GLU  63           H        GLU  63  -3.977 -11.903 -10.025
  457    HA   GLU  63           HA       GLU  63  -6.737 -11.650 -10.503
  458   1HB   GLU  63          1HB       GLU  63  -5.332 -13.695  -9.614
  459   2HB   GLU  63          2HB       GLU  63  -5.831 -13.168  -8.019
  460   1HG   GLU  63          1HG       GLU  63  -8.259 -13.417  -8.684
  461   2HG   GLU  63          2HG       GLU  63  -7.779 -13.877 -10.308
  462    H    GLU  64           H        GLU  64  -4.981 -10.693  -7.558
  463    HA   GLU  64           HA       GLU  64  -7.304  -9.454  -6.175
  464   1HB   GLU  64          1HB       GLU  64  -4.348  -9.634  -5.663
  465   2HB   GLU  64          2HB       GLU  64  -5.702 -10.035  -4.626
  466   1HG   GLU  64          1HG       GLU  64  -4.093  -7.884  -4.195
  467   2HG   GLU  64          2HG       GLU  64  -5.231  -7.088  -5.269
  468    H    VAL  65           H        VAL  65  -8.224  -7.616  -6.691
  469    HA   VAL  65           HA       VAL  65  -8.600  -5.374  -7.510
  470    HB   VAL  65           HB       VAL  65  -5.940  -5.211  -6.868
  471   1HG1  VAL  65          1HG1      VAL  65  -4.671  -4.189  -8.763
  472   2HG1  VAL  65          2HG1      VAL  65  -5.118  -5.864  -9.137
  473   3HG1  VAL  65          3HG1      VAL  65  -6.015  -4.520  -9.884
  474   1HG2  VAL  65          1HG2      VAL  65  -7.571  -2.984  -8.272
  475   2HG2  VAL  65          2HG2      VAL  65  -7.585  -3.360  -6.532
  476   3HG2  VAL  65          3HG2      VAL  65  -6.109  -2.742  -7.286
  477    H    ASP  66           H        ASP  66  -7.759  -4.277  -9.900
  478    HA   ASP  66           HA       ASP  66  -7.980  -4.398 -12.284
  479   1HB   ASP  66          1HB       ASP  66  -7.611  -6.714 -13.401
  480   2HB   ASP  66          2HB       ASP  66  -7.222  -7.328 -11.811
  481    H    GLU  67           H        GLU  67 -10.144  -4.428 -10.529
  482    HA   GLU  67           HA       GLU  67 -12.225  -6.388 -11.485
  483   1HB   GLU  67          1HB       GLU  67 -12.440  -6.022  -9.196
  484   2HB   GLU  67          2HB       GLU  67 -13.738  -5.061  -9.878
  485   1HG   GLU  67          1HG       GLU  67 -11.367  -4.205  -8.275
  486   2HG   GLU  67          2HG       GLU  67 -11.590  -3.203  -9.699
  487    H    ASP  68           H        ASP  68 -10.993  -4.445 -13.370
  488    HA   ASP  68           HA       ASP  68 -13.392  -2.697 -14.120
  489   1HB   ASP  68          1HB       ASP  68 -11.237  -1.712 -15.641
  490   2HB   ASP  68          2HB       ASP  68 -12.000  -0.960 -14.259
  491    H    GLY  69           H        GLY  69 -11.006  -5.063 -15.167
  492   1HA   GLY  69          1HA       GLY  69 -11.815  -6.837 -16.900
  493   2HA   GLY  69          2HA       GLY  69 -12.549  -5.490 -17.785
  494    H    SER  70           H        SER  70  -9.403  -5.485 -16.168
  495    HA   SER  70           HA       SER  70  -7.814  -5.542 -18.747
  496   1HB   SER  70          1HB       SER  70  -6.885  -3.271 -18.481
  497   2HB   SER  70          2HB       SER  70  -8.634  -3.224 -18.722
  498    HG   SER  70           HG       SER  70  -7.424  -2.033 -16.892
  499    H    GLY  71           H        GLY  71  -7.071  -7.417 -17.511
  500   1HA   GLY  71          1HA       GLY  71  -5.874  -7.652 -14.946
  501   2HA   GLY  71          2HA       GLY  71  -5.253  -8.514 -16.357
  502    H    THR  72           H        THR  72  -4.633  -6.017 -17.799
  503    HA   THR  72           HA       THR  72  -1.848  -5.599 -16.841
  504    HB   THR  72           HB       THR  72  -1.921  -3.681 -18.676
  505    HG1  THR  72           HG1      THR  72  -4.100  -3.711 -19.006
  506   1HG2  THR  72          1HG2      THR  72  -1.370  -5.259 -20.484
  507   2HG2  THR  72          2HG2      THR  72  -0.591  -5.810 -18.984
  508   3HG2  THR  72          3HG2      THR  72  -2.054  -6.633 -19.586
  509    H    ILE  73           H        ILE  73  -1.028  -3.951 -15.702
  510    HA   ILE  73           HA       ILE  73  -2.958  -2.073 -14.280
  511    HB   ILE  73           HB       ILE  73  -0.030  -2.679 -13.622
  512   1HG1  ILE  73          1HG1      ILE  73  -2.374  -3.538 -11.854
  513   2HG1  ILE  73          2HG1      ILE  73  -1.985  -4.511 -13.257
  514   1HG2  ILE  73          1HG2      ILE  73  -0.379  -1.417 -11.502
  515   2HG2  ILE  73          2HG2      ILE  73  -0.730  -0.364 -12.880
  516   3HG2  ILE  73          3HG2      ILE  73  -2.067  -1.062 -11.935
  517   1HD1  ILE  73          1HD1      ILE  73  -0.025  -3.941 -10.957
  518   2HD1  ILE  73          2HD1      ILE  73  -0.857  -5.468 -11.321
  519   3HD1  ILE  73          3HD1      ILE  73   0.379  -4.847 -12.441
  520    H    ASP  74           H        ASP  74  -3.258  -0.187 -15.213
  521    HA   ASP  74           HA       ASP  74  -1.225   0.997 -17.121
  522   1HB   ASP  74          1HB       ASP  74  -2.910   2.315 -18.065
  523   2HB   ASP  74          2HB       ASP  74  -3.867   2.382 -16.603
  524    H    PHE  75           H        PHE  75  -1.579   3.642 -16.917
  525    HA   PHE  75           HA       PHE  75  -0.117   4.398 -14.427
  526   1HB   PHE  75          1HB       PHE  75   0.401   5.368 -16.720
  527   2HB   PHE  75          2HB       PHE  75  -1.126   6.209 -16.703
  528    HD1  PHE  75           HD1      PHE  75  -1.543   7.898 -14.675
  529    HD2  PHE  75           HD2      PHE  75   2.347   6.408 -15.759
  530    HE1  PHE  75           HE1      PHE  75  -0.484   9.818 -13.558
  531    HE2  PHE  75           HE2      PHE  75   3.386   8.333 -14.629
  532    HZ   PHE  75           HZ       PHE  75   1.978  10.041 -13.535
  533    H    GLU  76           H        GLU  76  -3.355   4.723 -15.766
  534    HA   GLU  76           HA       GLU  76  -4.393   6.746 -13.885
  535   1HB   GLU  76          1HB       GLU  76  -5.662   4.949 -15.957
  536   2HB   GLU  76          2HB       GLU  76  -6.696   5.669 -14.742
  537   1HG   GLU  76          1HG       GLU  76  -6.276   7.912 -15.512
  538   2HG   GLU  76          2HG       GLU  76  -4.804   7.455 -16.343
  539    H    GLU  77           H        GLU  77  -4.230   3.238 -13.923
  540    HA   GLU  77           HA       GLU  77  -5.959   2.908 -11.461
  541   1HB   GLU  77          1HB       GLU  77  -6.517   1.076 -12.612
  542   2HB   GLU  77          2HB       GLU  77  -5.118   1.163 -13.658
  543   1HG   GLU  77          1HG       GLU  77  -3.725  -0.111 -12.065
  544   2HG   GLU  77          2HG       GLU  77  -4.954  -0.008 -10.809
  545    H    PHE  78           H        PHE  78  -2.590   2.910 -12.406
  546    HA   PHE  78           HA       PHE  78  -1.390   1.606 -10.103
  547   1HB   PHE  78          1HB       PHE  78  -0.102   2.055 -12.169
  548   2HB   PHE  78          2HB       PHE  78  -0.234   3.782 -11.959
  549    HD1  PHE  78           HD1      PHE  78   1.564   4.920 -10.807
  550    HD2  PHE  78           HD2      PHE  78   1.064   0.696 -10.158
  551    HE1  PHE  78           HE1      PHE  78   3.723   4.835  -9.628
  552    HE2  PHE  78           HE2      PHE  78   3.222   0.632  -8.977
  553    HZ   PHE  78           HZ       PHE  78   4.552   2.696  -8.706
  554    H    LEU  79           H        LEU  79  -2.213   5.007 -10.735
  555    HA   LEU  79           HA       LEU  79  -1.097   6.142  -8.261
  556   1HB   LEU  79          1HB       LEU  79  -2.587   8.153  -8.797
  557   2HB   LEU  79          2HB       LEU  79  -3.261   7.258 -10.141
  558    HG   LEU  79           HG       LEU  79  -0.813   7.062 -11.063
  559   1HD1  LEU  79          1HD1      LEU  79  -0.319   9.399  -9.112
  560   2HD1  LEU  79          2HD1      LEU  79   0.315   7.758  -8.886
  561   3HD1  LEU  79          3HD1      LEU  79   0.836   8.723 -10.289
  562   1HD2  LEU  79          1HD2      LEU  79  -0.961   9.221 -12.230
  563   2HD2  LEU  79          2HD2      LEU  79  -2.627   8.637 -11.996
  564   3HD2  LEU  79          3HD2      LEU  79  -1.989   9.914 -10.950
  565    H    VAL  80           H        VAL  80  -4.211   4.755  -9.136
  566    HA   VAL  80           HA       VAL  80  -5.739   5.582  -6.764
  567    HB   VAL  80           HB       VAL  80  -6.201   3.480  -8.900
  568   1HG1  VAL  80          1HG1      VAL  80  -8.009   5.812  -8.013
  569   2HG1  VAL  80          2HG1      VAL  80  -6.772   5.974  -9.266
  570   3HG1  VAL  80          3HG1      VAL  80  -8.124   4.844  -9.506
  571   1HG2  VAL  80          1HG2      VAL  80  -8.320   2.740  -7.913
  572   2HG2  VAL  80          2HG2      VAL  80  -7.052   2.443  -6.702
  573   3HG2  VAL  80          3HG2      VAL  80  -8.133   3.833  -6.520
  574    H    MET  81           H        MET  81  -3.825   2.704  -7.602
  575    HA   MET  81           HA       MET  81  -4.339   0.982  -5.317
  576   1HB   MET  81          1HB       MET  81  -1.883   0.151  -5.752
  577   2HB   MET  81          2HB       MET  81  -1.878   1.264  -7.108
  578   1HG   MET  81          1HG       MET  81  -4.184  -0.023  -7.765
  579   2HG   MET  81          2HG       MET  81  -2.590  -0.642  -8.229
  580   1HE   MET  81          1HE       MET  81  -1.314  -2.604  -7.141
  581   2HE   MET  81          2HE       MET  81  -2.311  -3.993  -6.616
  582   3HE   MET  81          3HE       MET  81  -2.603  -3.241  -8.210
  583    H    MET  82           H        MET  82  -1.704   3.353  -5.817
  584    HA   MET  82           HA       MET  82  -0.542   3.063  -3.124
  585   1HB   MET  82          1HB       MET  82  -0.107   5.002  -5.424
  586   2HB   MET  82          2HB       MET  82   0.533   5.424  -3.848
  587   1HG   MET  82          1HG       MET  82   1.189   2.607  -4.663
  588   2HG   MET  82          2HG       MET  82   1.813   3.839  -5.768
  589   1HE   MET  82          1HE       MET  82   1.867   2.884  -1.654
  590   2HE   MET  82          2HE       MET  82   3.608   2.541  -1.874
  591   3HE   MET  82          3HE       MET  82   2.404   1.746  -2.930
  592    H    VAL  83           H        VAL  83  -2.995   5.144  -4.544
  593    HA   VAL  83           HA       VAL  83  -3.034   7.323  -2.595
  594    HB   VAL  83           HB       VAL  83  -4.752   6.485  -4.849
  595   1HG1  VAL  83          1HG1      VAL  83  -4.240   9.310  -3.727
  596   2HG1  VAL  83          2HG1      VAL  83  -3.110   8.477  -4.804
  597   3HG1  VAL  83          3HG1      VAL  83  -4.749   8.864  -5.377
  598   1HG2  VAL  83          1HG2      VAL  83  -6.823   7.629  -4.246
  599   2HG2  VAL  83          2HG2      VAL  83  -6.511   6.446  -2.954
  600   3HG2  VAL  83          3HG2      VAL  83  -6.164   8.159  -2.676
  601    NH1  ARG  84           NH1      ARG  84 -10.204   3.017  -4.080
  602    NH2  ARG  84           NH2      ARG  84 -11.457   1.472  -2.983
  603    H    ARG  84           H        ARG  84  -4.690   4.193  -2.792
  604    HA   ARG  84           HA       ARG  84  -6.645   4.489  -0.629
  605   1HB   ARG  84          1HB       ARG  84  -5.486   2.180  -2.174
  606   2HB   ARG  84          2HB       ARG  84  -6.066   1.787  -0.562
  607   1HG   ARG  84          1HG       ARG  84  -8.284   2.097  -1.075
  608   2HG   ARG  84          2HG       ARG  84  -7.986   3.496  -2.110
  609   1HD   ARG  84          1HD       ARG  84  -7.539   2.188  -4.043
  610   2HD   ARG  84          2HD       ARG  84  -7.075   0.753  -3.126
  611    HE   ARG  84           HE       ARG  84  -9.383   0.077  -3.243
  612   1HH1  ARG  84          1HH1      ARG  84  -9.281   3.291  -4.435
  613   2HH1  ARG  84          2HH1      ARG  84 -11.078   3.547  -4.167
  614   1HH2  ARG  84          1HH2      ARG  84 -11.495   0.559  -2.517
  615   2HH2  ARG  84          2HH2      ARG  84 -12.239   2.120  -3.131
  616    H    GLN  85           H        GLN  85  -3.255   3.427  -0.697
  617    HA   GLN  85           HA       GLN  85  -3.065   2.612   2.166
  618   1HB   GLN  85          1HB       GLN  85  -1.531   1.900   0.152
  619   2HB   GLN  85          2HB       GLN  85  -0.870   2.068   1.767
  620   1HG   GLN  85          1HG       GLN  85  -0.531   4.657   0.561
  621   2HG   GLN  85          2HG       GLN  85  -0.151   3.511  -0.706
  622   1HE2  GLN  85          1HE2      GLN  85   2.470   2.048   1.744
  623   2HE2  GLN  85          2HE2      GLN  85   0.944   1.406   0.952
  624    H    MET  86           H        MET  86  -2.574   5.538   0.270
  625    HA   MET  86           HA       MET  86  -1.234   7.219   2.277
  626   1HB   MET  86          1HB       MET  86  -2.344   7.618  -0.420
  627   2HB   MET  86          2HB       MET  86  -2.795   8.953   0.624
  628   1HG   MET  86          1HG       MET  86  -0.152   8.330  -0.552
  629   2HG   MET  86          2HG       MET  86  -0.024   8.573   1.198
  630   1HE   MET  86          1HE       MET  86  -2.518  10.112  -1.597
  631   2HE   MET  86          2HE       MET  86  -1.734  11.700  -1.839
  632   3HE   MET  86          3HE       MET  86  -0.879  10.204  -2.313
  633    H    LYS  87           H        LYS  87  -4.533   6.198   1.803
  634    HA   LYS  87           HA       LYS  87  -6.224   8.183   2.865
  635   1HB   LYS  87          1HB       LYS  87  -6.346   5.157   3.409
  636   2HB   LYS  87          2HB       LYS  87  -7.562   6.274   4.012
  637   1HG   LYS  87          1HG       LYS  87  -7.527   5.018   1.472
  638   2HG   LYS  87          2HG       LYS  87  -7.106   6.682   1.102
  639   1HD   LYS  87          1HD       LYS  87  -9.611   5.711   2.622
  640   2HD   LYS  87          2HD       LYS  87  -9.167   7.406   2.459
  641   1HE   LYS  87          1HE       LYS  87  -9.838   7.542   0.221
  642   2HE   LYS  87          2HE       LYS  87  -9.294   5.904  -0.167
  643   1HZ   LYS  87          1HZ       LYS  87 -11.572   5.702  -0.206
  644   2HZ   LYS  87          2HZ       LYS  87 -11.844   6.744   1.047
  645   3HZ   LYS  87          3HZ       LYS  87 -11.283   5.220   1.348
  646    H    GLU  88           H        GLU  88  -6.735   9.029   4.791
  647    HA   GLU  88           HA       GLU  88  -4.757   9.316   6.896
  648   1HB   GLU  88          1HB       GLU  88  -7.613   9.758   7.694
  649   2HB   GLU  88          2HB       GLU  88  -7.102  10.622   6.257
  650   1HG   GLU  88          1HG       GLU  88  -6.263  11.000   9.137
  651   2HG   GLU  88          2HG       GLU  88  -4.981  11.219   7.959
  652    H    ASP  89           H        ASP  89  -4.016   7.417   7.664
  653    HA   ASP  89           HA       ASP  89  -3.888   5.436   9.030
  654   1HB   ASP  89          1HB       ASP  89  -6.135   5.982  10.827
  655   2HB   ASP  89          2HB       ASP  89  -4.420   5.902  11.157
  656    H    ALA  90           H        ALA  90  -4.664   4.364   7.052
  657    HA   ALA  90           HA       ALA  90  -7.320   2.895   7.542
  658   1HB   ALA  90          1HB       ALA  90  -7.422   2.436   5.078
  659   2HB   ALA  90          2HB       ALA  90  -7.409   4.183   5.392
  660   3HB   ALA  90          3HB       ALA  90  -5.932   3.375   4.812
   
  Start of MODEL          26
 Raw file had  660 H/Q atoms
  Start of MODEL   26
    1   1H    ALA   1          1H        ALA   1 -14.361   8.063 -23.532
    2   2H    ALA   1          2H        ALA   1 -15.114   9.507 -23.112
    3   3H    ALA   1          3H        ALA   1 -14.188   8.681 -21.978
    4    HA   ALA   1           HA       ALA   1 -16.766   8.564 -21.962
    5   1HB   ALA   1          1HB       ALA   1 -17.306   7.818 -24.133
    6   2HB   ALA   1          2HB       ALA   1 -17.325   6.284 -23.241
    7   3HB   ALA   1          3HB       ALA   1 -15.918   6.709 -24.249
    8    H    SER   2           H        SER   2 -16.806   7.858 -19.955
    9    HA   SER   2           HA       SER   2 -16.117   5.118 -19.106
   10   1HB   SER   2          1HB       SER   2 -14.231   5.726 -17.500
   11   2HB   SER   2          2HB       SER   2 -13.808   5.702 -19.214
   12    HG   SER   2           HG       SER   2 -14.545   8.015 -17.737
   13    H    MET   3           H        MET   3 -16.506   4.806 -16.813
   14    HA   MET   3           HA       MET   3 -18.336   6.930 -15.567
   15   1HB   MET   3          1HB       MET   3 -18.741   3.919 -15.864
   16   2HB   MET   3          2HB       MET   3 -19.545   4.794 -14.574
   17   1HG   MET   3          1HG       MET   3 -20.309   6.417 -16.639
   18   2HG   MET   3          2HG       MET   3 -20.002   4.947 -17.573
   19   1HE   MET   3          1HE       MET   3 -21.278   3.246 -17.943
   20   2HE   MET   3          2HE       MET   3 -22.995   3.089 -17.466
   21   3HE   MET   3          3HE       MET   3 -21.728   2.259 -16.515
   22    H    THR   4           H        THR   4 -16.346   4.035 -14.915
   23    HA   THR   4           HA       THR   4 -16.086   4.062 -12.099
   24    HB   THR   4           HB       THR   4 -13.950   2.936 -12.277
   25    HG1  THR   4           HG1      THR   4 -13.785   2.884 -14.959
   26   1HG2  THR   4          1HG2      THR   4 -14.654   0.944 -13.230
   27   2HG2  THR   4          2HG2      THR   4 -15.307   1.714 -14.693
   28   3HG2  THR   4          3HG2      THR   4 -16.239   1.746 -13.174
   29    H    ASP   5           H        ASP   5 -15.589   5.612 -10.747
   30    HA   ASP   5           HA       ASP   5 -13.917   8.011 -11.498
   31   1HB   ASP   5          1HB       ASP   5 -14.524   8.948  -9.300
   32   2HB   ASP   5          2HB       ASP   5 -15.936   8.471 -10.214
   33    H    GLN   6           H        GLN   6 -12.453   5.706 -11.667
   34    HA   GLN   6           HA       GLN   6 -10.677   5.422  -9.232
   35   1HB   GLN   6          1HB       GLN   6  -9.666   4.215 -11.747
   36   2HB   GLN   6          2HB       GLN   6  -9.886   3.518 -10.153
   37   1HG   GLN   6          1HG       GLN   6 -11.749   3.508 -12.517
   38   2HG   GLN   6          2HG       GLN   6 -12.544   3.724 -10.973
   39   1HE2  GLN   6          1HE2      GLN   6 -10.316   0.214 -11.112
   40   2HE2  GLN   6          2HE2      GLN   6  -9.589   1.801 -11.678
   41    H    GLN   7           H        GLN   7 -10.401   6.491 -12.634
   42    HA   GLN   7           HA       GLN   7  -7.637   7.610 -12.304
   43   1HB   GLN   7          1HB       GLN   7  -8.461   6.598 -14.497
   44   2HB   GLN   7          2HB       GLN   7  -7.699   8.178 -14.617
   45   1HG   GLN   7          1HG       GLN   7 -10.296   9.028 -14.433
   46   2HG   GLN   7          2HG       GLN   7  -9.471   8.718 -15.954
   47   1HE2  GLN   7          1HE2      GLN   7 -12.823   6.756 -15.531
   48   2HE2  GLN   7          2HE2      GLN   7 -12.349   8.477 -15.106
   49    H    ALA   8           H        ALA   8 -10.957   8.783 -12.291
   50    HA   ALA   8           HA       ALA   8 -10.476  11.658 -12.546
   51   1HB   ALA   8          1HB       ALA   8 -12.783  11.926 -11.647
   52   2HB   ALA   8          2HB       ALA   8 -12.717  10.660 -12.888
   53   3HB   ALA   8          3HB       ALA   8 -12.830  10.213 -11.167
   54    H    GLU   9           H        GLU   9 -10.624   9.463  -9.760
   55    HA   GLU   9           HA       GLU   9 -10.533  11.513  -7.639
   56   1HB   GLU   9          1HB       GLU   9 -10.241   8.485  -7.666
   57   2HB   GLU   9          2HB       GLU   9  -9.608   9.355  -6.276
   58   1HG   GLU   9          1HG       GLU   9 -12.208   8.484  -6.446
   59   2HG   GLU   9          2HG       GLU   9 -12.437  10.111  -7.075
   60    H    ALA  10           H        ALA  10  -8.080   9.492  -9.228
   61    HA   ALA  10           HA       ALA  10  -5.823  10.366  -7.497
   62   1HB   ALA  10          1HB       ALA  10  -4.408   9.017  -9.038
   63   2HB   ALA  10          2HB       ALA  10  -5.842   8.109  -8.522
   64   3HB   ALA  10          3HB       ALA  10  -5.773   8.806 -10.160
   65    NH1  ARG  11           NH1      ARG  11  -6.757  12.285 -17.144
   66    NH2  ARG  11           NH2      ARG  11  -8.786  13.134 -17.710
   67    H    ARG  11           H        ARG  11  -7.230  11.380 -10.541
   68    HA   ARG  11           HA       ARG  11  -4.899  12.927 -11.610
   69   1HB   ARG  11          1HB       ARG  11  -6.326  12.201 -13.339
   70   2HB   ARG  11          2HB       ARG  11  -7.791  12.530 -12.427
   71   1HG   ARG  11          1HG       ARG  11  -8.007  14.649 -13.212
   72   2HG   ARG  11          2HG       ARG  11  -6.311  15.050 -12.932
   73   1HD   ARG  11          1HD       ARG  11  -6.424  15.192 -15.281
   74   2HD   ARG  11          2HD       ARG  11  -5.807  13.551 -15.079
   75    HE   ARG  11           HE       ARG  11  -8.817  13.789 -15.277
   76   1HH1  ARG  11          1HH1      ARG  11  -6.010  12.218 -16.443
   77   2HH1  ARG  11          2HH1      ARG  11  -6.780  11.829 -18.063
   78   1HH2  ARG  11          1HH2      ARG  11  -9.579  13.732 -17.451
   79   2HH2  ARG  11          2HH2      ARG  11  -8.677  12.602 -18.580
   80    H    ALA  12           H        ALA  12  -7.834  13.569  -9.747
   81    HA   ALA  12           HA       ALA  12  -7.715  16.535  -9.867
   82   1HB   ALA  12          1HB       ALA  12  -9.533  16.475  -8.171
   83   2HB   ALA  12          2HB       ALA  12  -9.869  15.366  -9.515
   84   3HB   ALA  12          3HB       ALA  12  -9.312  14.722  -7.950
   85    H    PHE  13           H        PHE  13  -6.499  14.021  -7.720
   86    HA   PHE  13           HA       PHE  13  -5.726  15.790  -5.478
   87   1HB   PHE  13          1HB       PHE  13  -6.243  13.517  -4.950
   88   2HB   PHE  13          2HB       PHE  13  -5.162  12.861  -6.152
   89    HD1  PHE  13           HD1      PHE  13  -2.722  12.633  -5.635
   90    HD2  PHE  13           HD2      PHE  13  -5.369  14.483  -2.788
   91    HE1  PHE  13           HE1      PHE  13  -0.994  12.450  -3.891
   92    HE2  PHE  13           HE2      PHE  13  -3.628  14.294  -1.061
   93    HZ   PHE  13           HZ       PHE  13  -1.442  13.277  -1.605
   94    H    LEU  14           H        LEU  14  -4.009  14.175  -8.152
   95    HA   LEU  14           HA       LEU  14  -1.344  15.460  -7.459
   96   1HB   LEU  14          1HB       LEU  14  -1.837  13.695  -9.905
   97   2HB   LEU  14          2HB       LEU  14  -0.329  14.015  -9.076
   98    HG   LEU  14           HG       LEU  14  -2.492  12.574  -7.494
   99   1HD1  LEU  14          1HD1      LEU  14  -1.860  10.365  -8.470
  100   2HD1  LEU  14          2HD1      LEU  14  -2.575  11.415  -9.707
  101   3HD1  LEU  14          3HD1      LEU  14  -0.812  11.164  -9.670
  102   1HD2  LEU  14          1HD2      LEU  14   0.581  12.230  -7.626
  103   2HD2  LEU  14          2HD2      LEU  14  -0.325  13.086  -6.353
  104   3HD2  LEU  14          3HD2      LEU  14  -0.519  11.337  -6.545
  105    H    SER  15           H        SER  15  -0.140  16.371  -9.378
  106    HA   SER  15           HA       SER  15  -1.952  18.140 -11.115
  107   1HB   SER  15          1HB       SER  15   0.867  18.995 -10.369
  108   2HB   SER  15          2HB       SER  15  -0.526  19.979 -10.826
  109    HG   SER  15           HG       SER  15  -1.411  18.835  -8.764
  110    H    GLU  16           H        GLU  16   0.092  19.170 -12.706
  111    HA   GLU  16           HA       GLU  16   0.520  16.928 -14.655
  112   1HB   GLU  16          1HB       GLU  16   1.100  19.928 -14.886
  113   2HB   GLU  16          2HB       GLU  16  -0.335  19.098 -15.454
  114   1HG   GLU  16          1HG       GLU  16   0.870  17.996 -17.254
  115   2HG   GLU  16          2HG       GLU  16   2.436  18.315 -16.527
  116    H    GLU  17           H        GLU  17   2.380  19.000 -12.511
  117    HA   GLU  17           HA       GLU  17   5.071  18.198 -13.576
  118   1HB   GLU  17          1HB       GLU  17   4.177  20.421 -12.161
  119   2HB   GLU  17          2HB       GLU  17   5.030  19.538 -10.910
  120   1HG   GLU  17          1HG       GLU  17   6.975  19.402 -12.821
  121   2HG   GLU  17          2HG       GLU  17   6.123  20.795 -13.465
  122    H    MET  18           H        MET  18   2.954  17.442 -10.851
  123    HA   MET  18           HA       MET  18   4.786  15.718  -9.316
  124   1HB   MET  18          1HB       MET  18   1.840  16.315  -9.221
  125   2HB   MET  18          2HB       MET  18   2.296  14.726  -8.636
  126   1HG   MET  18          1HG       MET  18   3.840  15.709  -6.945
  127   2HG   MET  18          2HG       MET  18   3.556  17.336  -7.586
  128   1HE   MET  18          1HE       MET  18   2.457  18.699  -5.757
  129   2HE   MET  18          2HE       MET  18   1.395  17.994  -4.503
  130   3HE   MET  18          3HE       MET  18   3.076  17.409  -4.678
  131    H    ILE  19           H        ILE  19   2.552  15.220 -11.994
  132    HA   ILE  19           HA       ILE  19   2.406  12.304 -11.987
  133    HB   ILE  19           HB       ILE  19   1.776  14.427 -14.033
  134   1HG1  ILE  19          1HG1      ILE  19  -0.456  13.740 -13.778
  135   2HG1  ILE  19          2HG1      ILE  19  -0.043  12.069 -13.454
  136   1HG2  ILE  19          1HG2      ILE  19   1.244  12.751 -15.820
  137   2HG2  ILE  19          2HG2      ILE  19   2.968  12.723 -15.456
  138   3HG2  ILE  19          3HG2      ILE  19   1.916  11.438 -14.822
  139   1HD1  ILE  19          1HD1      ILE  19   0.202  14.340 -11.393
  140   2HD1  ILE  19          2HD1      ILE  19  -0.986  13.021 -11.424
  141   3HD1  ILE  19          3HD1      ILE  19   0.729  12.656 -11.120
  142    H    ALA  20           H        ALA  20   4.683  14.639 -13.348
  143    HA   ALA  20           HA       ALA  20   6.232  12.979 -15.122
  144   1HB   ALA  20          1HB       ALA  20   8.040  14.676 -14.874
  145   2HB   ALA  20          2HB       ALA  20   6.453  15.445 -15.067
  146   3HB   ALA  20          3HB       ALA  20   7.223  15.385 -13.461
  147    H    GLU  21           H        GLU  21   6.284  13.270 -11.621
  148    HA   GLU  21           HA       GLU  21   8.796  11.925 -11.007
  149   1HB   GLU  21          1HB       GLU  21   7.128  13.256  -9.450
  150   2HB   GLU  21          2HB       GLU  21   6.366  11.700  -9.180
  151   1HG   GLU  21          1HG       GLU  21   8.281  10.805  -8.044
  152   2HG   GLU  21          2HG       GLU  21   9.392  11.946  -8.781
  153    H    PHE  22           H        PHE  22   5.457  10.709 -11.369
  154    HA   PHE  22           HA       PHE  22   6.365   7.821 -11.290
  155   1HB   PHE  22          1HB       PHE  22   3.480   8.396 -11.914
  156   2HB   PHE  22          2HB       PHE  22   4.195   7.216 -10.850
  157    HD1  PHE  22           HD1      PHE  22   2.460  10.363 -10.919
  158    HD2  PHE  22           HD2      PHE  22   5.342   8.156  -8.605
  159    HE1  PHE  22           HE1      PHE  22   1.801  11.601  -8.899
  160    HE2  PHE  22           HE2      PHE  22   4.678   9.416  -6.598
  161    HZ   PHE  22           HZ       PHE  22   2.872  11.098  -6.728
  162    H    LYS  23           H        LYS  23   6.866   9.905 -13.542
  163    HA   LYS  23           HA       LYS  23   5.700   8.511 -15.978
  164   1HB   LYS  23          1HB       LYS  23   7.115  11.097 -15.482
  165   2HB   LYS  23          2HB       LYS  23   7.705  10.262 -16.902
  166   1HG   LYS  23          1HG       LYS  23   5.384  10.193 -17.864
  167   2HG   LYS  23          2HG       LYS  23   4.753  10.935 -16.404
  168   1HD   LYS  23          1HD       LYS  23   6.742  12.781 -17.139
  169   2HD   LYS  23          2HD       LYS  23   5.007  12.955 -17.430
  170   1HE   LYS  23          1HE       LYS  23   5.518  11.485 -19.640
  171   2HE   LYS  23          2HE       LYS  23   5.798  13.232 -19.632
  172   1HZ   LYS  23          1HZ       LYS  23   8.082  12.924 -19.456
  173   2HZ   LYS  23          2HZ       LYS  23   7.661  11.653 -20.423
  174   3HZ   LYS  23          3HZ       LYS  23   7.977  11.402 -18.821
  175    H    ALA  24           H        ALA  24   8.740   8.921 -14.205
  176    HA   ALA  24           HA       ALA  24  10.493   7.515 -16.116
  177   1HB   ALA  24          1HB       ALA  24  12.196   7.611 -14.306
  178   2HB   ALA  24          2HB       ALA  24  11.396   9.179 -14.521
  179   3HB   ALA  24          3HB       ALA  24  10.966   8.144 -13.135
  180    H    ALA  25           H        ALA  25   9.508   6.585 -12.798
  181    HA   ALA  25           HA       ALA  25  10.498   3.915 -12.708
  182   1HB   ALA  25          1HB       ALA  25   8.860   3.489 -10.884
  183   2HB   ALA  25          2HB       ALA  25   9.622   5.081 -10.707
  184   3HB   ALA  25          3HB       ALA  25   7.951   4.958 -11.315
  185    H    PHE  26           H        PHE  26   7.505   5.143 -14.103
  186    HA   PHE  26           HA       PHE  26   6.023   2.631 -14.436
  187   1HB   PHE  26          1HB       PHE  26   4.803   4.719 -14.660
  188   2HB   PHE  26          2HB       PHE  26   5.798   5.276 -15.978
  189    HD1  PHE  26           HD1      PHE  26   5.847   3.255 -18.028
  190    HD2  PHE  26           HD2      PHE  26   2.634   4.105 -15.296
  191    HE1  PHE  26           HE1      PHE  26   4.243   2.193 -19.566
  192    HE2  PHE  26           HE2      PHE  26   1.038   3.089 -16.872
  193    HZ   PHE  26           HZ       PHE  26   1.842   2.101 -18.989
  194    H    ASP  27           H        ASP  27   8.180   4.461 -16.605
  195    HA   ASP  27           HA       ASP  27   8.195   2.628 -18.893
  196   1HB   ASP  27          1HB       ASP  27   9.129   5.085 -18.753
  197   2HB   ASP  27          2HB       ASP  27  10.603   4.357 -18.156
  198    H    MET  28           H        MET  28  10.021   2.795 -15.879
  199    HA   MET  28           HA       MET  28  12.177   0.957 -16.326
  200   1HB   MET  28          1HB       MET  28  11.429   2.314 -14.102
  201   2HB   MET  28          2HB       MET  28  10.760   0.755 -13.655
  202   1HG   MET  28          1HG       MET  28  13.718   1.354 -14.272
  203   2HG   MET  28          2HG       MET  28  13.090  -0.290 -14.074
  204   1HE   MET  28          1HE       MET  28  11.167   2.499 -12.137
  205   2HE   MET  28          2HE       MET  28  12.169   2.777 -10.681
  206   3HE   MET  28          3HE       MET  28  12.752   3.324 -12.281
  207    H    PHE  29           H        PHE  29   8.809   0.305 -15.391
  208    HA   PHE  29           HA       PHE  29   9.063  -2.659 -15.253
  209   1HB   PHE  29          1HB       PHE  29   6.530  -2.653 -15.219
  210   2HB   PHE  29          2HB       PHE  29   6.527  -0.932 -15.494
  211    HD1  PHE  29           HD1      PHE  29   5.071  -1.436 -13.223
  212    HD2  PHE  29           HD2      PHE  29   9.370  -1.506 -13.437
  213    HE1  PHE  29           HE1      PHE  29   5.210  -1.097 -10.789
  214    HE2  PHE  29           HE2      PHE  29   9.485  -1.159 -11.003
  215    HZ   PHE  29           HZ       PHE  29   7.412  -0.962  -9.676
  216    H    ASP  30           H        ASP  30   8.125  -0.238 -17.651
  217    HA   ASP  30           HA       ASP  30   7.054  -1.986 -19.740
  218   1HB   ASP  30          1HB       ASP  30   6.986   0.662 -19.551
  219   2HB   ASP  30          2HB       ASP  30   8.501   0.609 -20.423
  220    H    ALA  31           H        ALA  31   8.109  -2.491 -21.781
  221    HA   ALA  31           HA       ALA  31  11.113  -3.087 -21.535
  222   1HB   ALA  31          1HB       ALA  31  10.700  -5.263 -22.688
  223   2HB   ALA  31          2HB       ALA  31   9.812  -5.151 -21.156
  224   3HB   ALA  31          3HB       ALA  31   8.947  -4.955 -22.703
  225    H    ASP  32           H        ASP  32   8.349  -2.607 -23.725
  226    HA   ASP  32           HA       ASP  32  10.115  -2.000 -26.111
  227   1HB   ASP  32          1HB       ASP  32   8.406  -2.970 -27.200
  228   2HB   ASP  32          2HB       ASP  32   7.568  -1.447 -27.016
  229    H    GLY  33           H        GLY  33   7.168  -0.325 -25.021
  230   1HA   GLY  33          1HA       GLY  33   7.397   2.062 -23.973
  231   2HA   GLY  33          2HA       GLY  33   8.671   2.333 -25.140
  232    H    GLY  34           H        GLY  34   5.297   1.115 -25.161
  233   1HA   GLY  34          1HA       GLY  34   3.655   1.469 -27.048
  234   2HA   GLY  34          2HA       GLY  34   4.631   2.840 -27.590
  235    H    GLY  35           H        GLY  35   2.740   1.753 -24.774
  236   1HA   GLY  35          1HA       GLY  35   2.493   4.249 -23.333
  237   2HA   GLY  35          2HA       GLY  35   1.167   4.253 -24.503
  238    H    ASP  36           H        ASP  36   2.623   1.527 -22.745
  239    HA   ASP  36           HA       ASP  36   0.687   1.249 -20.597
  240   1HB   ASP  36          1HB       ASP  36  -1.171   0.675 -21.796
  241   2HB   ASP  36          2HB       ASP  36  -0.478  -0.920 -21.620
  242    H    ILE  37           H        ILE  37   0.588  -1.361 -20.111
  243    HA   ILE  37           HA       ILE  37   3.346  -2.595 -20.556
  244    HB   ILE  37           HB       ILE  37   2.261  -3.178 -17.871
  245   1HG1  ILE  37          1HG1      ILE  37   2.618  -0.306 -18.557
  246   2HG1  ILE  37          2HG1      ILE  37   1.833  -1.052 -17.178
  247   1HG2  ILE  37          1HG2      ILE  37   4.640  -3.141 -17.229
  248   2HG2  ILE  37          2HG2      ILE  37   4.440  -4.053 -18.732
  249   3HG2  ILE  37          3HG2      ILE  37   5.095  -2.398 -18.782
  250   1HD1  ILE  37          1HD1      ILE  37   4.860  -0.538 -17.390
  251   2HD1  ILE  37          2HD1      ILE  37   3.684   0.311 -16.363
  252   3HD1  ILE  37          3HD1      ILE  37   4.068  -1.395 -16.041
  253    H    SER  38           H        SER  38   3.173  -4.923 -19.385
  254    HA   SER  38           HA       SER  38   0.569  -6.305 -20.042
  255   1HB   SER  38          1HB       SER  38   2.095  -6.051 -22.206
  256   2HB   SER  38          2HB       SER  38   1.193  -7.534 -21.889
  257    HG   SER  38           HG       SER  38   3.294  -8.008 -22.399
  258    H    THR  39           H        THR  39   1.239  -8.848 -19.947
  259    HA   THR  39           HA       THR  39   2.198  -9.288 -17.129
  260    HB   THR  39           HB       THR  39   1.598 -11.803 -17.837
  261    HG1  THR  39           HG1      THR  39   0.916 -11.800 -19.770
  262   1HG2  THR  39          1HG2      THR  39  -0.701 -11.513 -17.025
  263   2HG2  THR  39          2HG2      THR  39   0.378 -10.484 -16.056
  264   3HG2  THR  39          3HG2      THR  39  -0.651  -9.760 -17.321
  265    H    LYS  40           H        LYS  40   3.390  -9.622 -20.372
  266    HA   LYS  40           HA       LYS  40   5.542 -11.617 -19.684
  267   1HB   LYS  40          1HB       LYS  40   4.404 -10.659 -22.197
  268   2HB   LYS  40          2HB       LYS  40   6.123 -10.383 -22.262
  269   1HG   LYS  40          1HG       LYS  40   5.640 -12.539 -23.209
  270   2HG   LYS  40          2HG       LYS  40   6.453 -12.851 -21.696
  271   1HD   LYS  40          1HD       LYS  40   4.787 -14.466 -21.475
  272   2HD   LYS  40          2HD       LYS  40   3.983 -13.113 -20.735
  273   1HE   LYS  40          1HE       LYS  40   3.533 -13.662 -23.699
  274   2HE   LYS  40          2HE       LYS  40   2.602 -14.508 -22.469
  275   1HZ   LYS  40          1HZ       LYS  40   2.763 -11.533 -22.595
  276   2HZ   LYS  40          2HZ       LYS  40   1.676 -12.442 -21.745
  277   3HZ   LYS  40          3HZ       LYS  40   1.609 -12.403 -23.395
  278    H    GLU  41           H        GLU  41   5.093  -8.150 -20.144
  279    HA   GLU  41           HA       GLU  41   8.005  -7.449 -20.012
  280   1HB   GLU  41          1HB       GLU  41   7.476  -5.422 -20.789
  281   2HB   GLU  41          2HB       GLU  41   6.206  -5.166 -19.612
  282   1HG   GLU  41          1HG       GLU  41   5.901  -6.668 -22.286
  283   2HG   GLU  41          2HG       GLU  41   4.642  -6.582 -21.072
  284    H    LEU  42           H        LEU  42   5.160  -7.292 -17.899
  285    HA   LEU  42           HA       LEU  42   6.307  -5.713 -15.705
  286   1HB   LEU  42          1HB       LEU  42   3.987  -7.730 -15.708
  287   2HB   LEU  42          2HB       LEU  42   3.863  -6.002 -15.955
  288    HG   LEU  42           HG       LEU  42   4.926  -7.175 -13.319
  289   1HD1  LEU  42          1HD1      LEU  42   1.996  -6.391 -13.871
  290   2HD1  LEU  42          2HD1      LEU  42   2.580  -8.062 -13.855
  291   3HD1  LEU  42          3HD1      LEU  42   2.665  -7.081 -12.370
  292   1HD2  LEU  42          1HD2      LEU  42   4.359  -4.979 -12.341
  293   2HD2  LEU  42          2HD2      LEU  42   5.366  -4.697 -13.783
  294   3HD2  LEU  42          3HD2      LEU  42   3.614  -4.433 -13.866
  295    H    GLY  43           H        GLY  43   6.205  -9.165 -16.458
  296   1HA   GLY  43          1HA       GLY  43   7.359 -11.086 -15.530
  297   2HA   GLY  43          2HA       GLY  43   6.984 -10.363 -13.961
  298    H    THR  44           H        THR  44   8.904  -8.673 -16.353
  299    HA   THR  44           HA       THR  44  11.561  -9.619 -15.610
  300    HB   THR  44           HB       THR  44  10.659  -7.115 -17.091
  301    HG1  THR  44           HG1      THR  44  12.340  -8.733 -18.353
  302   1HG2  THR  44          1HG2      THR  44  13.037  -6.685 -17.736
  303   2HG2  THR  44          2HG2      THR  44  12.787  -6.425 -15.997
  304   3HG2  THR  44          3HG2      THR  44  13.590  -7.910 -16.567
  305    H    VAL  45           H        VAL  45   9.855  -6.593 -14.763
  306    HA   VAL  45           HA       VAL  45  11.899  -5.473 -13.009
  307    HB   VAL  45           HB       VAL  45   9.124  -4.770 -13.716
  308   1HG1  VAL  45          1HG1      VAL  45   8.613  -3.353 -11.727
  309   2HG1  VAL  45          2HG1      VAL  45   8.672  -5.059 -11.266
  310   3HG1  VAL  45          3HG1      VAL  45  10.039  -3.994 -10.869
  311   1HG2  VAL  45          1HG2      VAL  45  11.518  -3.015 -12.854
  312   2HG2  VAL  45          2HG2      VAL  45  11.087  -3.437 -14.527
  313   3HG2  VAL  45          3HG2      VAL  45   9.993  -2.429 -13.569
  314    H    MET  46           H        MET  46   9.200  -7.693 -12.496
  315    HA   MET  46           HA       MET  46   9.130  -7.708  -9.569
  316   1HB   MET  46          1HB       MET  46   8.153 -10.181 -10.040
  317   2HB   MET  46          2HB       MET  46   8.088  -9.607 -11.696
  318   1HG   MET  46          1HG       MET  46   6.889  -7.473 -10.241
  319   2HG   MET  46          2HG       MET  46   6.059  -8.697 -11.215
  320   1HE   MET  46          1HE       MET  46   4.866  -7.122  -8.560
  321   2HE   MET  46          2HE       MET  46   5.046  -8.015  -7.021
  322   3HE   MET  46          3HE       MET  46   6.449  -7.156  -7.721
  323    NH1  ARG  47           NH1      ARG  47  16.770  -9.182 -15.508
  324    NH2  ARG  47           NH2      ARG  47  18.542 -10.409 -14.787
  325    H    ARG  47           H        ARG  47  10.989  -9.487 -11.981
  326    HA   ARG  47           HA       ARG  47  12.131 -11.612 -10.361
  327   1HB   ARG  47          1HB       ARG  47  12.437 -10.689 -13.057
  328   2HB   ARG  47          2HB       ARG  47  12.942 -12.213 -12.341
  329   1HG   ARG  47          1HG       ARG  47  14.719  -9.717 -12.126
  330   2HG   ARG  47          2HG       ARG  47  15.166 -11.395 -11.815
  331   1HD   ARG  47          1HD       ARG  47  14.489 -11.791 -14.395
  332   2HD   ARG  47          2HD       ARG  47  14.651 -10.046 -14.515
  333    HE   ARG  47           HE       ARG  47  16.985 -11.753 -13.552
  334   1HH1  ARG  47          1HH1      ARG  47  15.755  -9.036 -15.492
  335   2HH1  ARG  47          2HH1      ARG  47  17.463  -8.628 -16.025
  336   1HH2  ARG  47          1HH2      ARG  47  18.880 -11.196 -14.222
  337   2HH2  ARG  47          2HH2      ARG  47  19.110  -9.770 -15.353
  338    H    MET  48           H        MET  48  13.112  -8.262 -10.921
  339    HA   MET  48           HA       MET  48  15.794  -8.205  -9.902
  340   1HB   MET  48          1HB       MET  48  14.838  -5.761  -8.950
  341   2HB   MET  48          2HB       MET  48  13.664  -6.127 -10.200
  342   1HG   MET  48          1HG       MET  48  15.174  -5.809 -11.939
  343   2HG   MET  48          2HG       MET  48  16.533  -6.518 -11.051
  344   1HE   MET  48          1HE       MET  48  13.955  -3.570  -9.999
  345   2HE   MET  48          2HE       MET  48  14.944  -2.150 -10.449
  346   3HE   MET  48          3HE       MET  48  14.356  -3.264 -11.718
  347    H    LEU  49           H        LEU  49  12.709  -8.259  -8.194
  348    HA   LEU  49           HA       LEU  49  13.397  -7.630  -5.495
  349   1HB   LEU  49          1HB       LEU  49  11.598  -9.316  -4.791
  350   2HB   LEU  49          2HB       LEU  49  11.459  -9.813  -6.463
  351    HG   LEU  49           HG       LEU  49  10.410  -7.805  -7.155
  352   1HD1  LEU  49          1HD1      LEU  49   8.547  -7.394  -5.545
  353   2HD1  LEU  49          2HD1      LEU  49   8.907  -9.127  -5.657
  354   3HD1  LEU  49          3HD1      LEU  49   9.459  -8.197  -4.242
  355   1HD2  LEU  49          1HD2      LEU  49  11.414  -6.380  -4.599
  356   2HD2  LEU  49          2HD2      LEU  49  12.029  -6.126  -6.251
  357   3HD2  LEU  49          3HD2      LEU  49  10.371  -5.656  -5.849
  358    H    GLY  50           H        GLY  50  13.013 -11.030  -6.491
  359   1HA   GLY  50          1HA       GLY  50  15.696 -11.931  -5.482
  360   2HA   GLY  50          2HA       GLY  50  14.394 -12.287  -4.338
  361    H    GLN  51           H        GLN  51  12.298 -13.042  -5.713
  362    HA   GLN  51           HA       GLN  51  13.087 -15.757  -6.768
  363   1HB   GLN  51          1HB       GLN  51  10.698 -16.327  -6.590
  364   2HB   GLN  51          2HB       GLN  51  11.326 -15.669  -5.091
  365   1HG   GLN  51          1HG       GLN  51   9.976 -13.696  -6.957
  366   2HG   GLN  51          2HG       GLN  51  10.039 -13.703  -5.209
  367   1HE2  GLN  51          1HE2      GLN  51   6.637 -14.835  -5.327
  368   2HE2  GLN  51          2HE2      GLN  51   7.882 -13.632  -4.717
  369    H    ASN  52           H        ASN  52  11.391 -16.480  -8.585
  370    HA   ASN  52           HA       ASN  52  11.062 -14.490 -10.791
  371   1HB   ASN  52          1HB       ASN  52  13.569 -15.301 -10.683
  372   2HB   ASN  52          2HB       ASN  52  12.995 -16.796 -11.389
  373   1HD2  ASN  52          1HD2      ASN  52  14.086 -14.222 -14.045
  374   2HD2  ASN  52          2HD2      ASN  52  14.824 -14.755 -12.451
  375    HA   PRO  53           HA       PRO  53   8.070 -18.155 -10.931
  376   1HB   PRO  53          1HB       PRO  53   5.747 -16.803 -11.553
  377   2HB   PRO  53          2HB       PRO  53   6.472 -16.840  -9.939
  378   1HG   PRO  53          1HG       PRO  53   6.677 -14.621 -12.027
  379   2HG   PRO  53          2HG       PRO  53   6.346 -14.461 -10.287
  380   1HD   PRO  53          1HD       PRO  53   8.677 -14.637  -9.742
  381   2HD   PRO  53          2HD       PRO  53   8.897 -14.130 -11.444
  382    H    THR  54           H        THR  54   6.313 -18.687 -12.744
  383    HA   THR  54           HA       THR  54   7.757 -18.633 -15.404
  384    HB   THR  54           HB       THR  54   6.722 -20.768 -14.226
  385    HG1  THR  54           HG1      THR  54   7.151 -21.613 -16.043
  386   1HG2  THR  54          1HG2      THR  54   4.528 -21.468 -15.127
  387   2HG2  THR  54          2HG2      THR  54   4.330 -20.009 -14.130
  388   3HG2  THR  54          3HG2      THR  54   4.294 -19.886 -15.907
  389    H    LYS  55           H        LYS  55   5.705 -18.920 -17.169
  390    HA   LYS  55           HA       LYS  55   4.885 -16.086 -17.557
  391   1HB   LYS  55          1HB       LYS  55   5.619 -17.887 -19.371
  392   2HB   LYS  55          2HB       LYS  55   3.948 -18.412 -19.325
  393   1HG   LYS  55          1HG       LYS  55   4.231 -15.466 -19.689
  394   2HG   LYS  55          2HG       LYS  55   5.016 -16.391 -20.957
  395   1HD   LYS  55          1HD       LYS  55   2.773 -16.008 -21.776
  396   2HD   LYS  55          2HD       LYS  55   2.058 -16.282 -20.195
  397   1HE   LYS  55          1HE       LYS  55   3.178 -18.787 -20.686
  398   2HE   LYS  55          2HE       LYS  55   1.489 -18.363 -20.950
  399   1HZ   LYS  55          1HZ       LYS  55   3.671 -18.583 -22.927
  400   2HZ   LYS  55          2HZ       LYS  55   2.394 -17.595 -23.273
  401   3HZ   LYS  55          3HZ       LYS  55   2.141 -19.203 -22.988
  402    H    GLU  56           H        GLU  56   3.149 -19.199 -17.259
  403    HA   GLU  56           HA       GLU  56   0.438 -18.133 -17.269
  404   1HB   GLU  56          1HB       GLU  56   0.967 -20.697 -15.766
  405   2HB   GLU  56          2HB       GLU  56   1.454 -20.650 -17.449
  406   1HG   GLU  56          1HG       GLU  56  -1.339 -19.630 -16.971
  407   2HG   GLU  56          2HG       GLU  56  -0.733 -20.688 -18.233
  408    H    GLU  57           H        GLU  57   2.799 -18.717 -14.713
  409    HA   GLU  57           HA       GLU  57   1.006 -18.408 -12.385
  410   1HB   GLU  57          1HB       GLU  57   3.967 -18.649 -12.760
  411   2HB   GLU  57          2HB       GLU  57   2.864 -19.569 -11.760
  412   1HG   GLU  57          1HG       GLU  57   4.682 -17.989 -10.633
  413   2HG   GLU  57          2HG       GLU  57   3.577 -16.670 -10.996
  414    H    LEU  58           H        LEU  58   3.042 -16.232 -14.290
  415    HA   LEU  58           HA       LEU  58   2.695 -13.798 -12.694
  416   1HB   LEU  58          1HB       LEU  58   3.979 -14.572 -15.197
  417   2HB   LEU  58          2HB       LEU  58   3.060 -13.107 -15.474
  418    HG   LEU  58           HG       LEU  58   4.832 -13.194 -12.997
  419   1HD1  LEU  58          1HD1      LEU  58   4.444 -10.938 -15.074
  420   2HD1  LEU  58          2HD1      LEU  58   3.434 -11.114 -13.631
  421   3HD1  LEU  58          3HD1      LEU  58   5.178 -10.799 -13.456
  422   1HD2  LEU  58          1HD2      LEU  58   6.893 -12.714 -14.265
  423   2HD2  LEU  58          2HD2      LEU  58   6.218 -14.256 -14.848
  424   3HD2  LEU  58          3HD2      LEU  58   6.016 -12.783 -15.814
  425    H    ASP  59           H        ASP  59   0.884 -15.342 -15.300
  426    HA   ASP  59           HA       ASP  59  -1.012 -13.205 -15.934
  427   1HB   ASP  59          1HB       ASP  59  -2.497 -15.082 -16.857
  428   2HB   ASP  59          2HB       ASP  59  -1.307 -16.236 -16.301
  429    H    ALA  60           H        ALA  60  -0.898 -15.698 -13.455
  430    HA   ALA  60           HA       ALA  60  -3.574 -15.396 -12.288
  431   1HB   ALA  60          1HB       ALA  60  -2.597 -16.468 -10.264
  432   2HB   ALA  60          2HB       ALA  60  -2.123 -17.325 -11.743
  433   3HB   ALA  60          3HB       ALA  60  -0.952 -16.269 -10.913
  434    H    ILE  61           H        ILE  61  -0.447 -13.817 -11.656
  435    HA   ILE  61           HA       ILE  61  -1.110 -12.269  -9.307
  436    HB   ILE  61           HB       ILE  61   1.077 -12.230 -11.290
  437   1HG1  ILE  61          1HG1      ILE  61   2.178 -12.865  -9.407
  438   2HG1  ILE  61          2HG1      ILE  61   0.732 -12.616  -8.452
  439   1HG2  ILE  61          1HG2      ILE  61   1.923  -9.915 -10.812
  440   2HG2  ILE  61          2HG2      ILE  61   0.378  -9.848 -11.657
  441   3HG2  ILE  61          3HG2      ILE  61   0.436  -9.539  -9.906
  442   1HD1  ILE  61          1HD1      ILE  61   1.331 -10.264  -7.939
  443   2HD1  ILE  61          2HD1      ILE  61   2.665 -11.359  -7.517
  444   3HD1  ILE  61          3HD1      ILE  61   2.766 -10.375  -8.996
  445    H    ILE  62           H        ILE  62  -1.367 -11.461 -12.772
  446    HA   ILE  62           HA       ILE  62  -2.498  -8.751 -12.413
  447    HB   ILE  62           HB       ILE  62  -2.438 -10.587 -14.859
  448   1HG1  ILE  62          1HG1      ILE  62  -0.539  -8.574 -13.711
  449   2HG1  ILE  62          2HG1      ILE  62  -0.237  -9.916 -14.794
  450   1HG2  ILE  62          1HG2      ILE  62  -3.157  -8.623 -16.249
  451   2HG2  ILE  62          2HG2      ILE  62  -4.417  -9.048 -15.093
  452   3HG2  ILE  62          3HG2      ILE  62  -3.377  -7.639 -14.781
  453   1HD1  ILE  62          1HD1      ILE  62  -1.264  -7.161 -15.702
  454   2HD1  ILE  62          2HD1      ILE  62   0.349  -7.861 -15.956
  455   3HD1  ILE  62          3HD1      ILE  62  -1.061  -8.576 -16.772
  456    H    GLU  63           H        GLU  63  -3.769 -12.026 -12.747
  457    HA   GLU  63           HA       GLU  63  -6.548 -11.692 -13.162
  458   1HB   GLU  63          1HB       GLU  63  -5.698 -13.642 -10.997
  459   2HB   GLU  63          2HB       GLU  63  -5.074 -13.862 -12.620
  460   1HG   GLU  63          1HG       GLU  63  -7.028 -15.258 -12.464
  461   2HG   GLU  63          2HG       GLU  63  -7.978 -14.024 -11.655
  462    H    GLU  64           H        GLU  64  -4.783 -11.430 -10.070
  463    HA   GLU  64           HA       GLU  64  -6.913 -10.913  -8.226
  464   1HB   GLU  64          1HB       GLU  64  -3.987 -10.367  -8.269
  465   2HB   GLU  64          2HB       GLU  64  -4.884  -9.245  -7.265
  466   1HG   GLU  64          1HG       GLU  64  -4.099 -11.127  -5.894
  467   2HG   GLU  64          2HG       GLU  64  -5.853 -11.158  -5.948
  468    H    VAL  65           H        VAL  65  -4.823  -8.312  -9.509
  469    HA   VAL  65           HA       VAL  65  -6.794  -6.158  -9.173
  470    HB   VAL  65           HB       VAL  65  -4.158  -6.033  -9.421
  471   1HG1  VAL  65          1HG1      VAL  65  -5.872  -3.745 -10.585
  472   2HG1  VAL  65          2HG1      VAL  65  -5.785  -4.127  -8.856
  473   3HG1  VAL  65          3HG1      VAL  65  -4.319  -3.609  -9.722
  474   1HG2  VAL  65          1HG2      VAL  65  -3.282  -5.296 -11.582
  475   2HG2  VAL  65          2HG2      VAL  65  -4.144  -6.824 -11.885
  476   3HG2  VAL  65          3HG2      VAL  65  -4.901  -5.286 -12.324
  477    H    ASP  66           H        ASP  66  -6.800  -4.814 -11.603
  478    HA   ASP  66           HA       ASP  66  -7.762  -4.720 -13.820
  479   1HB   ASP  66          1HB       ASP  66  -8.308  -7.680 -14.023
  480   2HB   ASP  66          2HB       ASP  66  -6.626  -7.215 -13.915
  481    H    GLU  67           H        GLU  67  -9.239  -3.806 -12.104
  482    HA   GLU  67           HA       GLU  67 -11.803  -5.247 -11.502
  483   1HB   GLU  67          1HB       GLU  67 -12.214  -2.480 -11.028
  484   2HB   GLU  67          2HB       GLU  67 -10.523  -2.734 -10.640
  485   1HG   GLU  67          1HG       GLU  67 -12.582  -4.686  -9.493
  486   2HG   GLU  67          2HG       GLU  67 -11.013  -4.237  -8.847
  487    H    ASP  68           H        ASP  68 -10.491  -3.073 -13.917
  488    HA   ASP  68           HA       ASP  68 -13.123  -2.346 -15.152
  489   1HB   ASP  68          1HB       ASP  68 -11.853  -0.578 -15.738
  490   2HB   ASP  68          2HB       ASP  68 -11.367  -1.572 -17.093
  491    H    GLY  69           H        GLY  69 -10.281  -3.727 -16.808
  492   1HA   GLY  69          1HA       GLY  69 -12.100  -5.745 -18.247
  493   2HA   GLY  69          2HA       GLY  69 -10.587  -6.298 -17.515
  494    H    SER  70           H        SER  70  -8.845  -6.314 -18.694
  495    HA   SER  70           HA       SER  70  -8.745  -5.381 -21.517
  496   1HB   SER  70          1HB       SER  70  -8.461  -3.170 -20.718
  497   2HB   SER  70          2HB       SER  70  -6.833  -3.706 -21.143
  498    HG   SER  70           HG       SER  70  -7.454  -2.683 -18.957
  499    H    GLY  71           H        GLY  71  -6.649  -5.948 -18.660
  500   1HA   GLY  71          1HA       GLY  71  -5.186  -7.970 -18.342
  501   2HA   GLY  71          2HA       GLY  71  -5.242  -8.243 -20.088
  502    H    THR  72           H        THR  72  -4.716  -5.078 -18.671
  503    HA   THR  72           HA       THR  72  -1.728  -5.132 -19.042
  504    HB   THR  72           HB       THR  72  -1.637  -3.169 -20.563
  505    HG1  THR  72           HG1      THR  72  -3.447  -2.585 -21.684
  506   1HG2  THR  72          1HG2      THR  72  -2.133  -4.272 -22.707
  507   2HG2  THR  72          2HG2      THR  72  -1.374  -5.452 -21.617
  508   3HG2  THR  72          3HG2      THR  72  -3.130  -5.513 -21.918
  509    H    ILE  73           H        ILE  73  -0.969  -2.701 -18.671
  510    HA   ILE  73           HA       ILE  73  -2.608  -1.331 -16.499
  511    HB   ILE  73           HB       ILE  73   0.309  -2.136 -16.034
  512   1HG1  ILE  73          1HG1      ILE  73  -0.350  -3.872 -14.584
  513   2HG1  ILE  73          2HG1      ILE  73  -1.511  -4.035 -15.885
  514   1HG2  ILE  73          1HG2      ILE  73   0.048  -1.168 -13.753
  515   2HG2  ILE  73          2HG2      ILE  73  -0.321   0.068 -14.964
  516   3HG2  ILE  73          3HG2      ILE  73  -1.645  -0.729 -14.081
  517   1HD1  ILE  73          1HD1      ILE  73  -3.305  -2.925 -14.582
  518   2HD1  ILE  73          2HD1      ILE  73  -2.606  -4.279 -13.670
  519   3HD1  ILE  73          3HD1      ILE  73  -2.168  -2.608 -13.243
  520    H    ASP  74           H        ASP  74  -2.978   0.350 -17.840
  521    HA   ASP  74           HA       ASP  74  -0.892   1.689 -19.481
  522   1HB   ASP  74          1HB       ASP  74  -3.475   3.140 -18.853
  523   2HB   ASP  74          2HB       ASP  74  -2.538   3.100 -20.329
  524    H    PHE  75           H        PHE  75  -1.116   4.318 -19.135
  525    HA   PHE  75           HA       PHE  75   0.404   4.890 -16.637
  526   1HB   PHE  75          1HB       PHE  75   0.831   5.980 -18.932
  527   2HB   PHE  75          2HB       PHE  75  -0.620   6.920 -18.709
  528    HD1  PHE  75           HD1      PHE  75   1.501   6.158 -15.734
  529    HD2  PHE  75           HD2      PHE  75   0.656   9.054 -18.804
  530    HE1  PHE  75           HE1      PHE  75   2.791   7.855 -14.504
  531    HE2  PHE  75           HE2      PHE  75   1.957  10.735 -17.560
  532    HZ   PHE  75           HZ       PHE  75   3.021  10.142 -15.412
  533    H    GLU  76           H        GLU  76  -2.841   5.446 -17.903
  534    HA   GLU  76           HA       GLU  76  -3.794   7.332 -15.853
  535   1HB   GLU  76          1HB       GLU  76  -4.777   6.718 -18.253
  536   2HB   GLU  76          2HB       GLU  76  -5.729   7.444 -16.977
  537   1HG   GLU  76          1HG       GLU  76  -5.715   4.420 -17.577
  538   2HG   GLU  76          2HG       GLU  76  -6.723   5.229 -16.396
  539    H    GLU  77           H        GLU  77  -3.850   3.819 -16.211
  540    HA   GLU  77           HA       GLU  77  -5.475   3.314 -13.737
  541   1HB   GLU  77          1HB       GLU  77  -5.868   1.716 -15.413
  542   2HB   GLU  77          2HB       GLU  77  -4.175   1.516 -15.800
  543   1HG   GLU  77          1HG       GLU  77  -5.514   0.509 -13.207
  544   2HG   GLU  77          2HG       GLU  77  -3.807   0.312 -13.588
  545    H    PHE  78           H        PHE  78  -2.102   3.358 -14.710
  546    HA   PHE  78           HA       PHE  78  -0.881   2.059 -12.415
  547   1HB   PHE  78          1HB       PHE  78   0.269   4.257 -14.243
  548   2HB   PHE  78          2HB       PHE  78   0.375   2.538 -14.523
  549    HD1  PHE  78           HD1      PHE  78   2.105   5.363 -13.240
  550    HD2  PHE  78           HD2      PHE  78   1.535   1.181 -12.404
  551    HE1  PHE  78           HE1      PHE  78   4.218   5.316 -11.977
  552    HE2  PHE  78           HE2      PHE  78   3.656   1.150 -11.156
  553    HZ   PHE  78           HZ       PHE  78   4.994   3.215 -10.930
  554    H    LEU  79           H        LEU  79  -1.902   5.391 -13.018
  555    HA   LEU  79           HA       LEU  79  -0.821   6.625 -10.560
  556   1HB   LEU  79          1HB       LEU  79  -2.861   8.317 -11.111
  557   2HB   LEU  79          2HB       LEU  79  -2.880   7.464 -12.638
  558    HG   LEU  79           HG       LEU  79  -0.271   8.020 -12.729
  559   1HD1  LEU  79          1HD1      LEU  79  -0.777  10.157 -13.915
  560   2HD1  LEU  79          2HD1      LEU  79  -1.971   8.913 -14.332
  561   3HD1  LEU  79          3HD1      LEU  79  -2.403  10.208 -13.188
  562   1HD2  LEU  79          1HD2      LEU  79  -1.238  10.204 -10.761
  563   2HD2  LEU  79          2HD2      LEU  79  -0.015   8.954 -10.423
  564   3HD2  LEU  79          3HD2      LEU  79   0.318  10.205 -11.629
  565    H    VAL  80           H        VAL  80  -3.996   5.300 -11.490
  566    HA   VAL  80           HA       VAL  80  -5.505   5.836  -9.060
  567    HB   VAL  80           HB       VAL  80  -5.832   3.621 -11.136
  568   1HG1  VAL  80          1HG1      VAL  80  -7.646   6.055 -10.604
  569   2HG1  VAL  80          2HG1      VAL  80  -6.341   6.068 -11.798
  570   3HG1  VAL  80          3HG1      VAL  80  -7.697   4.933 -11.988
  571   1HG2  VAL  80          1HG2      VAL  80  -8.012   3.015 -10.193
  572   2HG2  VAL  80          2HG2      VAL  80  -6.814   2.837  -8.890
  573   3HG2  VAL  80          3HG2      VAL  80  -7.880   4.250  -8.916
  574    H    MET  81           H        MET  81  -3.065   3.451  -9.878
  575    HA   MET  81           HA       MET  81  -3.374   1.485  -7.781
  576   1HB   MET  81          1HB       MET  81  -1.509   1.864  -9.824
  577   2HB   MET  81          2HB       MET  81  -0.531   2.173  -8.400
  578   1HG   MET  81          1HG       MET  81  -0.332  -0.201  -8.965
  579   2HG   MET  81          2HG       MET  81  -1.224  -0.081  -7.438
  580   1HE   MET  81          1HE       MET  81  -0.998  -2.251 -10.162
  581   2HE   MET  81          2HE       MET  81  -2.547  -2.352 -11.052
  582   3HE   MET  81          3HE       MET  81  -1.452  -0.968 -11.329
  583    H    MET  82           H        MET  82  -0.900   4.069  -7.736
  584    HA   MET  82           HA       MET  82  -0.191   3.846  -4.963
  585   1HB   MET  82          1HB       MET  82   1.041   5.867  -5.171
  586   2HB   MET  82          2HB       MET  82   1.143   5.050  -6.719
  587   1HG   MET  82          1HG       MET  82   0.013   6.710  -7.871
  588   2HG   MET  82          2HG       MET  82  -1.125   7.020  -6.555
  589   1HE   MET  82          1HE       MET  82   2.407   7.135  -4.821
  590   2HE   MET  82          2HE       MET  82   3.221   8.466  -5.696
  591   3HE   MET  82          3HE       MET  82   2.852   6.937  -6.547
  592    H    VAL  83           H        VAL  83  -2.761   5.706  -6.508
  593    HA   VAL  83           HA       VAL  83  -3.399   7.501  -4.266
  594    HB   VAL  83           HB       VAL  83  -4.610   6.928  -6.930
  595   1HG1  VAL  83          1HG1      VAL  83  -6.785   8.066  -6.444
  596   2HG1  VAL  83          2HG1      VAL  83  -6.661   6.549  -5.543
  597   3HG1  VAL  83          3HG1      VAL  83  -6.406   8.096  -4.703
  598   1HG2  VAL  83          1HG2      VAL  83  -4.271   9.558  -5.341
  599   2HG2  VAL  83          2HG2      VAL  83  -3.157   8.944  -6.584
  600   3HG2  VAL  83          3HG2      VAL  83  -4.799   9.421  -7.038
  601    NH1  ARG  84           NH1      ARG  84  -6.013  -1.713  -5.163
  602    NH2  ARG  84           NH2      ARG  84  -7.917  -2.350  -4.099
  603    H    ARG  84           H        ARG  84  -4.469   4.298  -5.276
  604    HA   ARG  84           HA       ARG  84  -6.898   3.976  -3.665
  605   1HB   ARG  84          1HB       ARG  84  -5.367   2.328  -5.452
  606   2HB   ARG  84          2HB       ARG  84  -5.408   1.458  -3.926
  607   1HG   ARG  84          1HG       ARG  84  -8.022   2.601  -5.008
  608   2HG   ARG  84          2HG       ARG  84  -7.783   1.246  -3.902
  609   1HD   ARG  84          1HD       ARG  84  -8.023   1.178  -6.800
  610   2HD   ARG  84          2HD       ARG  84  -6.400   0.605  -6.410
  611    HE   ARG  84           HE       ARG  84  -8.974  -0.787  -5.779
  612   1HH1  ARG  84          1HH1      ARG  84  -5.564  -1.072  -5.826
  613   2HH1  ARG  84          2HH1      ARG  84  -5.562  -2.472  -4.640
  614   1HH2  ARG  84          1HH2      ARG  84  -8.930  -2.233  -3.993
  615   2HH2  ARG  84          2HH2      ARG  84  -7.321  -3.025  -3.607
  616    H    GLN  85           H        GLN  85  -3.473   3.186  -3.040
  617    HA   GLN  85           HA       GLN  85  -3.946   2.022  -0.332
  618   1HB   GLN  85          1HB       GLN  85  -1.504   2.580  -2.041
  619   2HB   GLN  85          2HB       GLN  85  -1.269   2.425  -0.310
  620   1HG   GLN  85          1HG       GLN  85  -1.473   0.325  -2.233
  621   2HG   GLN  85          2HG       GLN  85  -2.970   0.219  -1.334
  622   1HE2  GLN  85          1HE2      GLN  85   0.484  -0.186   0.978
  623   2HE2  GLN  85          2HE2      GLN  85   0.367   1.126  -0.300
  624    H    MET  86           H        MET  86  -3.003   5.128  -1.699
  625    HA   MET  86           HA       MET  86  -1.882   6.530   0.531
  626   1HB   MET  86          1HB       MET  86  -2.905   7.300  -2.066
  627   2HB   MET  86          2HB       MET  86  -3.627   8.380  -0.888
  628   1HG   MET  86          1HG       MET  86  -0.955   8.495  -1.977
  629   2HG   MET  86          2HG       MET  86  -0.778   8.143  -0.250
  630   1HE   MET  86          1HE       MET  86  -4.058   9.911  -1.620
  631   2HE   MET  86          2HE       MET  86  -3.581  11.635  -1.634
  632   3HE   MET  86          3HE       MET  86  -2.862  10.502  -2.816
  633    H    LYS  87           H        LYS  87  -5.238   5.787  -0.241
  634    HA   LYS  87           HA       LYS  87  -6.787   7.416   1.508
  635   1HB   LYS  87          1HB       LYS  87  -8.200   5.152   1.898
  636   2HB   LYS  87          2HB       LYS  87  -7.145   4.519   0.643
  637   1HG   LYS  87          1HG       LYS  87  -8.028   7.023  -0.401
  638   2HG   LYS  87          2HG       LYS  87  -8.471   5.416  -0.954
  639   1HD   LYS  87          1HD       LYS  87 -10.383   7.082  -0.329
  640   2HD   LYS  87          2HD       LYS  87 -10.510   5.414   0.218
  641   1HE   LYS  87          1HE       LYS  87 -10.164   5.957   2.507
  642   2HE   LYS  87          2HE       LYS  87  -9.222   7.409   2.145
  643   1HZ   LYS  87          1HZ       LYS  87 -11.566   7.756   2.970
  644   2HZ   LYS  87          2HZ       LYS  87 -12.117   7.236   1.501
  645   3HZ   LYS  87          3HZ       LYS  87 -11.176   8.591   1.599
  646    H    GLU  88           H        GLU  88  -7.170   7.536   3.628
  647    HA   GLU  88           HA       GLU  88  -5.187   6.678   5.595
  648   1HB   GLU  88          1HB       GLU  88  -6.656   8.685   5.851
  649   2HB   GLU  88          2HB       GLU  88  -6.546   7.676   7.281
  650   1HG   GLU  88          1HG       GLU  88  -8.917   7.332   5.362
  651   2HG   GLU  88          2HG       GLU  88  -8.816   6.887   7.056
  652    H    ASP  89           H        ASP  89  -4.840   4.535   5.611
  653    HA   ASP  89           HA       ASP  89  -7.148   2.656   6.348
  654   1HB   ASP  89          1HB       ASP  89  -5.851   2.365   4.039
  655   2HB   ASP  89          2HB       ASP  89  -6.408   0.995   4.972
  656    H    ALA  90           H        ALA  90  -6.614   0.925   7.772
  657    HA   ALA  90           HA       ALA  90  -4.643   1.729   9.952
  658   1HB   ALA  90          1HB       ALA  90  -5.862   0.078  11.393
  659   2HB   ALA  90          2HB       ALA  90  -6.993   1.250  10.687
  660   3HB   ALA  90          3HB       ALA  90  -6.896  -0.400  10.024
   
  Start of MODEL          27
 Raw file had  660 H/Q atoms
  Start of MODEL   27
    1   1H    ALA   1          1H        ALA   1 -17.151   3.293 -16.651
    2   2H    ALA   1          2H        ALA   1 -16.918   2.207 -15.389
    3   3H    ALA   1          3H        ALA   1 -15.919   2.152 -16.740
    4    HA   ALA   1           HA       ALA   1 -17.394   1.142 -18.060
    5   1HB   ALA   1          1HB       ALA   1 -18.859  -0.390 -16.287
    6   2HB   ALA   1          2HB       ALA   1 -17.606   0.223 -15.192
    7   3HB   ALA   1          3HB       ALA   1 -17.143  -0.693 -16.649
    8    H    SER   2           H        SER   2 -19.263   2.212 -15.192
    9    HA   SER   2           HA       SER   2 -21.383   3.490 -16.983
   10   1HB   SER   2          1HB       SER   2 -21.959   1.036 -16.307
   11   2HB   SER   2          2HB       SER   2 -22.240   1.670 -14.683
   12    HG   SER   2           HG       SER   2 -23.748   1.854 -16.900
   13    H    MET   3           H        MET   3 -20.403   2.825 -13.605
   14    HA   MET   3           HA       MET   3 -20.300   5.722 -12.858
   15   1HB   MET   3          1HB       MET   3 -22.745   5.378 -12.828
   16   2HB   MET   3          2HB       MET   3 -22.593   4.000 -11.754
   17   1HG   MET   3          1HG       MET   3 -22.893   5.452 -10.018
   18   2HG   MET   3          2HG       MET   3 -21.265   6.067 -10.327
   19   1HE   MET   3          1HE       MET   3 -25.238   8.220 -10.941
   20   2HE   MET   3          2HE       MET   3 -24.859   6.729 -10.029
   21   3HE   MET   3          3HE       MET   3 -25.153   6.643 -11.790
   22    H    THR   4           H        THR   4 -18.167   4.771 -12.504
   23    HA   THR   4           HA       THR   4 -17.816   3.787  -9.678
   24    HB   THR   4           HB       THR   4 -17.011   2.097 -12.055
   25    HG1  THR   4           HG1      THR   4 -18.317   0.718 -11.148
   26   1HG2  THR   4          1HG2      THR   4 -16.022   0.474 -10.285
   27   2HG2  THR   4          2HG2      THR   4 -15.852   1.883  -9.214
   28   3HG2  THR   4          3HG2      THR   4 -14.984   1.832 -10.770
   29    H    ASP   5           H        ASP   5 -16.981   5.914  -9.479
   30    HA   ASP   5           HA       ASP   5 -14.418   6.686 -10.864
   31   1HB   ASP   5          1HB       ASP   5 -14.567   8.817  -9.857
   32   2HB   ASP   5          2HB       ASP   5 -15.516   8.251  -8.502
   33    H    GLN   6           H        GLN   6 -13.332   4.753 -10.157
   34    HA   GLN   6           HA       GLN   6 -12.647   4.358  -7.234
   35   1HB   GLN   6          1HB       GLN   6 -12.462   2.727  -9.704
   36   2HB   GLN   6          2HB       GLN   6 -12.697   2.248  -8.033
   37   1HG   GLN   6          1HG       GLN   6 -10.326   2.183  -7.572
   38   2HG   GLN   6          2HG       GLN   6  -9.917   3.106  -9.000
   39   1HE2  GLN   6          1HE2      GLN   6  -9.217   0.041 -10.690
   40   2HE2  GLN   6          2HE2      GLN   6  -8.627   1.667 -10.077
   41    H    GLN   7           H        GLN   7 -10.903   4.965 -10.301
   42    HA   GLN   7           HA       GLN   7  -8.321   5.669  -8.921
   43   1HB   GLN   7          1HB       GLN   7  -7.464   5.007 -10.910
   44   2HB   GLN   7          2HB       GLN   7  -8.060   6.516 -11.586
   45   1HG   GLN   7          1HG       GLN   7  -8.706   4.512 -12.950
   46   2HG   GLN   7          2HG       GLN   7  -9.653   3.878 -11.613
   47   1HE2  GLN   7          1HE2      GLN   7 -11.078   7.467 -13.222
   48   2HE2  GLN   7          2HE2      GLN   7  -9.300   7.261 -12.818
   49    H    ALA   8           H        ALA   8 -11.034   7.287 -10.501
   50    HA   ALA   8           HA       ALA   8 -10.185   9.956 -10.902
   51   1HB   ALA   8          1HB       ALA   8 -12.535  10.668 -10.491
   52   2HB   ALA   8          2HB       ALA   8 -12.468   9.183 -11.460
   53   3HB   ALA   8          3HB       ALA   8 -12.911   9.101  -9.736
   54    H    GLU   9           H        GLU   9 -10.852   8.304  -7.867
   55    HA   GLU   9           HA       GLU   9 -10.975  10.621  -6.069
   56   1HB   GLU   9          1HB       GLU   9 -10.559   7.633  -5.588
   57   2HB   GLU   9          2HB       GLU   9 -10.228   8.765  -4.285
   58   1HG   GLU   9          1HG       GLU   9 -12.750   7.669  -4.900
   59   2HG   GLU   9          2HG       GLU   9 -12.889   9.297  -5.552
   60    H    ALA  10           H        ALA  10  -8.384   8.157  -6.181
   61    HA   ALA  10           HA       ALA  10  -6.413   9.513  -4.620
   62   1HB   ALA  10          1HB       ALA  10  -4.726   8.024  -5.685
   63   2HB   ALA  10          2HB       ALA  10  -6.201   7.132  -5.266
   64   3HB   ALA  10          3HB       ALA  10  -5.881   7.575  -6.963
   65    NH1  ARG  11           NH1      ARG  11  -8.501  13.133 -15.021
   66    NH2  ARG  11           NH2      ARG  11  -7.243  15.023 -14.957
   67    H    ARG  11           H        ARG  11  -7.239   9.887  -8.019
   68    HA   ARG  11           HA       ARG  11  -4.888  11.322  -9.020
   69   1HB   ARG  11          1HB       ARG  11  -6.264  10.506 -10.747
   70   2HB   ARG  11          2HB       ARG  11  -7.751  11.011  -9.960
   71   1HG   ARG  11          1HG       ARG  11  -7.418  13.361 -10.538
   72   2HG   ARG  11          2HG       ARG  11  -5.774  13.067 -11.112
   73   1HD   ARG  11          1HD       ARG  11  -7.014  11.311 -12.770
   74   2HD   ARG  11          2HD       ARG  11  -8.420  12.331 -12.461
   75    HE   ARG  11           HE       ARG  11  -5.824  13.636 -13.410
   76   1HH1  ARG  11          1HH1      ARG  11  -8.689  12.202 -14.631
   77   2HH1  ARG  11          2HH1      ARG  11  -8.998  13.585 -15.796
   78   1HH2  ARG  11          1HH2      ARG  11  -6.461  15.529 -14.528
   79   2HH2  ARG  11          2HH2      ARG  11  -7.838  15.349 -15.727
   80    H    ALA  12           H        ALA  12  -8.082  12.538  -7.964
   81    HA   ALA  12           HA       ALA  12  -7.478  15.404  -8.177
   82   1HB   ALA  12          1HB       ALA  12  -9.548  15.768  -6.850
   83   2HB   ALA  12          2HB       ALA  12  -9.809  14.573  -8.136
   84   3HB   ALA  12          3HB       ALA  12  -9.632  14.036  -6.447
   85    H    PHE  13           H        PHE  13  -7.019  12.998  -5.649
   86    HA   PHE  13           HA       PHE  13  -6.521  14.735  -3.369
   87   1HB   PHE  13          1HB       PHE  13  -5.449  11.898  -3.863
   88   2HB   PHE  13          2HB       PHE  13  -7.044  12.267  -3.262
   89    HD1  PHE  13           HD1      PHE  13  -5.669  10.531  -1.542
   90    HD2  PHE  13           HD2      PHE  13  -5.081  14.788  -1.792
   91    HE1  PHE  13           HE1      PHE  13  -4.769  10.554   0.749
   92    HE2  PHE  13           HE2      PHE  13  -4.178  14.788   0.495
   93    HZ   PHE  13           HZ       PHE  13  -4.022  12.677   1.771
   94    H    LEU  14           H        LEU  14  -4.388  13.299  -5.824
   95    HA   LEU  14           HA       LEU  14  -1.896  14.605  -4.658
   96   1HB   LEU  14          1HB       LEU  14  -1.967  12.803  -7.131
   97   2HB   LEU  14          2HB       LEU  14  -0.591  13.205  -6.128
   98    HG   LEU  14           HG       LEU  14  -2.900  11.677  -4.846
   99   1HD1  LEU  14          1HD1      LEU  14  -1.949   9.500  -5.611
  100   2HD1  LEU  14          2HD1      LEU  14  -2.504  10.462  -6.994
  101   3HD1  LEU  14          3HD1      LEU  14  -0.762  10.347  -6.637
  102   1HD2  LEU  14          1HD2      LEU  14   0.162  11.566  -4.419
  103   2HD2  LEU  14          2HD2      LEU  14  -1.015  12.381  -3.361
  104   3HD2  LEU  14          3HD2      LEU  14  -1.047  10.618  -3.517
  105    H    SER  15           H        SER  15  -0.714  16.098  -5.757
  106    HA   SER  15           HA       SER  15  -2.124  17.736  -7.871
  107   1HB   SER  15          1HB       SER  15  -0.874  19.535  -7.177
  108   2HB   SER  15          2HB       SER  15   0.587  18.589  -6.882
  109    HG   SER  15           HG       SER  15  -0.713  19.440  -5.049
  110    H    GLU  16           H        GLU  16  -0.148  18.818  -9.309
  111    HA   GLU  16           HA       GLU  16   0.598  16.696 -11.254
  112   1HB   GLU  16          1HB       GLU  16  -0.122  18.751 -12.201
  113   2HB   GLU  16          2HB       GLU  16   0.949  19.724 -11.212
  114   1HG   GLU  16          1HG       GLU  16   2.129  19.819 -13.210
  115   2HG   GLU  16          2HG       GLU  16   2.893  18.387 -12.542
  116    H    GLU  17           H        GLU  17   2.201  18.631  -8.800
  117    HA   GLU  17           HA       GLU  17   5.004  17.916  -9.589
  118   1HB   GLU  17          1HB       GLU  17   4.683  20.076  -8.562
  119   2HB   GLU  17          2HB       GLU  17   5.742  19.102  -7.561
  120   1HG   GLU  17          1HG       GLU  17   4.070  18.835  -5.832
  121   2HG   GLU  17          2HG       GLU  17   2.748  19.267  -6.902
  122    H    MET  18           H        MET  18   2.553  16.842  -7.293
  123    HA   MET  18           HA       MET  18   4.246  14.883  -5.820
  124   1HB   MET  18          1HB       MET  18   1.883  13.945  -5.115
  125   2HB   MET  18          2HB       MET  18   1.231  15.359  -5.922
  126   1HG   MET  18          1HG       MET  18   3.402  15.747  -3.795
  127   2HG   MET  18          2HG       MET  18   2.165  16.890  -4.343
  128   1HE   MET  18          1HE       MET  18   2.078  17.080  -1.465
  129   2HE   MET  18          2HE       MET  18   1.460  15.730  -0.468
  130   3HE   MET  18          3HE       MET  18   3.057  15.593  -1.261
  131    H    ILE  19           H        ILE  19   2.099  14.862  -8.619
  132    HA   ILE  19           HA       ILE  19   1.805  11.950  -8.938
  133    HB   ILE  19           HB       ILE  19   1.134  14.347 -10.603
  134   1HG1  ILE  19          1HG1      ILE  19  -0.588  11.844 -10.498
  135   2HG1  ILE  19          2HG1      ILE  19  -0.346  12.684  -8.981
  136   1HG2  ILE  19          1HG2      ILE  19   0.665  13.036 -12.689
  137   2HG2  ILE  19          2HG2      ILE  19   2.390  13.007 -12.327
  138   3HG2  ILE  19          3HG2      ILE  19   1.392  11.581 -11.965
  139   1HD1  ILE  19          1HD1      ILE  19  -1.587  13.966 -11.488
  140   2HD1  ILE  19          2HD1      ILE  19  -2.406  13.507  -9.981
  141   3HD1  ILE  19          3HD1      ILE  19  -1.225  14.837  -9.972
  142    H    ALA  20           H        ALA  20   4.164  14.362  -9.975
  143    HA   ALA  20           HA       ALA  20   5.642  12.831 -11.957
  144   1HB   ALA  20          1HB       ALA  20   7.462  14.500 -11.619
  145   2HB   ALA  20          2HB       ALA  20   5.875  15.285 -11.734
  146   3HB   ALA  20          3HB       ALA  20   6.669  15.112 -10.148
  147    H    GLU  21           H        GLU  21   5.777  12.915  -8.442
  148    HA   GLU  21           HA       GLU  21   8.408  11.690  -8.029
  149   1HB   GLU  21          1HB       GLU  21   7.578  11.217  -5.680
  150   2HB   GLU  21          2HB       GLU  21   5.995  11.809  -6.141
  151   1HG   GLU  21          1HG       GLU  21   7.019  14.084  -6.666
  152   2HG   GLU  21          2HG       GLU  21   8.595  13.475  -6.191
  153    H    PHE  22           H        PHE  22   5.181  10.427  -8.613
  154    HA   PHE  22           HA       PHE  22   5.958   7.566  -7.994
  155   1HB   PHE  22          1HB       PHE  22   3.212   8.616  -8.907
  156   2HB   PHE  22          2HB       PHE  22   3.574   7.029  -8.284
  157    HD1  PHE  22           HD1      PHE  22   5.654   8.436  -6.115
  158    HD2  PHE  22           HD2      PHE  22   1.458   8.725  -7.030
  159    HE1  PHE  22           HE1      PHE  22   5.214   9.322  -3.864
  160    HE2  PHE  22           HE2      PHE  22   1.037   9.602  -4.769
  161    HZ   PHE  22           HZ       PHE  22   2.910   9.907  -3.185
  162    H    LYS  23           H        LYS  23   5.452   9.710 -10.702
  163    HA   LYS  23           HA       LYS  23   4.863   7.682 -12.805
  164   1HB   LYS  23          1HB       LYS  23   4.720   9.425 -14.312
  165   2HB   LYS  23          2HB       LYS  23   4.379  10.290 -12.831
  166   1HG   LYS  23          1HG       LYS  23   6.953  10.896 -12.802
  167   2HG   LYS  23          2HG       LYS  23   5.841  11.745 -13.863
  168   1HD   LYS  23          1HD       LYS  23   8.144  10.922 -14.847
  169   2HD   LYS  23          2HD       LYS  23   7.411   9.314 -14.898
  170   1HE   LYS  23          1HE       LYS  23   7.082  11.486 -16.808
  171   2HE   LYS  23          2HE       LYS  23   5.498  11.207 -16.069
  172   1HZ   LYS  23          1HZ       LYS  23   7.080   8.882 -16.976
  173   2HZ   LYS  23          2HZ       LYS  23   6.262   9.789 -18.089
  174   3HZ   LYS  23          3HZ       LYS  23   5.440   9.048 -16.863
  175    H    ALA  24           H        ALA  24   7.733   9.294 -11.517
  176    HA   ALA  24           HA       ALA  24   9.754   8.485 -13.450
  177   1HB   ALA  24          1HB       ALA  24  11.402   8.867 -11.627
  178   2HB   ALA  24          2HB       ALA  24  10.207  10.176 -11.698
  179   3HB   ALA  24          3HB       ALA  24  10.097   8.940 -10.419
  180    H    ALA  25           H        ALA  25   8.625   6.918 -10.441
  181    HA   ALA  25           HA       ALA  25  10.340   4.517 -10.664
  182   1HB   ALA  25          1HB       ALA  25   9.026   3.662  -8.732
  183   2HB   ALA  25          2HB       ALA  25   9.546   5.336  -8.465
  184   3HB   ALA  25          3HB       ALA  25   7.853   4.990  -8.900
  185    H    PHE  26           H        PHE  26   7.128   5.402 -11.754
  186    HA   PHE  26           HA       PHE  26   5.853   2.805 -12.071
  187   1HB   PHE  26          1HB       PHE  26   4.330   4.551 -12.306
  188   2HB   PHE  26          2HB       PHE  26   5.375   5.536 -13.294
  189    HD1  PHE  26           HD1      PHE  26   2.884   2.786 -13.290
  190    HD2  PHE  26           HD2      PHE  26   5.522   5.080 -15.797
  191    HE1  PHE  26           HE1      PHE  26   1.656   2.035 -15.287
  192    HE2  PHE  26           HE2      PHE  26   4.284   4.316 -17.783
  193    HZ   PHE  26           HZ       PHE  26   2.340   2.811 -17.532
  194    H    ASP  27           H        ASP  27   7.882   4.738 -14.268
  195    HA   ASP  27           HA       ASP  27   7.834   2.988 -16.604
  196   1HB   ASP  27          1HB       ASP  27  10.005   4.117 -17.290
  197   2HB   ASP  27          2HB       ASP  27  10.038   4.946 -15.751
  198    H    MET  28           H        MET  28   9.817   3.056 -13.683
  199    HA   MET  28           HA       MET  28  11.914   1.184 -14.382
  200   1HB   MET  28          1HB       MET  28  11.526   2.607 -12.131
  201   2HB   MET  28          2HB       MET  28  10.802   1.116 -11.556
  202   1HG   MET  28          1HG       MET  28  12.932  -0.143 -11.995
  203   2HG   MET  28          2HG       MET  28  13.677   1.322 -12.655
  204   1HE   MET  28          1HE       MET  28  11.937   3.409 -10.574
  205   2HE   MET  28          2HE       MET  28  13.229   3.732  -9.380
  206   3HE   MET  28          3HE       MET  28  13.609   3.744 -11.128
  207    H    PHE  29           H        PHE  29   8.670   0.647 -13.029
  208    HA   PHE  29           HA       PHE  29   8.896  -2.300 -12.761
  209   1HB   PHE  29          1HB       PHE  29   6.329  -0.602 -12.862
  210   2HB   PHE  29          2HB       PHE  29   6.418  -2.278 -12.392
  211    HD1  PHE  29           HD1      PHE  29   9.407  -1.107 -11.055
  212    HD2  PHE  29           HD2      PHE  29   5.171  -0.645 -10.440
  213    HE1  PHE  29           HE1      PHE  29   9.811  -0.373  -8.741
  214    HE2  PHE  29           HE2      PHE  29   5.598   0.077  -8.127
  215    HZ   PHE  29           HZ       PHE  29   7.912   0.239  -7.282
  216    H    ASP  30           H        ASP  30   7.778  -0.029 -15.215
  217    HA   ASP  30           HA       ASP  30   6.386  -1.853 -17.008
  218   1HB   ASP  30          1HB       ASP  30   7.797   0.784 -17.710
  219   2HB   ASP  30          2HB       ASP  30   6.138   0.606 -17.188
  220    H    ALA  31           H        ALA  31   9.427  -0.289 -17.970
  221    HA   ALA  31           HA       ALA  31  11.506  -1.178 -18.838
  222   1HB   ALA  31          1HB       ALA  31  12.037  -3.592 -18.491
  223   2HB   ALA  31          2HB       ALA  31  11.446  -2.829 -17.002
  224   3HB   ALA  31          3HB       ALA  31  10.377  -3.908 -17.934
  225    H    ASP  32           H        ASP  32   8.884  -0.853 -20.270
  226    HA   ASP  32           HA       ASP  32   9.531  -2.498 -22.772
  227   1HB   ASP  32          1HB       ASP  32   6.844  -1.885 -21.551
  228   2HB   ASP  32          2HB       ASP  32   6.948  -1.724 -23.289
  229    H    GLY  33           H        GLY  33   7.398   0.303 -22.277
  230   1HA   GLY  33          1HA       GLY  33   9.258   2.099 -23.930
  231   2HA   GLY  33          2HA       GLY  33   7.600   1.880 -24.444
  232    H    GLY  34           H        GLY  34   6.073   2.080 -22.291
  233   1HA   GLY  34          1HA       GLY  34   6.133   3.502 -20.016
  234   2HA   GLY  34          2HA       GLY  34   6.689   4.818 -21.059
  235    H    GLY  35           H        GLY  35   4.036   2.464 -20.754
  236   1HA   GLY  35          1HA       GLY  35   1.951   4.565 -21.489
  237   2HA   GLY  35          2HA       GLY  35   2.097   3.183 -22.582
  238    H    ASP  36           H        ASP  36   2.631   1.118 -20.861
  239    HA   ASP  36           HA       ASP  36   0.784   0.967 -18.528
  240   1HB   ASP  36          1HB       ASP  36  -0.510  -1.066 -19.748
  241   2HB   ASP  36          2HB       ASP  36  -1.112   0.575 -19.702
  242    H    ILE  37           H        ILE  37   1.134  -0.861 -17.321
  243    HA   ILE  37           HA       ILE  37   3.569  -2.544 -18.036
  244    HB   ILE  37           HB       ILE  37   2.404  -3.021 -15.358
  245   1HG1  ILE  37          1HG1      ILE  37   3.767  -0.288 -15.783
  246   2HG1  ILE  37          2HG1      ILE  37   2.048  -0.503 -15.517
  247   1HG2  ILE  37          1HG2      ILE  37   4.770  -3.118 -14.675
  248   2HG2  ILE  37          2HG2      ILE  37   4.539  -4.046 -16.164
  249   3HG2  ILE  37          3HG2      ILE  37   5.296  -2.437 -16.234
  250   1HD1  ILE  37          1HD1      ILE  37   4.229  -1.215 -13.465
  251   2HD1  ILE  37          2HD1      ILE  37   3.078   0.138 -13.401
  252   3HD1  ILE  37          3HD1      ILE  37   2.486  -1.532 -13.247
  253    H    SER  38           H        SER  38   2.919  -4.741 -16.360
  254    HA   SER  38           HA       SER  38   0.301  -5.933 -17.252
  255   1HB   SER  38          1HB       SER  38   2.214  -7.885 -18.156
  256   2HB   SER  38          2HB       SER  38   2.677  -6.342 -18.878
  257    HG   SER  38           HG       SER  38   0.921  -7.814 -19.804
  258    H    THR  39           H        THR  39   0.926  -8.584 -16.847
  259    HA   THR  39           HA       THR  39   1.195  -8.733 -13.855
  260    HB   THR  39           HB       THR  39   0.856 -11.331 -14.447
  261    HG1  THR  39           HG1      THR  39   0.005 -11.692 -16.304
  262   1HG2  THR  39          1HG2      THR  39  -1.576 -11.091 -14.206
  263   2HG2  THR  39          2HG2      THR  39  -0.779  -9.935 -13.113
  264   3HG2  THR  39          3HG2      THR  39  -1.510  -9.366 -14.637
  265    H    LYS  40           H        LYS  40   2.884  -9.898 -16.762
  266    HA   LYS  40           HA       LYS  40   4.981 -11.454 -15.399
  267   1HB   LYS  40          1HB       LYS  40   4.927 -10.217 -18.201
  268   2HB   LYS  40          2HB       LYS  40   4.364 -11.819 -17.802
  269   1HG   LYS  40          1HG       LYS  40   7.160 -10.680 -18.120
  270   2HG   LYS  40          2HG       LYS  40   7.011 -11.922 -16.905
  271   1HD   LYS  40          1HD       LYS  40   6.222 -13.586 -18.633
  272   2HD   LYS  40          2HD       LYS  40   6.160 -12.308 -19.810
  273   1HE   LYS  40          1HE       LYS  40   8.730 -11.969 -19.417
  274   2HE   LYS  40          2HE       LYS  40   8.705 -13.562 -18.674
  275   1HZ   LYS  40          1HZ       LYS  40   9.078 -13.199 -21.252
  276   2HZ   LYS  40          2HZ       LYS  40   7.430 -13.282 -21.312
  277   3HZ   LYS  40          3HZ       LYS  40   8.299 -14.545 -20.697
  278    H    GLU  41           H        GLU  41   4.924  -8.208 -16.913
  279    HA   GLU  41           HA       GLU  41   7.626  -7.364 -16.326
  280   1HB   GLU  41          1HB       GLU  41   6.922  -5.057 -16.718
  281   2HB   GLU  41          2HB       GLU  41   5.235  -5.478 -16.520
  282   1HG   GLU  41          1HG       GLU  41   7.074  -6.279 -18.852
  283   2HG   GLU  41          2HG       GLU  41   5.520  -7.041 -18.594
  284    H    LEU  42           H        LEU  42   4.608  -6.767 -14.510
  285    HA   LEU  42           HA       LEU  42   5.763  -5.168 -12.339
  286   1HB   LEU  42          1HB       LEU  42   3.269  -6.922 -12.025
  287   2HB   LEU  42          2HB       LEU  42   3.239  -5.489 -13.029
  288    HG   LEU  42           HG       LEU  42   3.189  -4.028 -11.245
  289   1HD1  LEU  42          1HD1      LEU  42   1.892  -4.950  -9.306
  290   2HD1  LEU  42          2HD1      LEU  42   1.262  -5.552 -10.847
  291   3HD1  LEU  42          3HD1      LEU  42   2.266  -6.612  -9.827
  292   1HD2  LEU  42          1HD2      LEU  42   4.867  -5.962  -9.507
  293   2HD2  LEU  42          2HD2      LEU  42   5.485  -4.537 -10.376
  294   3HD2  LEU  42          3HD2      LEU  42   4.339  -4.325  -9.040
  295    H    GLY  43           H        GLY  43   5.262  -8.628 -12.837
  296   1HA   GLY  43          1HA       GLY  43   5.658  -9.680 -10.162
  297   2HA   GLY  43          2HA       GLY  43   5.997 -10.584 -11.643
  298    H    THR  44           H        THR  44   7.940  -8.588 -12.611
  299    HA   THR  44           HA       THR  44  10.357  -9.880 -11.520
  300    HB   THR  44           HB       THR  44   9.860  -7.851 -13.695
  301    HG1  THR  44           HG1      THR  44  11.286  -9.446 -14.696
  302   1HG2  THR  44          1HG2      THR  44  12.308  -7.594 -14.138
  303   2HG2  THR  44          2HG2      THR  44  11.848  -6.821 -12.606
  304   3HG2  THR  44          3HG2      THR  44  12.686  -8.394 -12.593
  305    H    VAL  45           H        VAL  45   9.024  -6.583 -11.363
  306    HA   VAL  45           HA       VAL  45  11.226  -5.348  -9.864
  307    HB   VAL  45           HB       VAL  45   8.677  -4.456 -10.935
  308   1HG1  VAL  45          1HG1      VAL  45   8.064  -2.701  -9.272
  309   2HG1  VAL  45          2HG1      VAL  45   7.856  -4.310  -8.570
  310   3HG1  VAL  45          3HG1      VAL  45   9.270  -3.331  -8.119
  311   1HG2  VAL  45          1HG2      VAL  45  11.118  -2.824  -9.967
  312   2HG2  VAL  45          2HG2      VAL  45  10.879  -3.462 -11.610
  313   3HG2  VAL  45          3HG2      VAL  45   9.788  -2.216 -10.988
  314    H    MET  46           H        MET  46   8.152  -6.877  -8.942
  315    HA   MET  46           HA       MET  46   8.187  -6.273  -6.062
  316   1HB   MET  46          1HB       MET  46   6.762  -8.487  -7.639
  317   2HB   MET  46          2HB       MET  46   6.653  -8.359  -5.893
  318   1HG   MET  46          1HG       MET  46   5.234  -6.785  -7.960
  319   2HG   MET  46          2HG       MET  46   6.018  -5.724  -6.777
  320   1HE   MET  46          1HE       MET  46   2.980  -5.460  -6.813
  321   2HE   MET  46          2HE       MET  46   2.505  -5.722  -5.110
  322   3HE   MET  46          3HE       MET  46   3.955  -4.748  -5.490
  323    NH1  ARG  47           NH1      ARG  47   8.076 -16.792  -5.580
  324    NH2  ARG  47           NH2      ARG  47   6.847 -15.764  -3.968
  325    H    ARG  47           H        ARG  47   8.635  -9.491  -7.534
  326    HA   ARG  47           HA       ARG  47  10.590 -10.348  -5.391
  327   1HB   ARG  47          1HB       ARG  47   9.915 -12.119  -7.766
  328   2HB   ARG  47          2HB       ARG  47   8.633 -11.740  -6.623
  329   1HG   ARG  47          1HG       ARG  47  11.332 -13.014  -5.852
  330   2HG   ARG  47          2HG       ARG  47  10.055 -12.588  -4.712
  331   1HD   ARG  47          1HD       ARG  47   9.196 -14.358  -7.033
  332   2HD   ARG  47          2HD       ARG  47  10.301 -15.080  -5.873
  333    HE   ARG  47           HE       ARG  47   8.116 -13.775  -4.403
  334   1HH1  ARG  47          1HH1      ARG  47   8.823 -16.715  -6.279
  335   2HH1  ARG  47          2HH1      ARG  47   7.515 -17.624  -5.368
  336   1HH2  ARG  47          1HH2      ARG  47   6.655 -14.907  -3.437
  337   2HH2  ARG  47          2HH2      ARG  47   6.372 -16.668  -3.870
  338    H    MET  48           H        MET  48  11.570  -8.239  -6.916
  339    HA   MET  48           HA       MET  48  13.495  -9.140  -9.013
  340   1HB   MET  48          1HB       MET  48  12.537  -6.659  -8.381
  341   2HB   MET  48          2HB       MET  48  13.968  -6.968  -9.345
  342   1HG   MET  48          1HG       MET  48  13.831  -5.394  -6.982
  343   2HG   MET  48          2HG       MET  48  14.678  -6.858  -6.458
  344   1HE   MET  48          1HE       MET  48  15.359  -3.432  -7.468
  345   2HE   MET  48          2HE       MET  48  16.380  -3.446  -8.935
  346   3HE   MET  48          3HE       MET  48  14.637  -3.824  -9.059
  347    H    LEU  49           H        LEU  49  13.481  -8.656  -5.518
  348    HA   LEU  49           HA       LEU  49  16.416  -9.435  -5.257
  349   1HB   LEU  49          1HB       LEU  49  16.026  -7.525  -3.940
  350   2HB   LEU  49          2HB       LEU  49  16.043  -8.841  -2.786
  351    HG   LEU  49           HG       LEU  49  14.205  -7.739  -1.959
  352   1HD1  LEU  49          1HD1      LEU  49  12.688  -6.238  -3.255
  353   2HD1  LEU  49          2HD1      LEU  49  14.385  -5.808  -3.538
  354   3HD1  LEU  49          3HD1      LEU  49  13.480  -6.709  -4.781
  355   1HD2  LEU  49          1HD2      LEU  49  12.796  -9.260  -4.257
  356   2HD2  LEU  49          2HD2      LEU  49  13.212  -9.926  -2.658
  357   3HD2  LEU  49          3HD2      LEU  49  12.006  -8.637  -2.786
  358    H    GLY  50           H        GLY  50  15.318 -11.532  -6.173
  359   1HA   GLY  50          1HA       GLY  50  15.573 -13.616  -4.071
  360   2HA   GLY  50          2HA       GLY  50  13.872 -13.405  -4.506
  361    H    GLN  51           H        GLN  51  13.130 -13.944  -6.528
  362    HA   GLN  51           HA       GLN  51  14.983 -15.548  -8.386
  363   1HB   GLN  51          1HB       GLN  51  13.474 -17.416  -8.461
  364   2HB   GLN  51          2HB       GLN  51  12.214 -16.558  -7.594
  365   1HG   GLN  51          1HG       GLN  51  14.902 -17.226  -6.266
  366   2HG   GLN  51          2HG       GLN  51  13.591 -18.383  -6.319
  367   1HE2  GLN  51          1HE2      GLN  51  11.516 -15.942  -4.215
  368   2HE2  GLN  51          2HE2      GLN  51  11.349 -16.770  -5.843
  369    H    ASN  52           H        ASN  52  12.987 -16.389 -10.103
  370    HA   ASN  52           HA       ASN  52  11.705 -13.820 -11.135
  371   1HB   ASN  52          1HB       ASN  52  12.329 -15.869 -13.230
  372   2HB   ASN  52          2HB       ASN  52  13.760 -15.245 -12.439
  373   1HD2  ASN  52          1HD2      ASN  52  13.464 -12.719 -15.033
  374   2HD2  ASN  52          2HD2      ASN  52  14.302 -14.256 -14.484
  375    HA   PRO  53           HA       PRO  53   8.158 -16.929 -10.126
  376   1HB   PRO  53          1HB       PRO  53   6.445 -15.509  -9.271
  377   2HB   PRO  53          2HB       PRO  53   6.771 -14.257 -10.479
  378   1HG   PRO  53          1HG       PRO  53   7.832 -13.231  -8.671
  379   2HG   PRO  53          2HG       PRO  53   8.288 -14.754  -7.872
  380   1HD   PRO  53          1HD       PRO  53  10.412 -14.348  -8.917
  381   2HD   PRO  53          2HD       PRO  53   9.707 -13.244 -10.132
  382    H    THR  54           H        THR  54   6.141 -17.275 -11.421
  383    HA   THR  54           HA       THR  54   6.711 -16.998 -14.401
  384    HB   THR  54           HB       THR  54   6.212 -19.297 -13.173
  385    HG1  THR  54           HG1      THR  54   5.508 -20.041 -15.138
  386   1HG2  THR  54          1HG2      THR  54   3.878 -20.082 -13.407
  387   2HG2  THR  54          2HG2      THR  54   3.943 -18.728 -12.255
  388   3HG2  THR  54          3HG2      THR  54   3.337 -18.462 -13.910
  389    H    LYS  55           H        LYS  55   4.606 -16.874 -15.718
  390    HA   LYS  55           HA       LYS  55   3.451 -14.212 -15.185
  391   1HB   LYS  55          1HB       LYS  55   2.886 -16.307 -17.367
  392   2HB   LYS  55          2HB       LYS  55   1.989 -14.805 -17.282
  393   1HG   LYS  55          1HG       LYS  55   3.599 -13.663 -18.342
  394   2HG   LYS  55          2HG       LYS  55   4.835 -14.150 -17.195
  395   1HD   LYS  55          1HD       LYS  55   4.041 -15.492 -19.846
  396   2HD   LYS  55          2HD       LYS  55   5.617 -14.920 -19.323
  397   1HE   LYS  55          1HE       LYS  55   5.254 -16.849 -17.415
  398   2HE   LYS  55          2HE       LYS  55   4.255 -17.553 -18.683
  399   1HZ   LYS  55          1HZ       LYS  55   6.241 -18.365 -19.358
  400   2HZ   LYS  55          2HZ       LYS  55   7.140 -17.222 -18.574
  401   3HZ   LYS  55          3HZ       LYS  55   6.487 -16.887 -20.055
  402    H    GLU  56           H        GLU  56   2.259 -17.551 -15.057
  403    HA   GLU  56           HA       GLU  56  -0.564 -16.954 -14.524
  404   1HB   GLU  56          1HB       GLU  56  -0.338 -19.478 -13.507
  405   2HB   GLU  56          2HB       GLU  56   1.143 -19.437 -14.442
  406   1HG   GLU  56          1HG       GLU  56  -1.734 -19.088 -15.482
  407   2HG   GLU  56          2HG       GLU  56  -0.634 -20.416 -15.809
  408    H    GLU  57           H        GLU  57   2.278 -17.498 -12.498
  409    HA   GLU  57           HA       GLU  57   0.993 -17.701  -9.859
  410   1HB   GLU  57          1HB       GLU  57   3.189 -17.127  -8.882
  411   2HB   GLU  57          2HB       GLU  57   3.804 -16.667 -10.455
  412   1HG   GLU  57          1HG       GLU  57   2.743 -19.488 -10.370
  413   2HG   GLU  57          2HG       GLU  57   4.210 -18.866 -11.117
  414    H    LEU  58           H        LEU  58   2.190 -14.993 -11.819
  415    HA   LEU  58           HA       LEU  58   1.769 -12.899  -9.789
  416   1HB   LEU  58          1HB       LEU  58   2.696 -13.049 -12.630
  417   2HB   LEU  58          2HB       LEU  58   1.874 -11.553 -12.233
  418    HG   LEU  58           HG       LEU  58   4.182 -11.113 -11.835
  419   1HD1  LEU  58          1HD1      LEU  58   4.493 -13.661 -10.115
  420   2HD1  LEU  58          2HD1      LEU  58   4.955 -13.579 -11.821
  421   3HD1  LEU  58          3HD1      LEU  58   5.783 -12.546 -10.631
  422   1HD2  LEU  58          1HD2      LEU  58   4.347 -10.609  -9.426
  423   2HD2  LEU  58          2HD2      LEU  58   2.657 -10.374  -9.937
  424   3HD2  LEU  58          3HD2      LEU  58   3.111 -11.832  -9.035
  425    H    ASP  59           H        ASP  59  -0.159 -14.342 -12.339
  426    HA   ASP  59           HA       ASP  59  -2.172 -12.445 -12.943
  427   1HB   ASP  59          1HB       ASP  59  -2.559 -15.475 -12.625
  428   2HB   ASP  59          2HB       ASP  59  -2.075 -14.626 -14.075
  429    H    ALA  60           H        ALA  60  -1.779 -14.363 -10.023
  430    HA   ALA  60           HA       ALA  60  -4.403 -13.738  -8.789
  431   1HB   ALA  60          1HB       ALA  60  -3.447 -14.784  -6.741
  432   2HB   ALA  60          2HB       ALA  60  -3.162 -15.788  -8.176
  433   3HB   ALA  60          3HB       ALA  60  -1.829 -14.830  -7.482
  434    H    ILE  61           H        ILE  61  -1.068 -12.559  -8.337
  435    HA   ILE  61           HA       ILE  61  -1.390 -10.643  -6.235
  436    HB   ILE  61           HB       ILE  61   0.613 -11.100  -8.336
  437   1HG1  ILE  61          1HG1      ILE  61   1.833 -11.481  -6.459
  438   2HG1  ILE  61          2HG1      ILE  61   0.479 -10.984  -5.467
  439   1HG2  ILE  61          1HG2      ILE  61   1.682  -8.827  -8.339
  440   2HG2  ILE  61          2HG2      ILE  61   0.082  -8.761  -9.077
  441   3HG2  ILE  61          3HG2      ILE  61   0.311  -8.161  -7.418
  442   1HD1  ILE  61          1HD1      ILE  61   1.250  -8.628  -5.384
  443   2HD1  ILE  61          2HD1      ILE  61   2.546  -9.732  -4.875
  444   3HD1  ILE  61          3HD1      ILE  61   2.594  -9.005  -6.497
  445    H    ILE  62           H        ILE  62  -2.175 -10.434  -9.674
  446    HA   ILE  62           HA       ILE  62  -2.939  -7.533  -9.615
  447    HB   ILE  62           HB       ILE  62  -3.265  -9.616 -11.836
  448   1HG1  ILE  62          1HG1      ILE  62  -0.973  -9.324 -11.941
  449   2HG1  ILE  62          2HG1      ILE  62  -0.997  -7.836 -11.019
  450   1HG2  ILE  62          1HG2      ILE  62  -3.750  -7.700 -13.384
  451   2HG2  ILE  62          2HG2      ILE  62  -4.977  -7.792 -12.123
  452   3HG2  ILE  62          3HG2      ILE  62  -3.701  -6.558 -12.018
  453   1HD1  ILE  62          1HD1      ILE  62  -1.596  -6.473 -13.002
  454   2HD1  ILE  62          2HD1      ILE  62  -0.157  -7.460 -13.332
  455   3HD1  ILE  62          3HD1      ILE  62  -1.731  -7.946 -14.003
  456    H    GLU  63           H        GLU  63  -4.468 -10.717  -9.522
  457    HA   GLU  63           HA       GLU  63  -7.240 -10.167  -9.789
  458   1HB   GLU  63          1HB       GLU  63  -6.209 -12.059  -7.620
  459   2HB   GLU  63          2HB       GLU  63  -6.069 -12.437  -9.326
  460   1HG   GLU  63          1HG       GLU  63  -8.850 -11.651  -8.746
  461   2HG   GLU  63          2HG       GLU  63  -8.238 -13.148  -9.429
  462    H    GLU  64           H        GLU  64  -5.084  -9.503  -7.081
  463    HA   GLU  64           HA       GLU  64  -7.211  -8.506  -5.234
  464   1HB   GLU  64          1HB       GLU  64  -4.660  -7.595  -4.309
  465   2HB   GLU  64          2HB       GLU  64  -4.365  -9.167  -5.027
  466   1HG   GLU  64          1HG       GLU  64  -4.910  -9.912  -2.911
  467   2HG   GLU  64          2HG       GLU  64  -6.552  -9.850  -3.529
  468    H    VAL  65           H        VAL  65  -4.611  -7.097  -7.225
  469    HA   VAL  65           HA       VAL  65  -5.706  -4.284  -6.752
  470    HB   VAL  65           HB       VAL  65  -3.407  -3.648  -7.917
  471   1HG1  VAL  65          1HG1      VAL  65  -2.352  -3.431  -5.660
  472   2HG1  VAL  65          2HG1      VAL  65  -4.066  -2.978  -5.601
  473   3HG1  VAL  65          3HG1      VAL  65  -3.544  -4.556  -4.963
  474   1HG2  VAL  65          1HG2      VAL  65  -2.646  -6.408  -6.736
  475   2HG2  VAL  65          2HG2      VAL  65  -2.575  -5.943  -8.453
  476   3HG2  VAL  65          3HG2      VAL  65  -1.503  -5.158  -7.284
  477    H    ASP  66           H        ASP  66  -7.401  -5.414  -8.256
  478    HA   ASP  66           HA       ASP  66  -7.242  -4.096 -10.910
  479   1HB   ASP  66          1HB       ASP  66  -5.808  -6.242 -11.215
  480   2HB   ASP  66          2HB       ASP  66  -7.294  -7.153 -11.073
  481    H    GLU  67           H        GLU  67  -8.975  -3.461  -9.234
  482    HA   GLU  67           HA       GLU  67 -11.478  -5.142  -9.196
  483   1HB   GLU  67          1HB       GLU  67 -10.394  -3.478  -7.332
  484   2HB   GLU  67          2HB       GLU  67 -11.473  -2.327  -8.099
  485   1HG   GLU  67          1HG       GLU  67 -12.143  -4.809  -6.469
  486   2HG   GLU  67          2HG       GLU  67 -13.272  -4.372  -7.740
  487    H    ASP  68           H        ASP  68 -10.597  -4.346 -11.781
  488    HA   ASP  68           HA       ASP  68 -12.926  -2.639 -12.736
  489   1HB   ASP  68          1HB       ASP  68 -11.749  -0.992 -13.785
  490   2HB   ASP  68          2HB       ASP  68 -10.616  -1.312 -12.491
  491    H    GLY  69           H        GLY  69 -10.101  -4.624 -13.674
  492   1HA   GLY  69          1HA       GLY  69 -11.884  -6.277 -15.546
  493   2HA   GLY  69          2HA       GLY  69 -10.372  -6.851 -14.828
  494    H    SER  70           H        SER  70  -8.495  -6.547 -15.828
  495    HA   SER  70           HA       SER  70  -8.420  -5.637 -18.677
  496   1HB   SER  70          1HB       SER  70  -8.306  -3.419 -17.859
  497   2HB   SER  70          2HB       SER  70  -6.635  -3.838 -18.244
  498    HG   SER  70           HG       SER  70  -6.189  -4.093 -16.131
  499    H    GLY  71           H        GLY  71  -6.479  -6.248 -15.734
  500   1HA   GLY  71          1HA       GLY  71  -4.998  -8.297 -15.518
  501   2HA   GLY  71          2HA       GLY  71  -4.760  -8.256 -17.271
  502    H    THR  72           H        THR  72  -4.403  -5.371 -17.390
  503    HA   THR  72           HA       THR  72  -1.467  -5.278 -16.631
  504    HB   THR  72           HB       THR  72  -1.428  -3.204 -18.158
  505    HG1  THR  72           HG1      THR  72  -3.161  -3.405 -19.757
  506   1HG2  THR  72          1HG2      THR  72  -1.293  -4.465 -20.268
  507   2HG2  THR  72          2HG2      THR  72  -0.521  -5.416 -18.980
  508   3HG2  THR  72          3HG2      THR  72  -2.145  -5.860 -19.568
  509    H    ILE  73           H        ILE  73  -0.630  -3.097 -15.970
  510    HA   ILE  73           HA       ILE  73  -2.485  -1.687 -13.972
  511    HB   ILE  73           HB       ILE  73   0.406  -2.569 -13.542
  512   1HG1  ILE  73          1HG1      ILE  73  -1.783  -4.032 -12.937
  513   2HG1  ILE  73          2HG1      ILE  73  -1.885  -2.962 -11.556
  514   1HG2  ILE  73          1HG2      ILE  73   0.490  -1.228 -11.444
  515   2HG2  ILE  73          2HG2      ILE  73   0.199  -0.154 -12.819
  516   3HG2  ILE  73          3HG2      ILE  73  -1.144  -0.586 -11.732
  517   1HD1  ILE  73          1HD1      ILE  73   0.354  -3.628 -10.724
  518   2HD1  ILE  73          2HD1      ILE  73  -0.675  -5.053 -10.983
  519   3HD1  ILE  73          3HD1      ILE  73   0.604  -4.662 -12.158
  520    H    ASP  74           H        ASP  74  -2.979  -0.092 -15.402
  521    HA   ASP  74           HA       ASP  74  -0.942   1.426 -16.963
  522   1HB   ASP  74          1HB       ASP  74  -3.673   2.645 -16.595
  523   2HB   ASP  74          2HB       ASP  74  -2.661   2.545 -18.017
  524    H    PHE  75           H        PHE  75  -0.920   3.868 -16.759
  525    HA   PHE  75           HA       PHE  75   0.204   4.715 -14.199
  526   1HB   PHE  75          1HB       PHE  75   0.492   5.771 -16.604
  527   2HB   PHE  75          2HB       PHE  75  -0.955   6.677 -16.250
  528    HD1  PHE  75           HD1      PHE  75   0.877   6.061 -13.187
  529    HD2  PHE  75           HD2      PHE  75   0.806   8.625 -16.643
  530    HE1  PHE  75           HE1      PHE  75   2.138   7.776 -11.954
  531    HE2  PHE  75           HE2      PHE  75   2.075  10.325 -15.392
  532    HZ   PHE  75           HZ       PHE  75   2.725   9.914 -13.046
  533    H    GLU  76           H        GLU  76  -3.050   4.663 -15.503
  534    HA   GLU  76           HA       GLU  76  -4.205   6.382 -13.281
  535   1HB   GLU  76          1HB       GLU  76  -4.956   5.795 -16.035
  536   2HB   GLU  76          2HB       GLU  76  -5.367   7.135 -14.990
  537   1HG   GLU  76          1HG       GLU  76  -6.957   4.609 -15.569
  538   2HG   GLU  76          2HG       GLU  76  -7.170   5.345 -13.995
  539    H    GLU  77           H        GLU  77  -2.987   4.142 -12.375
  540    HA   GLU  77           HA       GLU  77  -5.170   2.675 -10.936
  541   1HB   GLU  77          1HB       GLU  77  -4.887   1.412 -13.139
  542   2HB   GLU  77          2HB       GLU  77  -3.265   0.998 -12.634
  543   1HG   GLU  77          1HG       GLU  77  -5.613   0.297 -10.796
  544   2HG   GLU  77          2HG       GLU  77  -4.023  -0.454 -10.869
  545    H    PHE  78           H        PHE  78  -1.715   2.857 -11.753
  546    HA   PHE  78           HA       PHE  78  -0.574   1.662  -9.384
  547   1HB   PHE  78          1HB       PHE  78   0.720   2.249 -11.477
  548   2HB   PHE  78          2HB       PHE  78   0.628   3.946 -11.080
  549    HD1  PHE  78           HD1      PHE  78   1.109   1.448  -8.333
  550    HD2  PHE  78           HD2      PHE  78   3.140   4.046 -11.096
  551    HE1  PHE  78           HE1      PHE  78   3.201   1.181  -7.063
  552    HE2  PHE  78           HE2      PHE  78   5.224   3.760  -9.819
  553    HZ   PHE  78           HZ       PHE  78   5.263   2.321  -7.811
  554    H    LEU  79           H        LEU  79  -1.603   4.984 -10.074
  555    HA   LEU  79           HA       LEU  79  -0.662   6.243  -7.589
  556   1HB   LEU  79          1HB       LEU  79  -2.059   8.168  -8.181
  557   2HB   LEU  79          2HB       LEU  79  -3.023   7.221  -9.293
  558    HG   LEU  79           HG       LEU  79  -1.006   6.930 -10.804
  559   1HD1  LEU  79          1HD1      LEU  79  -1.034   9.257 -11.706
  560   2HD1  LEU  79          2HD1      LEU  79  -2.667   8.749 -11.238
  561   3HD1  LEU  79          3HD1      LEU  79  -1.753   9.864 -10.192
  562   1HD2  LEU  79          1HD2      LEU  79   0.389   8.906  -8.875
  563   2HD2  LEU  79          2HD2      LEU  79   0.861   7.213  -9.166
  564   3HD2  LEU  79          3HD2      LEU  79   1.007   8.402 -10.468
  565    H    VAL  80           H        VAL  80  -3.627   4.598  -8.552
  566    HA   VAL  80           HA       VAL  80  -5.326   5.247  -6.268
  567    HB   VAL  80           HB       VAL  80  -5.500   2.610  -7.800
  568   1HG1  VAL  80          1HG1      VAL  80  -6.832   5.240  -8.698
  569   2HG1  VAL  80          2HG1      VAL  80  -5.337   4.623  -9.414
  570   3HG1  VAL  80          3HG1      VAL  80  -6.833   3.668  -9.540
  571   1HG2  VAL  80          1HG2      VAL  80  -7.904   2.686  -7.329
  572   2HG2  VAL  80          2HG2      VAL  80  -7.064   2.915  -5.777
  573   3HG2  VAL  80          3HG2      VAL  80  -7.781   4.307  -6.602
  574    H    MET  81           H        MET  81  -2.892   2.744  -6.864
  575    HA   MET  81           HA       MET  81  -3.248   1.100  -4.449
  576   1HB   MET  81          1HB       MET  81  -1.819   0.578  -6.602
  577   2HB   MET  81          2HB       MET  81  -0.547   1.499  -5.821
  578   1HG   MET  81          1HG       MET  81  -1.708  -0.575  -4.001
  579   2HG   MET  81          2HG       MET  81  -1.007  -1.247  -5.482
  580   1HE   MET  81          1HE       MET  81   1.438  -1.268  -6.155
  581   2HE   MET  81          2HE       MET  81   2.657  -1.300  -4.846
  582   3HE   MET  81          3HE       MET  81   1.243  -2.389  -4.771
  583    H    MET  82           H        MET  82  -0.714   3.514  -5.195
  584    HA   MET  82           HA       MET  82   0.502   3.670  -2.589
  585   1HB   MET  82          1HB       MET  82   1.012   6.198  -3.459
  586   2HB   MET  82          2HB       MET  82   0.449   5.527  -4.978
  587   1HG   MET  82          1HG       MET  82   2.756   5.103  -5.125
  588   2HG   MET  82          2HG       MET  82   2.183   3.556  -4.488
  589   1HE   MET  82          1HE       MET  82   3.039   2.409  -2.770
  590   2HE   MET  82          2HE       MET  82   2.306   3.187  -1.336
  591   3HE   MET  82          3HE       MET  82   4.078   2.964  -1.419
  592    H    VAL  83           H        VAL  83  -2.412   5.175  -3.839
  593    HA   VAL  83           HA       VAL  83  -2.728   7.315  -1.851
  594    HB   VAL  83           HB       VAL  83  -4.076   6.587  -4.217
  595   1HG1  VAL  83          1HG1      VAL  83  -6.508   6.638  -3.639
  596   2HG1  VAL  83          2HG1      VAL  83  -5.737   5.197  -2.961
  597   3HG1  VAL  83          3HG1      VAL  83  -6.119   6.573  -1.900
  598   1HG2  VAL  83          1HG2      VAL  83  -4.805   8.864  -2.257
  599   2HG2  VAL  83          2HG2      VAL  83  -3.577   8.953  -3.542
  600   3HG2  VAL  83          3HG2      VAL  83  -5.284   8.765  -3.971
  601    NH1  ARG  84           NH1      ARG  84  -5.265  -1.436  -1.191
  602    NH2  ARG  84           NH2      ARG  84  -6.941  -2.734  -2.008
  603    H    ARG  84           H        ARG  84  -4.024   4.009  -2.152
  604    HA   ARG  84           HA       ARG  84  -5.835   3.930   0.113
  605   1HB   ARG  84          1HB       ARG  84  -4.347   1.810  -1.469
  606   2HB   ARG  84          2HB       ARG  84  -4.999   1.344   0.095
  607   1HG   ARG  84          1HG       ARG  84  -7.221   1.530  -0.552
  608   2HG   ARG  84          2HG       ARG  84  -6.924   2.850  -1.686
  609   1HD   ARG  84          1HD       ARG  84  -7.090   1.312  -3.364
  610   2HD   ARG  84          2HD       ARG  84  -5.494   0.727  -2.890
  611    HE   ARG  84           HE       ARG  84  -8.154  -0.530  -2.088
  612   1HH1  ARG  84          1HH1      ARG  84  -7.861  -2.780  -2.460
  613   2HH1  ARG  84          2HH1      ARG  84  -6.368  -3.527  -1.698
  614   1HH2  ARG  84          1HH2      ARG  84  -4.866  -0.496  -1.097
  615   2HH2  ARG  84          2HH2      ARG  84  -4.848  -2.317  -0.868
  616    H    GLN  85           H        GLN  85  -2.330   3.596  -0.096
  617    HA   GLN  85           HA       GLN  85  -1.954   2.742   2.759
  618   1HB   GLN  85          1HB       GLN  85   0.570   3.309   2.068
  619   2HB   GLN  85          2HB       GLN  85  -0.082   3.342   0.440
  620   1HG   GLN  85          1HG       GLN  85   0.249   1.108   0.356
  621   2HG   GLN  85          2HG       GLN  85  -1.141   0.925   1.403
  622   1HE2  GLN  85          1HE2      GLN  85   2.541   0.861   3.370
  623   2HE2  GLN  85          2HE2      GLN  85   2.242   2.046   2.002
  624    H    MET  86           H        MET  86  -1.821   5.683   0.828
  625    HA   MET  86           HA       MET  86  -0.350   7.481   2.530
  626   1HB   MET  86          1HB       MET  86  -2.068   7.778   0.186
  627   2HB   MET  86          2HB       MET  86  -2.485   9.022   1.350
  628   1HG   MET  86          1HG       MET  86  -0.072   8.807  -0.357
  629   2HG   MET  86          2HG       MET  86   0.363   9.087   1.337
  630   1HE   MET  86          1HE       MET  86  -2.694  10.207  -1.083
  631   2HE   MET  86          2HE       MET  86  -2.214  11.909  -1.348
  632   3HE   MET  86          3HE       MET  86  -1.171  10.587  -1.947
  633    H    LYS  87           H        LYS  87  -3.853   6.791   2.451
  634    HA   LYS  87           HA       LYS  87  -4.767   8.677   4.473
  635   1HB   LYS  87          1HB       LYS  87  -6.830   7.501   4.580
  636   2HB   LYS  87          2HB       LYS  87  -6.275   7.306   2.924
  637   1HG   LYS  87          1HG       LYS  87  -5.778   5.146   5.044
  638   2HG   LYS  87          2HG       LYS  87  -5.563   4.989   3.308
  639   1HD   LYS  87          1HD       LYS  87  -8.104   4.944   4.970
  640   2HD   LYS  87          2HD       LYS  87  -8.223   5.681   3.376
  641   1HE   LYS  87          1HE       LYS  87  -7.803   3.643   2.214
  642   2HE   LYS  87          2HE       LYS  87  -6.894   2.929   3.553
  643   1HZ   LYS  87          1HZ       LYS  87  -9.665   3.515   4.185
  644   2HZ   LYS  87          2HZ       LYS  87  -8.775   2.156   4.487
  645   3HZ   LYS  87          3HZ       LYS  87  -9.463   2.380   3.002
  646    H    GLU  88           H        GLU  88  -3.451   5.396   4.696
  647    HA   GLU  88           HA       GLU  88  -3.882   4.897   7.540
  648   1HB   GLU  88          1HB       GLU  88  -3.274   3.153   5.824
  649   2HB   GLU  88          2HB       GLU  88  -1.633   3.768   5.785
  650   1HG   GLU  88          1HG       GLU  88  -1.304   3.144   8.194
  651   2HG   GLU  88          2HG       GLU  88  -2.985   2.657   8.329
  652    H    ASP  89           H        ASP  89  -1.175   6.323   5.719
  653    HA   ASP  89           HA       ASP  89   0.530   7.903   6.372
  654   1HB   ASP  89          1HB       ASP  89  -1.443   8.637   8.092
  655   2HB   ASP  89          2HB       ASP  89  -0.338   7.967   9.270
  656    H    ALA  90           H        ALA  90   1.947   7.930   8.796
  657    HA   ALA  90           HA       ALA  90   2.812   5.470  10.012
  658   1HB   ALA  90          1HB       ALA  90   4.743   4.732   8.592
  659   2HB   ALA  90          2HB       ALA  90   3.213   4.569   7.706
  660   3HB   ALA  90          3HB       ALA  90   4.312   5.920   7.336
   
  Start of MODEL          28
 Raw file had  660 H/Q atoms
  Start of MODEL   28
    1   1H    ALA   1          1H        ALA   1 -24.840  10.600 -16.311
    2   2H    ALA   1          2H        ALA   1 -23.820  11.836 -15.801
    3   3H    ALA   1          3H        ALA   1 -24.230  11.702 -17.426
    4    HA   ALA   1           HA       ALA   1 -22.962   9.852 -17.796
    5   1HB   ALA   1          1HB       ALA   1 -21.115  11.204 -15.791
    6   2HB   ALA   1          2HB       ALA   1 -21.757  12.186 -17.121
    7   3HB   ALA   1          3HB       ALA   1 -20.793  10.729 -17.476
    8    H    SER   2           H        SER   2 -22.068   7.936 -17.079
    9    HA   SER   2           HA       SER   2 -22.186   7.208 -14.108
   10   1HB   SER   2          1HB       SER   2 -23.146   5.048 -15.942
   11   2HB   SER   2          2HB       SER   2 -23.693   5.509 -14.328
   12    HG   SER   2           HG       SER   2 -24.815   7.211 -15.205
   13    H    MET   3           H        MET   3 -19.915   7.896 -15.544
   14    HA   MET   3           HA       MET   3 -18.471   5.434 -16.528
   15   1HB   MET   3          1HB       MET   3 -17.779   8.392 -16.371
   16   2HB   MET   3          2HB       MET   3 -16.476   7.226 -16.515
   17   1HG   MET   3          1HG       MET   3 -18.687   6.763 -18.495
   18   2HG   MET   3          2HG       MET   3 -17.914   8.348 -18.638
   19   1HE   MET   3          1HE       MET   3 -16.671   8.411 -20.631
   20   2HE   MET   3          2HE       MET   3 -17.223   6.855 -21.318
   21   3HE   MET   3          3HE       MET   3 -15.476   7.224 -21.245
   22    H    THR   4           H        THR   4 -16.317   4.967 -15.559
   23    HA   THR   4           HA       THR   4 -16.591   4.410 -12.657
   24    HB   THR   4           HB       THR   4 -13.980   3.852 -14.009
   25    HG1  THR   4           HG1      THR   4 -16.446   2.631 -14.631
   26   1HG2  THR   4          1HG2      THR   4 -15.704   2.422 -11.948
   27   2HG2  THR   4          2HG2      THR   4 -13.949   2.709 -11.950
   28   3HG2  THR   4          3HG2      THR   4 -14.651   1.448 -12.997
   29    H    ASP   5           H        ASP   5 -16.556   6.274 -11.519
   30    HA   ASP   5           HA       ASP   5 -14.328   8.291 -11.751
   31   1HB   ASP   5          1HB       ASP   5 -16.848   8.818 -11.203
   32   2HB   ASP   5          2HB       ASP   5 -16.475   8.302  -9.574
   33    H    GLN   6           H        GLN   6 -13.621   5.565 -11.051
   34    HA   GLN   6           HA       GLN   6 -12.694   5.628  -8.169
   35   1HB   GLN   6          1HB       GLN   6 -12.535   3.577 -10.415
   36   2HB   GLN   6          2HB       GLN   6 -13.297   3.453  -8.840
   37   1HG   GLN   6          1HG       GLN   6 -11.136   3.227  -7.697
   38   2HG   GLN   6          2HG       GLN   6 -10.242   3.646  -9.141
   39   1HE2  GLN   6          1HE2      GLN   6  -9.907   0.170  -9.883
   40   2HE2  GLN   6          2HE2      GLN   6  -9.181   1.852  -9.784
   41    H    GLN   7           H        GLN   7 -11.263   5.550 -11.445
   42    HA   GLN   7           HA       GLN   7  -8.456   5.995 -10.541
   43   1HB   GLN   7          1HB       GLN   7  -7.815   5.963 -12.845
   44   2HB   GLN   7          2HB       GLN   7  -9.378   6.556 -13.388
   45   1HG   GLN   7          1HG       GLN   7  -8.683   3.991 -13.727
   46   2HG   GLN   7          2HG       GLN   7  -9.283   3.796 -12.087
   47   1HE2  GLN   7          1HE2      GLN   7 -11.987   4.919 -15.079
   48   2HE2  GLN   7          2HE2      GLN   7 -10.220   5.401 -15.187
   49    H    ALA   8           H        ALA   8 -11.107   7.972 -11.807
   50    HA   ALA   8           HA       ALA   8  -9.631  10.489 -12.266
   51   1HB   ALA   8          1HB       ALA   8 -11.882  11.547 -12.358
   52   2HB   ALA   8          2HB       ALA   8 -11.823  10.067 -13.333
   53   3HB   ALA   8          3HB       ALA   8 -12.643  10.057 -11.751
   54    H    GLU   9           H        GLU   9 -11.199   8.969  -9.504
   55    HA   GLU   9           HA       GLU   9 -11.350  11.285  -7.702
   56   1HB   GLU   9          1HB       GLU   9 -11.887   8.376  -7.470
   57   2HB   GLU   9          2HB       GLU   9 -11.098   8.998  -6.027
   58   1HG   GLU   9          1HG       GLU   9 -13.133  10.947  -6.600
   59   2HG   GLU   9          2HG       GLU   9 -13.892   9.387  -6.896
   60    H    ALA  10           H        ALA  10  -8.895   8.812  -8.308
   61    HA   ALA  10           HA       ALA  10  -7.137   9.479  -6.014
   62   1HB   ALA  10          1HB       ALA  10  -5.510   7.930  -7.086
   63   2HB   ALA  10          2HB       ALA  10  -7.130   7.212  -7.007
   64   3HB   ALA  10          3HB       ALA  10  -6.512   7.844  -8.554
   65    NH1  ARG  11           NH1      ARG  11  -4.953  13.100 -15.633
   66    NH2  ARG  11           NH2      ARG  11  -6.745  14.448 -15.994
   67    H    ARG  11           H        ARG  11  -7.383  10.439  -9.393
   68    HA   ARG  11           HA       ARG  11  -4.719  11.746  -9.677
   69   1HB   ARG  11          1HB       ARG  11  -6.564  10.892 -11.518
   70   2HB   ARG  11          2HB       ARG  11  -7.029  12.585 -11.436
   71   1HG   ARG  11          1HG       ARG  11  -4.068  12.172 -11.704
   72   2HG   ARG  11          2HG       ARG  11  -5.014  11.585 -13.074
   73   1HD   ARG  11          1HD       ARG  11  -5.452  14.405 -11.923
   74   2HD   ARG  11          2HD       ARG  11  -4.207  14.096 -13.134
   75    HE   ARG  11           HE       ARG  11  -7.208  13.931 -13.578
   76   1HH1  ARG  11          1HH1      ARG  11  -7.505  15.006 -15.590
   77   2HH1  ARG  11          2HH1      ARG  11  -6.525  14.339 -16.990
   78   1HH2  ARG  11          1HH2      ARG  11  -4.326  12.656 -14.953
   79   2HH2  ARG  11          2HH2      ARG  11  -4.882  13.054 -16.656
   80    H    ALA  12           H        ALA  12  -7.991  12.741  -8.796
   81    HA   ALA  12           HA       ALA  12  -7.537  15.677  -8.727
   82   1HB   ALA  12          1HB       ALA  12  -9.710  15.779  -7.523
   83   2HB   ALA  12          2HB       ALA  12  -9.822  14.754  -8.967
   84   3HB   ALA  12          3HB       ALA  12  -9.735  14.007  -7.352
   85    H    PHE  13           H        PHE  13  -7.162  12.982  -6.488
   86    HA   PHE  13           HA       PHE  13  -6.944  14.332  -3.957
   87   1HB   PHE  13          1HB       PHE  13  -5.367  11.825  -4.766
   88   2HB   PHE  13          2HB       PHE  13  -7.074  11.806  -4.411
   89    HD1  PHE  13           HD1      PHE  13  -7.440  13.397  -1.976
   90    HD2  PHE  13           HD2      PHE  13  -4.061  10.947  -3.030
   91    HE1  PHE  13           HE1      PHE  13  -6.870  13.138   0.404
   92    HE2  PHE  13           HE2      PHE  13  -3.510  10.699  -0.646
   93    HZ   PHE  13           HZ       PHE  13  -4.906  11.795   1.074
   94    H    LEU  14           H        LEU  14  -4.403  13.470  -6.316
   95    HA   LEU  14           HA       LEU  14  -2.348  15.222  -4.876
   96   1HB   LEU  14          1HB       LEU  14  -0.813  13.664  -5.375
   97   2HB   LEU  14          2HB       LEU  14  -1.144  13.808  -7.087
   98    HG   LEU  14           HG       LEU  14  -3.014  12.062  -5.431
   99   1HD1  LEU  14          1HD1      LEU  14  -0.256  11.070  -6.387
  100   2HD1  LEU  14          2HD1      LEU  14  -0.651  11.448  -4.701
  101   3HD1  LEU  14          3HD1      LEU  14  -1.498  10.120  -5.532
  102   1HD2  LEU  14          1HD2      LEU  14  -3.222  10.751  -7.504
  103   2HD2  LEU  14          2HD2      LEU  14  -3.395  12.468  -7.945
  104   3HD2  LEU  14          3HD2      LEU  14  -1.871  11.628  -8.266
  105    H    SER  15           H        SER  15  -0.817  16.319  -6.442
  106    HA   SER  15           HA       SER  15  -2.427  17.909  -8.486
  107   1HB   SER  15          1HB       SER  15  -1.071  19.748  -8.057
  108   2HB   SER  15          2HB       SER  15   0.336  18.782  -7.606
  109    HG   SER  15           HG       SER  15  -1.658  19.755  -6.087
  110    H    GLU  16           H        GLU  16  -0.249  18.928  -9.916
  111    HA   GLU  16           HA       GLU  16   0.225  16.725 -11.899
  112   1HB   GLU  16          1HB       GLU  16   0.953  19.698 -11.947
  113   2HB   GLU  16          2HB       GLU  16  -0.410  18.931 -12.737
  114   1HG   GLU  16          1HG       GLU  16   1.502  17.516 -14.020
  115   2HG   GLU  16          2HG       GLU  16   2.552  18.821 -13.496
  116    H    GLU  17           H        GLU  17   1.990  18.596  -9.511
  117    HA   GLU  17           HA       GLU  17   4.737  17.842 -10.356
  118   1HB   GLU  17          1HB       GLU  17   3.771  18.999  -7.691
  119   2HB   GLU  17          2HB       GLU  17   4.377  19.900  -9.067
  120   1HG   GLU  17          1HG       GLU  17   6.012  17.949  -7.318
  121   2HG   GLU  17          2HG       GLU  17   6.649  18.723  -8.759
  122    H    MET  18           H        MET  18   2.325  16.563  -8.125
  123    HA   MET  18           HA       MET  18   3.991  14.510  -6.808
  124   1HB   MET  18          1HB       MET  18   1.003  15.034  -6.949
  125   2HB   MET  18          2HB       MET  18   1.533  13.430  -6.478
  126   1HG   MET  18          1HG       MET  18   1.115  14.985  -4.515
  127   2HG   MET  18          2HG       MET  18   2.739  14.276  -4.520
  128   1HE   MET  18          1HE       MET  18   2.792  16.526  -2.643
  129   2HE   MET  18          2HE       MET  18   2.747  18.210  -3.242
  130   3HE   MET  18          3HE       MET  18   1.266  17.209  -3.288
  131    H    ILE  19           H        ILE  19   1.990  14.643  -9.712
  132    HA   ILE  19           HA       ILE  19   1.849  11.766 -10.299
  133    HB   ILE  19           HB       ILE  19   1.357  14.246 -11.983
  134   1HG1  ILE  19          1HG1      ILE  19  -0.343  12.125 -10.629
  135   2HG1  ILE  19          2HG1      ILE  19  -0.582  13.856 -10.724
  136   1HG2  ILE  19          1HG2      ILE  19   0.696  12.835 -13.948
  137   2HG2  ILE  19          2HG2      ILE  19   2.408  12.616 -13.590
  138   3HG2  ILE  19          3HG2      ILE  19   1.242  11.365 -13.104
  139   1HD1  ILE  19          1HD1      ILE  19  -1.187  11.899 -13.019
  140   2HD1  ILE  19          2HD1      ILE  19  -2.348  12.778 -12.004
  141   3HD1  ILE  19          3HD1      ILE  19  -1.312  13.676 -13.137
  142    H    ALA  20           H        ALA  20   4.133  14.361 -11.030
  143    HA   ALA  20           HA       ALA  20   5.815  12.995 -12.987
  144   1HB   ALA  20          1HB       ALA  20   7.490  14.776 -12.505
  145   2HB   ALA  20          2HB       ALA  20   5.861  15.452 -12.702
  146   3HB   ALA  20          3HB       ALA  20   6.570  15.295 -11.074
  147    H    GLU  21           H        GLU  21   5.840  13.123  -9.453
  148    HA   GLU  21           HA       GLU  21   8.423  11.944  -8.826
  149   1HB   GLU  21          1HB       GLU  21   6.598  12.989  -7.248
  150   2HB   GLU  21          2HB       GLU  21   5.927  11.372  -7.166
  151   1HG   GLU  21          1HG       GLU  21   7.940  10.478  -6.099
  152   2HG   GLU  21          2HG       GLU  21   8.884  11.903  -6.498
  153    H    PHE  22           H        PHE  22   5.311  10.559  -9.756
  154    HA   PHE  22           HA       PHE  22   6.211   7.698  -9.397
  155   1HB   PHE  22          1HB       PHE  22   3.519   8.639 -10.546
  156   2HB   PHE  22          2HB       PHE  22   3.926   7.056  -9.942
  157    HD1  PHE  22           HD1      PHE  22   1.819   9.443  -9.045
  158    HD2  PHE  22           HD2      PHE  22   5.359   7.670  -7.354
  159    HE1  PHE  22           HE1      PHE  22   1.088  10.104  -6.792
  160    HE2  PHE  22           HE2      PHE  22   4.608   8.339  -5.108
  161    HZ   PHE  22           HZ       PHE  22   2.485   9.572  -4.824
  162    H    LYS  23           H        LYS  23   5.923  10.102 -11.899
  163    HA   LYS  23           HA       LYS  23   5.717   8.537 -14.332
  164   1HB   LYS  23          1HB       LYS  23   6.860  11.265 -13.681
  165   2HB   LYS  23          2HB       LYS  23   7.401  10.534 -15.176
  166   1HG   LYS  23          1HG       LYS  23   4.499  11.203 -14.409
  167   2HG   LYS  23          2HG       LYS  23   4.912  10.218 -15.803
  168   1HD   LYS  23          1HD       LYS  23   5.016  13.158 -15.513
  169   2HD   LYS  23          2HD       LYS  23   4.966  12.177 -16.982
  170   1HE   LYS  23          1HE       LYS  23   7.085  13.607 -16.743
  171   2HE   LYS  23          2HE       LYS  23   7.547  12.638 -15.337
  172   1HZ   LYS  23          1HZ       LYS  23   7.122  10.696 -17.099
  173   2HZ   LYS  23          2HZ       LYS  23   8.580  11.461 -16.962
  174   3HZ   LYS  23          3HZ       LYS  23   7.530  11.893 -18.162
  175    H    ALA  24           H        ALA  24   8.622   9.610 -12.542
  176    HA   ALA  24           HA       ALA  24  10.700   8.583 -14.218
  177   1HB   ALA  24          1HB       ALA  24  12.159   8.589 -12.204
  178   2HB   ALA  24          2HB       ALA  24  11.157  10.050 -12.276
  179   3HB   ALA  24          3HB       ALA  24  10.741   8.743 -11.139
  180    H    ALA  25           H        ALA  25   9.501   6.968 -11.252
  181    HA   ALA  25           HA       ALA  25  10.835   4.402 -11.633
  182   1HB   ALA  25          1HB       ALA  25   9.309   3.558  -9.858
  183   2HB   ALA  25          2HB       ALA  25   9.983   5.141  -9.426
  184   3HB   ALA  25          3HB       ALA  25   8.296   5.016  -9.989
  185    H    PHE  26           H        PHE  26   7.839   5.724 -12.864
  186    HA   PHE  26           HA       PHE  26   6.251   3.411 -13.463
  187   1HB   PHE  26          1HB       PHE  26   5.504   5.810 -13.817
  188   2HB   PHE  26          2HB       PHE  26   6.444   5.886 -15.284
  189    HD1  PHE  26           HD1      PHE  26   3.195   5.444 -14.106
  190    HD2  PHE  26           HD2      PHE  26   5.903   3.591 -16.887
  191    HE1  PHE  26           HE1      PHE  26   1.291   4.487 -15.340
  192    HE2  PHE  26           HE2      PHE  26   3.987   2.642 -18.108
  193    HZ   PHE  26           HZ       PHE  26   1.682   3.093 -17.343
  194    H    ASP  27           H        ASP  27   8.702   5.001 -15.526
  195    HA   ASP  27           HA       ASP  27   8.571   3.180 -17.805
  196   1HB   ASP  27          1HB       ASP  27  10.448   4.249 -18.717
  197   2HB   ASP  27          2HB       ASP  27  11.208   4.530 -17.167
  198    H    MET  28           H        MET  28  10.331   3.114 -14.761
  199    HA   MET  28           HA       MET  28  12.223   0.955 -15.280
  200   1HB   MET  28          1HB       MET  28  11.787   2.551 -13.073
  201   2HB   MET  28          2HB       MET  28  11.071   1.054 -12.503
  202   1HG   MET  28          1HG       MET  28  13.136  -0.141 -12.547
  203   2HG   MET  28          2HG       MET  28  13.871   0.952 -13.732
  204   1HE   MET  28          1HE       MET  28  11.919   1.398 -10.222
  205   2HE   MET  28          2HE       MET  28  12.686   2.925  -9.693
  206   3HE   MET  28          3HE       MET  28  11.710   2.891 -11.191
  207    H    PHE  29           H        PHE  29   8.862   0.971 -14.143
  208    HA   PHE  29           HA       PHE  29   8.592  -1.945 -13.675
  209   1HB   PHE  29          1HB       PHE  29   5.991  -1.229 -14.082
  210   2HB   PHE  29          2HB       PHE  29   6.638   0.373 -13.847
  211    HD1  PHE  29           HD1      PHE  29   4.629  -0.909 -11.987
  212    HD2  PHE  29           HD2      PHE  29   8.931  -0.926 -11.826
  213    HE1  PHE  29           HE1      PHE  29   4.549  -1.235  -9.548
  214    HE2  PHE  29           HE2      PHE  29   8.827  -1.243  -9.388
  215    HZ   PHE  29           HZ       PHE  29   6.643  -1.393  -8.246
  216    H    ASP  30           H        ASP  30   8.162   0.252 -16.399
  217    HA   ASP  30           HA       ASP  30   6.769  -1.608 -18.240
  218   1HB   ASP  30          1HB       ASP  30   8.442   0.750 -19.225
  219   2HB   ASP  30          2HB       ASP  30   6.942   1.027 -18.371
  220    H    ALA  31           H        ALA  31   7.724  -2.505 -20.171
  221    HA   ALA  31           HA       ALA  31  10.646  -3.393 -19.832
  222   1HB   ALA  31          1HB       ALA  31   9.977  -5.577 -20.839
  223   2HB   ALA  31          2HB       ALA  31   9.072  -5.235 -19.352
  224   3HB   ALA  31          3HB       ALA  31   8.281  -5.046 -20.938
  225    H    ASP  32           H        ASP  32   8.043  -3.109 -22.274
  226    HA   ASP  32           HA       ASP  32  10.096  -2.688 -24.479
  227   1HB   ASP  32          1HB       ASP  32   7.994  -2.992 -26.013
  228   2HB   ASP  32          2HB       ASP  32   8.732  -4.382 -25.250
  229    H    GLY  33           H        GLY  33   9.370  -0.632 -22.498
  230   1HA   GLY  33          1HA       GLY  33   8.839   1.751 -22.410
  231   2HA   GLY  33          2HA       GLY  33   9.655   1.717 -23.956
  232    H    GLY  34           H        GLY  34   6.632  -0.004 -23.409
  233   1HA   GLY  34          1HA       GLY  34   4.510   0.102 -24.589
  234   2HA   GLY  34          2HA       GLY  34   5.318   1.129 -25.781
  235    H    GLY  35           H        GLY  35   3.998   1.221 -22.478
  236   1HA   GLY  35          1HA       GLY  35   3.657   4.009 -21.922
  237   2HA   GLY  35          2HA       GLY  35   2.369   3.655 -23.082
  238    H    ASP  36           H        ASP  36   1.892   0.958 -22.324
  239    HA   ASP  36           HA       ASP  36   0.723   1.228 -19.502
  240   1HB   ASP  36          1HB       ASP  36  -1.280   0.493 -20.187
  241   2HB   ASP  36          2HB       ASP  36  -0.587  -0.922 -20.944
  242    H    ILE  37           H        ILE  37   0.711  -0.689 -18.230
  243    HA   ILE  37           HA       ILE  37   3.108  -2.520 -18.728
  244    HB   ILE  37           HB       ILE  37   1.887  -2.644 -16.029
  245   1HG1  ILE  37          1HG1      ILE  37   3.173  -0.014 -16.940
  246   2HG1  ILE  37          2HG1      ILE  37   1.669  -0.254 -16.071
  247   1HG2  ILE  37          1HG2      ILE  37   4.231  -2.882 -15.306
  248   2HG2  ILE  37          2HG2      ILE  37   3.924  -3.932 -16.696
  249   3HG2  ILE  37          3HG2      ILE  37   4.824  -2.413 -16.917
  250   1HD1  ILE  37          1HD1      ILE  37   4.467  -0.664 -14.855
  251   2HD1  ILE  37          2HD1      ILE  37   3.318   0.648 -14.517
  252   3HD1  ILE  37          3HD1      ILE  37   2.933  -1.013 -14.013
  253    H    SER  38           H        SER  38   2.727  -4.704 -17.476
  254    HA   SER  38           HA       SER  38  -0.041  -5.862 -17.904
  255   1HB   SER  38          1HB       SER  38   0.378  -7.205 -19.722
  256   2HB   SER  38          2HB       SER  38   2.100  -7.382 -19.376
  257    HG   SER  38           HG       SER  38   1.450  -6.042 -21.204
  258    H    THR  39           H        THR  39   0.799  -8.538 -17.940
  259    HA   THR  39           HA       THR  39   1.517  -8.971 -15.047
  260    HB   THR  39           HB       THR  39   1.192 -11.505 -15.828
  261    HG1  THR  39           HG1      THR  39   0.971 -10.695 -18.038
  262   1HG2  THR  39          1HG2      THR  39  -1.197 -11.417 -15.268
  263   2HG2  THR  39          2HG2      THR  39  -0.319 -10.312 -14.186
  264   3HG2  THR  39          3HG2      THR  39  -1.264  -9.663 -15.552
  265    H    LYS  40           H        LYS  40   2.771  -9.783 -18.282
  266    HA   LYS  40           HA       LYS  40   5.137 -11.263 -17.420
  267   1HB   LYS  40          1HB       LYS  40   4.273 -11.547 -19.647
  268   2HB   LYS  40          2HB       LYS  40   4.453  -9.866 -20.074
  269   1HG   LYS  40          1HG       LYS  40   7.015 -10.235 -19.848
  270   2HG   LYS  40          2HG       LYS  40   6.220 -11.046 -21.171
  271   1HD   LYS  40          1HD       LYS  40   8.055 -12.316 -19.635
  272   2HD   LYS  40          2HD       LYS  40   6.690 -12.548 -18.581
  273   1HE   LYS  40          1HE       LYS  40   6.463 -14.507 -19.698
  274   2HE   LYS  40          2HE       LYS  40   5.456 -13.539 -20.767
  275   1HZ   LYS  40          1HZ       LYS  40   7.886 -13.217 -21.888
  276   2HZ   LYS  40          2HZ       LYS  40   6.841 -14.425 -22.308
  277   3HZ   LYS  40          3HZ       LYS  40   8.070 -14.727 -21.245
  278    H    GLU  41           H        GLU  41   4.426  -7.851 -17.941
  279    HA   GLU  41           HA       GLU  41   7.246  -6.886 -17.861
  280   1HB   GLU  41          1HB       GLU  41   6.465  -4.730 -18.244
  281   2HB   GLU  41          2HB       GLU  41   4.943  -4.988 -17.419
  282   1HG   GLU  41          1HG       GLU  41   5.486  -6.459 -20.054
  283   2HG   GLU  41          2HG       GLU  41   3.950  -6.099 -19.295
  284    H    LEU  42           H        LEU  42   4.532  -7.126 -15.603
  285    HA   LEU  42           HA       LEU  42   5.729  -5.516 -13.420
  286   1HB   LEU  42          1HB       LEU  42   3.327  -7.400 -13.584
  287   2HB   LEU  42          2HB       LEU  42   3.335  -5.655 -13.445
  288    HG   LEU  42           HG       LEU  42   4.455  -7.345 -11.150
  289   1HD1  LEU  42          1HD1      LEU  42   3.717  -5.386  -9.767
  290   2HD1  LEU  42          2HD1      LEU  42   4.849  -4.890 -11.035
  291   3HD1  LEU  42          3HD1      LEU  42   3.108  -4.566 -11.228
  292   1HD2  LEU  42          1HD2      LEU  42   1.457  -6.680 -11.538
  293   2HD2  LEU  42          2HD2      LEU  42   2.183  -8.305 -11.599
  294   3HD2  LEU  42          3HD2      LEU  42   2.192  -7.393 -10.078
  295    H    GLY  43           H        GLY  43   5.581  -8.952 -14.248
  296   1HA   GLY  43          1HA       GLY  43   6.415 -10.225 -11.795
  297   2HA   GLY  43          2HA       GLY  43   6.734 -10.889 -13.401
  298    H    THR  44           H        THR  44   8.375  -8.960 -14.495
  299    HA   THR  44           HA       THR  44  10.976  -9.892 -13.736
  300    HB   THR  44           HB       THR  44  10.076  -7.550 -15.419
  301    HG1  THR  44           HG1      THR  44  10.355  -9.875 -15.969
  302   1HG2  THR  44          1HG2      THR  44  12.437  -6.982 -16.018
  303   2HG2  THR  44          2HG2      THR  44  12.086  -6.566 -14.328
  304   3HG2  THR  44          3HG2      THR  44  13.036  -8.026 -14.705
  305    H    VAL  45           H        VAL  45   9.460  -6.752 -12.959
  306    HA   VAL  45           HA       VAL  45  11.671  -5.686 -11.348
  307    HB   VAL  45           HB       VAL  45   8.927  -4.793 -12.024
  308   1HG1  VAL  45          1HG1      VAL  45   8.684  -3.147 -10.164
  309   2HG1  VAL  45          2HG1      VAL  45   8.614  -4.798  -9.537
  310   3HG1  VAL  45          3HG1      VAL  45  10.098  -3.841  -9.329
  311   1HG2  VAL  45          1HG2      VAL  45  11.526  -3.208 -11.484
  312   2HG2  VAL  45          2HG2      VAL  45  10.947  -3.744 -13.079
  313   3HG2  VAL  45          3HG2      VAL  45  10.018  -2.546 -12.167
  314    H    MET  46           H        MET  46   8.790  -7.607 -10.647
  315    HA   MET  46           HA       MET  46   8.757  -7.491  -7.740
  316   1HB   MET  46          1HB       MET  46   7.723  -9.957  -8.041
  317   2HB   MET  46          2HB       MET  46   7.684  -9.513  -9.738
  318   1HG   MET  46          1HG       MET  46   5.712  -8.433  -9.395
  319   2HG   MET  46          2HG       MET  46   6.539  -7.257  -8.360
  320   1HE   MET  46          1HE       MET  46   5.139  -6.701  -6.334
  321   2HE   MET  46          2HE       MET  46   5.108  -7.844  -4.960
  322   3HE   MET  46          3HE       MET  46   6.671  -7.357  -5.677
  323    NH1  ARG  47           NH1      ARG  47  15.838 -10.668 -11.913
  324    NH2  ARG  47           NH2      ARG  47  14.962 -11.591 -13.796
  325    H    ARG  47           H        ARG  47  10.609  -9.420 -10.036
  326    HA   ARG  47           HA       ARG  47  11.886 -11.166  -7.931
  327   1HB   ARG  47          1HB       ARG  47  12.578 -11.071 -10.922
  328   2HB   ARG  47          2HB       ARG  47  11.177 -11.929 -10.294
  329   1HG   ARG  47          1HG       ARG  47  13.129 -12.968  -8.618
  330   2HG   ARG  47          2HG       ARG  47  12.550 -13.728 -10.101
  331   1HD   ARG  47          1HD       ARG  47  15.059 -11.935  -9.845
  332   2HD   ARG  47          2HD       ARG  47  15.026 -13.674 -10.092
  333    HE   ARG  47           HE       ARG  47  13.905 -13.222 -12.391
  334   1HH1  ARG  47          1HH1      ARG  47  15.920 -10.701 -10.890
  335   2HH1  ARG  47          2HH1      ARG  47  16.276  -9.987 -12.543
  336   1HH2  ARG  47          1HH2      ARG  47  14.379 -12.325 -14.213
  337   2HH2  ARG  47          2HH2      ARG  47  15.460 -10.845 -14.294
  338    H    MET  48           H        MET  48  12.349  -8.161  -8.085
  339    HA   MET  48           HA       MET  48  15.248  -7.770  -8.708
  340   1HB   MET  48          1HB       MET  48  14.721  -5.662  -7.037
  341   2HB   MET  48          2HB       MET  48  13.078  -6.033  -7.526
  342   1HG   MET  48          1HG       MET  48  13.387  -4.893  -9.473
  343   2HG   MET  48          2HG       MET  48  14.656  -6.029  -9.963
  344   1HE   MET  48          1HE       MET  48  15.410  -3.545 -11.273
  345   2HE   MET  48          2HE       MET  48  17.010  -3.104 -10.608
  346   3HE   MET  48          3HE       MET  48  16.637  -4.814 -10.973
  347    H    LEU  49           H        LEU  49  13.242  -8.355  -5.832
  348    HA   LEU  49           HA       LEU  49  15.349  -8.068  -3.793
  349   1HB   LEU  49          1HB       LEU  49  13.449  -8.019  -2.579
  350   2HB   LEU  49          2HB       LEU  49  13.582  -9.764  -2.549
  351    HG   LEU  49           HG       LEU  49  11.859  -8.168  -4.546
  352   1HD1  LEU  49          1HD1      LEU  49  10.934  -9.876  -2.152
  353   2HD1  LEU  49          2HD1      LEU  49  11.040  -8.106  -2.134
  354   3HD1  LEU  49          3HD1      LEU  49   9.905  -8.915  -3.243
  355   1HD2  LEU  49          1HD2      LEU  49  10.922 -10.313  -5.307
  356   2HD2  LEU  49          2HD2      LEU  49  12.694 -10.436  -5.442
  357   3HD2  LEU  49          3HD2      LEU  49  11.858 -11.223  -4.095
  358    H    GLY  50           H        GLY  50  14.029 -10.810  -5.623
  359   1HA   GLY  50          1HA       GLY  50  16.288 -12.625  -4.581
  360   2HA   GLY  50          2HA       GLY  50  15.792 -12.625  -6.279
  361    H    GLN  51           H        GLN  51  14.216 -13.900  -6.936
  362    HA   GLN  51           HA       GLN  51  12.860 -15.831  -5.047
  363   1HB   GLN  51          1HB       GLN  51  10.550 -15.254  -5.716
  364   2HB   GLN  51          2HB       GLN  51  11.124 -13.936  -6.719
  365   1HG   GLN  51          1HG       GLN  51  12.080 -12.824  -4.595
  366   2HG   GLN  51          2HG       GLN  51  10.338 -12.865  -4.755
  367   1HE2  GLN  51          1HE2      GLN  51  10.929 -13.912  -1.246
  368   2HE2  GLN  51          2HE2      GLN  51  11.197 -12.427  -2.291
  369    H    ASN  52           H        ASN  52  10.952 -16.760  -6.803
  370    HA   ASN  52           HA       ASN  52  12.310 -17.284  -9.458
  371   1HB   ASN  52          1HB       ASN  52  11.102 -19.681  -8.011
  372   2HB   ASN  52          2HB       ASN  52  12.710 -19.156  -7.563
  373   1HD2  ASN  52          1HD2      ASN  52  12.649 -21.751 -10.445
  374   2HD2  ASN  52          2HD2      ASN  52  11.594 -21.594  -8.951
  375    HA   PRO  53           HA       PRO  53   7.661 -16.414  -9.794
  376   1HB   PRO  53          1HB       PRO  53   7.686 -14.639 -11.901
  377   2HB   PRO  53          2HB       PRO  53   8.147 -14.214 -10.246
  378   1HG   PRO  53          1HG       PRO  53   9.993 -14.876 -12.590
  379   2HG   PRO  53          2HG       PRO  53  10.135 -13.536 -11.429
  380   1HD   PRO  53          1HD       PRO  53  11.146 -14.963  -9.778
  381   2HD   PRO  53          2HD       PRO  53  11.534 -15.988 -11.191
  382    H    THR  54           H        THR  54   6.211 -16.402 -11.922
  383    HA   THR  54           HA       THR  54   7.054 -18.166 -14.184
  384    HB   THR  54           HB       THR  54   6.548 -19.717 -12.122
  385    HG1  THR  54           HG1      THR  54   6.877 -20.751 -13.888
  386   1HG2  THR  54          1HG2      THR  54   4.228 -20.563 -11.979
  387   2HG2  THR  54          2HG2      THR  54   4.269 -18.843 -11.528
  388   3HG2  THR  54          3HG2      THR  54   3.661 -19.329 -13.130
  389    H    LYS  55           H        LYS  55   5.483 -18.249 -15.820
  390    HA   LYS  55           HA       LYS  55   4.113 -15.733 -16.282
  391   1HB   LYS  55          1HB       LYS  55   4.029 -16.477 -18.417
  392   2HB   LYS  55          2HB       LYS  55   4.825 -17.939 -17.874
  393   1HG   LYS  55          1HG       LYS  55   2.011 -18.315 -17.365
  394   2HG   LYS  55          2HG       LYS  55   2.131 -17.600 -18.963
  395   1HD   LYS  55          1HD       LYS  55   2.345 -19.857 -19.578
  396   2HD   LYS  55          2HD       LYS  55   4.042 -19.492 -19.308
  397   1HE   LYS  55          1HE       LYS  55   4.024 -20.501 -17.079
  398   2HE   LYS  55          2HE       LYS  55   2.273 -20.691 -17.088
  399   1HZ   LYS  55          1HZ       LYS  55   3.829 -22.670 -17.710
  400   2HZ   LYS  55          2HZ       LYS  55   3.861 -21.994 -19.217
  401   3HZ   LYS  55          3HZ       LYS  55   2.424 -22.468 -18.555
  402    H    GLU  56           H        GLU  56   3.043 -18.849 -15.035
  403    HA   GLU  56           HA       GLU  56   0.137 -18.357 -15.158
  404   1HB   GLU  56          1HB       GLU  56   0.790 -20.328 -13.116
  405   2HB   GLU  56          2HB       GLU  56   1.851 -20.573 -14.489
  406   1HG   GLU  56          1HG       GLU  56  -0.319 -20.546 -15.977
  407   2HG   GLU  56          2HG       GLU  56   0.002 -21.961 -14.989
  408    H    GLU  57           H        GLU  57   2.656 -17.970 -12.699
  409    HA   GLU  57           HA       GLU  57   0.905 -17.412 -10.391
  410   1HB   GLU  57          1HB       GLU  57   3.712 -16.313 -10.419
  411   2HB   GLU  57          2HB       GLU  57   3.519 -18.047 -10.562
  412   1HG   GLU  57          1HG       GLU  57   1.824 -17.337  -8.351
  413   2HG   GLU  57          2HG       GLU  57   3.356 -18.199  -8.290
  414    H    LEU  58           H        LEU  58   2.386 -15.461 -12.919
  415    HA   LEU  58           HA       LEU  58   2.095 -12.814 -11.688
  416   1HB   LEU  58          1HB       LEU  58   2.884 -13.916 -14.348
  417   2HB   LEU  58          2HB       LEU  58   2.092 -12.357 -14.453
  418    HG   LEU  58           HG       LEU  58   4.552 -12.109 -14.335
  419   1HD1  LEU  58          1HD1      LEU  58   4.790 -10.518 -12.388
  420   2HD1  LEU  58          2HD1      LEU  58   3.280 -10.236 -13.267
  421   3HD1  LEU  58          3HD1      LEU  58   3.248 -11.101 -11.712
  422   1HD2  LEU  58          1HD2      LEU  58   4.421 -13.525 -11.593
  423   2HD2  LEU  58          2HD2      LEU  58   5.094 -14.208 -13.094
  424   3HD2  LEU  58          3HD2      LEU  58   5.874 -12.808 -12.335
  425    H    ASP  59           H        ASP  59   0.054 -14.858 -13.711
  426    HA   ASP  59           HA       ASP  59  -2.067 -12.926 -14.356
  427   1HB   ASP  59          1HB       ASP  59  -2.251 -15.993 -14.271
  428   2HB   ASP  59          2HB       ASP  59  -1.744 -15.038 -15.645
  429    H    ALA  60           H        ALA  60  -1.407 -15.053 -11.635
  430    HA   ALA  60           HA       ALA  60  -3.981 -14.778 -10.219
  431   1HB   ALA  60          1HB       ALA  60  -2.770 -15.733  -8.264
  432   2HB   ALA  60          2HB       ALA  60  -2.439 -16.654  -9.744
  433   3HB   ALA  60          3HB       ALA  60  -1.208 -15.540  -9.096
  434    H    ILE  61           H        ILE  61  -0.852 -13.096 -10.043
  435    HA   ILE  61           HA       ILE  61  -1.312 -11.459  -7.675
  436    HB   ILE  61           HB       ILE  61   0.702 -11.508  -9.846
  437   1HG1  ILE  61          1HG1      ILE  61   0.621 -11.872  -6.998
  438   2HG1  ILE  61          2HG1      ILE  61   1.992 -12.062  -8.069
  439   1HG2  ILE  61          1HG2      ILE  61   1.589  -9.185  -9.499
  440   2HG2  ILE  61          2HG2      ILE  61  -0.024  -9.133 -10.207
  441   3HG2  ILE  61          3HG2      ILE  61   0.187  -8.783  -8.476
  442   1HD1  ILE  61          1HD1      ILE  61   1.295  -9.447  -6.606
  443   2HD1  ILE  61          2HD1      ILE  61   2.640 -10.558  -6.268
  444   3HD1  ILE  61          3HD1      ILE  61   2.621  -9.632  -7.787
  445    H    ILE  62           H        ILE  62  -1.899 -10.894 -11.143
  446    HA   ILE  62           HA       ILE  62  -2.988  -8.146 -10.832
  447    HB   ILE  62           HB       ILE  62  -3.043 -10.075 -13.204
  448   1HG1  ILE  62          1HG1      ILE  62  -1.171  -7.867 -12.307
  449   2HG1  ILE  62          2HG1      ILE  62  -0.817  -9.372 -13.129
  450   1HG2  ILE  62          1HG2      ILE  62  -3.858  -8.176 -14.629
  451   2HG2  ILE  62          2HG2      ILE  62  -5.049  -8.565 -13.390
  452   3HG2  ILE  62          3HG2      ILE  62  -4.010  -7.136 -13.192
  453   1HD1  ILE  62          1HD1      ILE  62  -1.947  -6.868 -14.516
  454   2HD1  ILE  62          2HD1      ILE  62  -0.310  -7.542 -14.649
  455   3HD1  ILE  62          3HD1      ILE  62  -1.691  -8.446 -15.312
  456    H    GLU  63           H        GLU  63  -4.255 -11.437 -11.006
  457    HA   GLU  63           HA       GLU  63  -7.061 -11.100 -11.257
  458   1HB   GLU  63          1HB       GLU  63  -5.939 -13.052  -9.197
  459   2HB   GLU  63          2HB       GLU  63  -5.661 -13.287 -10.912
  460   1HG   GLU  63          1HG       GLU  63  -8.286 -13.447  -9.354
  461   2HG   GLU  63          2HG       GLU  63  -8.359 -13.039 -11.060
  462    H    GLU  64           H        GLU  64  -5.124 -10.903  -8.260
  463    HA   GLU  64           HA       GLU  64  -7.180 -10.361  -6.312
  464   1HB   GLU  64          1HB       GLU  64  -5.237  -8.972  -5.147
  465   2HB   GLU  64          2HB       GLU  64  -4.231  -9.616  -6.431
  466   1HG   GLU  64          1HG       GLU  64  -5.160 -10.915  -3.968
  467   2HG   GLU  64          2HG       GLU  64  -3.894 -11.418  -5.075
  468    H    VAL  65           H        VAL  65  -5.029  -7.884  -7.748
  469    HA   VAL  65           HA       VAL  65  -6.927  -5.631  -7.353
  470    HB   VAL  65           HB       VAL  65  -4.295  -5.565  -7.573
  471   1HG1  VAL  65          1HG1      VAL  65  -5.933  -3.279  -8.846
  472   2HG1  VAL  65          2HG1      VAL  65  -5.886  -3.604  -7.103
  473   3HG1  VAL  65          3HG1      VAL  65  -4.393  -3.151  -7.960
  474   1HG2  VAL  65          1HG2      VAL  65  -3.364  -4.925  -9.741
  475   2HG2  VAL  65          2HG2      VAL  65  -4.257  -6.441 -10.007
  476   3HG2  VAL  65          3HG2      VAL  65  -4.969  -4.903 -10.513
  477    H    ASP  66           H        ASP  66  -6.573  -4.455 -10.001
  478    HA   ASP  66           HA       ASP  66  -7.600  -4.360 -12.169
  479   1HB   ASP  66          1HB       ASP  66  -8.400  -7.156 -12.557
  480   2HB   ASP  66          2HB       ASP  66  -6.757  -7.092 -11.963
  481    H    GLU  67           H        GLU  67  -9.114  -3.295 -10.637
  482    HA   GLU  67           HA       GLU  67 -11.696  -4.656  -9.937
  483   1HB   GLU  67          1HB       GLU  67 -11.357  -1.641  -9.836
  484   2HB   GLU  67          2HB       GLU  67 -10.442  -2.632  -8.716
  485   1HG   GLU  67          1HG       GLU  67 -13.405  -2.057  -8.807
  486   2HG   GLU  67          2HG       GLU  67 -12.998  -3.708  -8.372
  487    H    ASP  68           H        ASP  68 -10.364  -2.645 -12.486
  488    HA   ASP  68           HA       ASP  68 -12.988  -2.020 -13.792
  489   1HB   ASP  68          1HB       ASP  68 -11.676  -0.273 -14.404
  490   2HB   ASP  68          2HB       ASP  68 -11.292  -1.308 -15.761
  491    H    GLY  69           H        GLY  69 -10.397  -4.379 -14.095
  492   1HA   GLY  69          1HA       GLY  69 -10.562  -6.654 -15.028
  493   2HA   GLY  69          2HA       GLY  69 -12.176  -6.255 -15.631
  494    H    SER  70           H        SER  70  -9.170  -4.449 -16.149
  495    HA   SER  70           HA       SER  70  -9.506  -4.513 -19.161
  496   1HB   SER  70          1HB       SER  70  -8.934  -2.350 -18.430
  497   2HB   SER  70          2HB       SER  70  -7.417  -2.987 -19.071
  498    HG   SER  70           HG       SER  70  -7.040  -2.063 -17.113
  499    H    GLY  71           H        GLY  71  -7.162  -5.483 -16.643
  500   1HA   GLY  71          1HA       GLY  71  -6.072  -7.802 -16.789
  501   2HA   GLY  71          2HA       GLY  71  -6.001  -7.589 -18.544
  502    H    THR  72           H        THR  72  -5.209  -4.791 -18.406
  503    HA   THR  72           HA       THR  72  -2.255  -5.125 -17.704
  504    HB   THR  72           HB       THR  72  -2.096  -2.894 -19.140
  505    HG1  THR  72           HG1      THR  72  -4.418  -2.882 -19.356
  506   1HG2  THR  72          1HG2      THR  72  -1.659  -4.150 -21.212
  507   2HG2  THR  72          2HG2      THR  72  -0.972  -5.049 -19.841
  508   3HG2  THR  72          3HG2      THR  72  -2.494  -5.593 -20.594
  509    H    ILE  73           H        ILE  73  -1.381  -2.664 -17.345
  510    HA   ILE  73           HA       ILE  73  -3.084  -1.259 -15.239
  511    HB   ILE  73           HB       ILE  73  -0.197  -2.131 -14.708
  512   1HG1  ILE  73          1HG1      ILE  73  -1.407  -3.347 -12.683
  513   2HG1  ILE  73          2HG1      ILE  73  -2.870  -3.197 -13.633
  514   1HG2  ILE  73          1HG2      ILE  73  -0.436  -1.081 -12.461
  515   2HG2  ILE  73          2HG2      ILE  73  -0.733   0.132 -13.714
  516   3HG2  ILE  73          3HG2      ILE  73  -2.102  -0.575 -12.822
  517   1HD1  ILE  73          1HD1      ILE  73  -0.375  -4.745 -14.545
  518   2HD1  ILE  73          2HD1      ILE  73  -1.932  -5.413 -14.012
  519   3HD1  ILE  73          3HD1      ILE  73  -1.839  -4.497 -15.534
  520    H    ASP  74           H        ASP  74  -3.397   0.234 -16.902
  521    HA   ASP  74           HA       ASP  74  -1.137   1.643 -18.251
  522   1HB   ASP  74          1HB       ASP  74  -3.234   3.289 -18.824
  523   2HB   ASP  74          2HB       ASP  74  -2.815   1.859 -19.740
  524    H    PHE  75           H        PHE  75  -1.155   4.112 -18.168
  525    HA   PHE  75           HA       PHE  75  -0.169   5.005 -15.589
  526   1HB   PHE  75          1HB       PHE  75  -1.256   6.928 -17.722
  527   2HB   PHE  75          2HB       PHE  75   0.216   6.032 -17.981
  528    HD1  PHE  75           HD1      PHE  75   0.221   8.999 -17.982
  529    HD2  PHE  75           HD2      PHE  75   0.719   6.300 -14.667
  530    HE1  PHE  75           HE1      PHE  75   1.517  10.707 -16.773
  531    HE2  PHE  75           HE2      PHE  75   2.006   8.026 -13.471
  532    HZ   PHE  75           HZ       PHE  75   2.407  10.226 -14.518
  533    H    GLU  76           H        GLU  76  -3.381   4.946 -16.984
  534    HA   GLU  76           HA       GLU  76  -4.595   6.716 -14.847
  535   1HB   GLU  76          1HB       GLU  76  -6.775   5.918 -16.243
  536   2HB   GLU  76          2HB       GLU  76  -5.806   7.329 -16.606
  537   1HG   GLU  76          1HG       GLU  76  -4.927   4.775 -17.974
  538   2HG   GLU  76          2HG       GLU  76  -6.501   5.391 -18.433
  539    H    GLU  77           H        GLU  77  -3.394   4.460 -13.843
  540    HA   GLU  77           HA       GLU  77  -5.627   3.177 -12.328
  541   1HB   GLU  77          1HB       GLU  77  -5.770   1.673 -14.182
  542   2HB   GLU  77          2HB       GLU  77  -4.034   1.493 -14.301
  543   1HG   GLU  77          1HG       GLU  77  -3.911   0.087 -12.319
  544   2HG   GLU  77          2HG       GLU  77  -5.526   0.538 -11.788
  545    H    PHE  78           H        PHE  78  -2.182   3.151 -13.192
  546    HA   PHE  78           HA       PHE  78  -1.057   1.897 -10.836
  547   1HB   PHE  78          1HB       PHE  78   0.176   2.528 -13.014
  548   2HB   PHE  78          2HB       PHE  78   0.271   4.174 -12.442
  549    HD1  PHE  78           HD1      PHE  78   2.636   4.456 -12.037
  550    HD2  PHE  78           HD2      PHE  78   0.663   1.010 -10.382
  551    HE1  PHE  78           HE1      PHE  78   4.687   3.854 -10.817
  552    HE2  PHE  78           HE2      PHE  78   2.725   0.420  -9.174
  553    HZ   PHE  78           HZ       PHE  78   4.734   1.844  -9.378
  554    H    LEU  79           H        LEU  79  -2.128   5.192 -11.485
  555    HA   LEU  79           HA       LEU  79  -1.326   6.246  -8.760
  556   1HB   LEU  79          1HB       LEU  79  -2.659   7.559 -11.198
  557   2HB   LEU  79          2HB       LEU  79  -2.519   8.384  -9.660
  558    HG   LEU  79           HG       LEU  79   0.092   7.874  -9.876
  559   1HD1  LEU  79          1HD1      LEU  79  -1.199  10.000 -11.699
  560   2HD1  LEU  79          2HD1      LEU  79  -1.029  10.162  -9.941
  561   3HD1  LEU  79          3HD1      LEU  79   0.424  10.060 -10.966
  562   1HD2  LEU  79          1HD2      LEU  79   0.974   7.714 -12.165
  563   2HD2  LEU  79          2HD2      LEU  79  -0.184   6.377 -11.956
  564   3HD2  LEU  79          3HD2      LEU  79  -0.660   7.816 -12.869
  565    H    VAL  80           H        VAL  80  -3.068   4.110  -8.589
  566    HA   VAL  80           HA       VAL  80  -5.520   5.409  -7.325
  567    HB   VAL  80           HB       VAL  80  -5.775   4.129  -9.764
  568   1HG1  VAL  80          1HG1      VAL  80  -6.997   1.978  -9.386
  569   2HG1  VAL  80          2HG1      VAL  80  -5.317   1.848  -8.846
  570   3HG1  VAL  80          3HG1      VAL  80  -6.615   2.044  -7.646
  571   1HG2  VAL  80          1HG2      VAL  80  -7.986   4.307  -7.613
  572   2HG2  VAL  80          2HG2      VAL  80  -7.525   5.620  -8.722
  573   3HG2  VAL  80          3HG2      VAL  80  -8.231   4.131  -9.368
  574    H    MET  81           H        MET  81  -3.582   2.453  -7.815
  575    HA   MET  81           HA       MET  81  -4.324   1.145  -5.257
  576   1HB   MET  81          1HB       MET  81  -2.343   0.549  -7.463
  577   2HB   MET  81          2HB       MET  81  -3.619  -0.445  -6.786
  578   1HG   MET  81          1HG       MET  81  -1.163   0.178  -5.062
  579   2HG   MET  81          2HG       MET  81  -2.285  -1.188  -4.948
  580   1HE   MET  81          1HE       MET  81  -2.511  -1.352  -8.372
  581   2HE   MET  81          2HE       MET  81  -1.406  -2.716  -8.718
  582   3HE   MET  81          3HE       MET  81  -2.609  -2.856  -7.403
  583    H    MET  82           H        MET  82  -1.765   3.295  -6.384
  584    HA   MET  82           HA       MET  82  -0.102   3.204  -3.910
  585   1HB   MET  82          1HB       MET  82   0.802   5.466  -5.044
  586   2HB   MET  82          2HB       MET  82  -0.057   4.876  -6.454
  587   1HG   MET  82          1HG       MET  82   1.354   2.575  -5.741
  588   2HG   MET  82          2HG       MET  82   1.898   3.778  -6.918
  589   1HE   MET  82          1HE       MET  82   3.506   1.690  -5.247
  590   2HE   MET  82          2HE       MET  82   4.763   2.443  -4.221
  591   3HE   MET  82          3HE       MET  82   4.743   2.761  -5.980
  592    H    VAL  83           H        VAL  83  -2.733   5.152  -5.214
  593    HA   VAL  83           HA       VAL  83  -2.652   7.385  -3.301
  594    HB   VAL  83           HB       VAL  83  -4.102   6.871  -5.627
  595   1HG1  VAL  83          1HG1      VAL  83  -4.711   9.182  -3.680
  596   2HG1  VAL  83          2HG1      VAL  83  -3.255   9.120  -4.683
  597   3HG1  VAL  83          3HG1      VAL  83  -4.856   9.182  -5.457
  598   1HG2  VAL  83          1HG2      VAL  83  -6.491   7.095  -5.178
  599   2HG2  VAL  83          2HG2      VAL  83  -5.934   5.696  -4.231
  600   3HG2  VAL  83          3HG2      VAL  83  -6.227   7.241  -3.421
  601    NH1  ARG  84           NH1      ARG  84  -9.052  -0.871  -3.844
  602    NH2  ARG  84           NH2      ARG  84  -8.151  -1.936  -2.051
  603    H    ARG  84           H        ARG  84  -4.179   4.204  -3.382
  604    HA   ARG  84           HA       ARG  84  -6.076   4.414  -1.168
  605   1HB   ARG  84          1HB       ARG  84  -4.771   2.150  -2.666
  606   2HB   ARG  84          2HB       ARG  84  -5.269   1.770  -1.024
  607   1HG   ARG  84          1HG       ARG  84  -7.350   3.240  -2.625
  608   2HG   ARG  84          2HG       ARG  84  -7.541   1.917  -1.473
  609   1HD   ARG  84          1HD       ARG  84  -6.217   1.417  -4.199
  610   2HD   ARG  84          2HD       ARG  84  -7.976   1.439  -4.057
  611    HE   ARG  84           HE       ARG  84  -6.129  -0.572  -2.682
  612   1HH1  ARG  84          1HH1      ARG  84  -8.955  -0.138  -4.555
  613   2HH1  ARG  84          2HH1      ARG  84  -9.831  -1.532  -3.744
  614   1HH2  ARG  84          1HH2      ARG  84  -7.386  -1.990  -1.369
  615   2HH2  ARG  84          2HH2      ARG  84  -8.975  -2.546  -2.100
  616    H    GLN  85           H        GLN  85  -2.742   3.098  -1.229
  617    HA   GLN  85           HA       GLN  85  -2.491   2.621   1.668
  618   1HB   GLN  85          1HB       GLN  85  -0.169   3.090  -0.284
  619   2HB   GLN  85          2HB       GLN  85  -0.111   2.285   1.273
  620   1HG   GLN  85          1HG       GLN  85  -0.916   1.212  -1.386
  621   2HG   GLN  85          2HG       GLN  85  -2.066   0.785  -0.139
  622   1HE2  GLN  85          1HE2      GLN  85   0.379  -1.292   1.675
  623   2HE2  GLN  85          2HE2      GLN  85  -0.913  -0.030   1.999
  624    H    MET  86           H        MET  86  -1.829   5.339  -0.478
  625    HA   MET  86           HA       MET  86  -0.174   7.066   1.076
  626   1HB   MET  86          1HB       MET  86  -2.194   8.747  -0.176
  627   2HB   MET  86          2HB       MET  86  -1.873   7.396  -1.248
  628   1HG   MET  86          1HG       MET  86   0.663   8.557  -0.195
  629   2HG   MET  86          2HG       MET  86   0.183   8.201  -1.863
  630   1HE   MET  86          1HE       MET  86  -2.652   9.785  -2.129
  631   2HE   MET  86          2HE       MET  86  -2.095  11.359  -2.768
  632   3HE   MET  86          3HE       MET  86  -1.392   9.842  -3.401
  633    H    LYS  87           H        LYS  87  -3.608   6.363   1.395
  634    HA   LYS  87           HA       LYS  87  -4.645   8.351   3.140
  635   1HB   LYS  87          1HB       LYS  87  -5.191   5.375   2.921
  636   2HB   LYS  87          2HB       LYS  87  -5.731   6.176   4.389
  637   1HG   LYS  87          1HG       LYS  87  -7.123   6.075   1.945
  638   2HG   LYS  87          2HG       LYS  87  -6.492   7.714   1.943
  639   1HD   LYS  87          1HD       LYS  87  -7.583   7.154   4.603
  640   2HD   LYS  87          2HD       LYS  87  -8.047   8.385   3.434
  641   1HE   LYS  87          1HE       LYS  87 -10.069   7.299   3.259
  642   2HE   LYS  87          2HE       LYS  87  -9.226   6.059   2.321
  643   1HZ   LYS  87          1HZ       LYS  87  -9.170   5.888   5.266
  644   2HZ   LYS  87          2HZ       LYS  87  -9.081   4.675   4.147
  645   3HZ   LYS  87          3HZ       LYS  87 -10.528   5.412   4.453
  646    H    GLU  88           H        GLU  88  -3.731   5.263   4.621
  647    HA   GLU  88           HA       GLU  88  -2.163   6.754   6.796
  648   1HB   GLU  88          1HB       GLU  88  -3.035   4.747   8.301
  649   2HB   GLU  88          2HB       GLU  88  -3.957   6.222   8.090
  650   1HG   GLU  88          1HG       GLU  88  -5.166   4.878   6.103
  651   2HG   GLU  88          2HG       GLU  88  -4.479   3.459   6.872
  652    H    ASP  89           H        ASP  89  -0.141   6.303   6.268
  653    HA   ASP  89           HA       ASP  89   0.728   3.374   6.047
  654   1HB   ASP  89          1HB       ASP  89   0.985   4.336   3.809
  655   2HB   ASP  89          2HB       ASP  89   2.540   3.943   4.507
  656    H    ALA  90           H        ALA  90   0.838   3.606   8.358
  657    HA   ALA  90           HA       ALA  90   3.610   4.369   9.278
  658   1HB   ALA  90          1HB       ALA  90   2.827   5.754  11.217
  659   2HB   ALA  90          2HB       ALA  90   2.380   6.518   9.679
  660   3HB   ALA  90          3HB       ALA  90   1.144   5.667  10.638
   
  Start of MODEL          29
 Raw file had  660 H/Q atoms
  Start of MODEL   29
    1   1H    ALA   1          1H        ALA   1 -16.932  -1.196 -11.525
    2   2H    ALA   1          2H        ALA   1 -16.037   0.227 -11.486
    3   3H    ALA   1          3H        ALA   1 -17.388   0.057 -10.500
    4    HA   ALA   1           HA       ALA   1 -17.638  -0.189 -13.410
    5   1HB   ALA   1          1HB       ALA   1 -19.484   0.267 -11.039
    6   2HB   ALA   1          2HB       ALA   1 -19.692  -0.795 -12.444
    7   3HB   ALA   1          3HB       ALA   1 -19.971   0.958 -12.605
    8    H    SER   2           H        SER   2 -18.921   1.978 -14.101
    9    HA   SER   2           HA       SER   2 -18.744   4.315 -14.682
   10   1HB   SER   2          1HB       SER   2 -18.458   4.335 -11.958
   11   2HB   SER   2          2HB       SER   2 -16.889   5.002 -12.418
   12    HG   SER   2           HG       SER   2 -17.932   6.566 -13.622
   13    H    MET   3           H        MET   3 -17.521   5.073 -16.255
   14    HA   MET   3           HA       MET   3 -14.795   3.903 -16.795
   15   1HB   MET   3          1HB       MET   3 -15.127   4.381 -19.025
   16   2HB   MET   3          2HB       MET   3 -16.791   4.197 -18.502
   17   1HG   MET   3          1HG       MET   3 -17.100   6.673 -18.431
   18   2HG   MET   3          2HG       MET   3 -15.384   6.928 -18.773
   19   1HE   MET   3          1HE       MET   3 -17.833   8.145 -20.185
   20   2HE   MET   3          2HE       MET   3 -17.918   7.749 -21.927
   21   3HE   MET   3          3HE       MET   3 -16.446   8.512 -21.259
   22    H    THR   4           H        THR   4 -16.328   7.004 -16.080
   23    HA   THR   4           HA       THR   4 -14.032   8.749 -16.639
   24    HB   THR   4           HB       THR   4 -15.265  10.538 -16.029
   25    HG1  THR   4           HG1      THR   4 -15.472  10.154 -13.920
   26   1HG2  THR   4          1HG2      THR   4 -17.339  10.423 -17.023
   27   2HG2  THR   4          2HG2      THR   4 -17.859   9.007 -16.082
   28   3HG2  THR   4          3HG2      THR   4 -16.813   8.797 -17.510
   29    H    ASP   5           H        ASP   5 -15.129   6.932 -13.842
   30    HA   ASP   5           HA       ASP   5 -13.405   8.293 -11.828
   31   1HB   ASP   5          1HB       ASP   5 -14.092   6.256 -10.349
   32   2HB   ASP   5          2HB       ASP   5 -15.134   5.774 -11.669
   33    H    GLN   6           H        GLN   6 -12.946   5.815 -14.172
   34    HA   GLN   6           HA       GLN   6 -10.742   4.355 -12.735
   35   1HB   GLN   6          1HB       GLN   6 -10.664   3.365 -15.310
   36   2HB   GLN   6          2HB       GLN   6 -12.306   3.980 -15.279
   37   1HG   GLN   6          1HG       GLN   6 -12.541   1.722 -14.614
   38   2HG   GLN   6          2HG       GLN   6 -12.700   2.613 -13.117
   39   1HE2  GLN   6          1HE2      GLN   6  -8.946   0.865 -13.507
   40   2HE2  GLN   6          2HE2      GLN   6  -9.692   1.782 -14.911
   41    H    GLN   7           H        GLN   7 -10.468   7.274 -13.449
   42    HA   GLN   7           HA       GLN   7  -7.590   7.266 -13.999
   43   1HB   GLN   7          1HB       GLN   7  -7.300   7.779 -16.227
   44   2HB   GLN   7          2HB       GLN   7  -8.752   6.800 -16.375
   45   1HG   GLN   7          1HG       GLN   7 -10.054   9.131 -16.143
   46   2HG   GLN   7          2HG       GLN   7  -8.517   9.832 -16.625
   47   1HE2  GLN   7          1HE2      GLN   7 -10.827   8.696 -19.593
   48   2HE2  GLN   7          2HE2      GLN   7 -11.239   9.454 -17.974
   49    H    ALA   8           H        ALA   8 -10.526   9.205 -14.692
   50    HA   ALA   8           HA       ALA   8  -9.522  11.857 -14.185
   51   1HB   ALA   8          1HB       ALA   8 -11.892  12.520 -13.815
   52   2HB   ALA   8          2HB       ALA   8 -11.736  11.439 -15.212
   53   3HB   ALA   8          3HB       ALA   8 -12.383  10.815 -13.674
   54    H    GLU   9           H        GLU   9 -10.598   9.338 -11.969
   55    HA   GLU   9           HA       GLU   9 -10.985  10.877  -9.528
   56   1HB   GLU   9          1HB       GLU   9 -10.304   7.916  -9.959
   57   2HB   GLU   9          2HB       GLU   9 -10.362   8.606  -8.343
   58   1HG   GLU   9          1HG       GLU   9 -12.788   9.052 -10.149
   59   2HG   GLU   9          2HG       GLU   9 -12.540   7.462  -9.438
   60    H    ALA  10           H        ALA  10  -8.154   8.884 -10.461
   61    HA   ALA  10           HA       ALA  10  -6.454   9.749  -8.219
   62   1HB   ALA  10          1HB       ALA  10  -4.637   8.521  -9.397
   63   2HB   ALA  10          2HB       ALA  10  -6.129   7.564  -9.343
   64   3HB   ALA  10          3HB       ALA  10  -5.641   8.367 -10.857
   65    NH1  ARG  11           NH1      ARG  11  -5.181  13.099 -18.654
   66    NH2  ARG  11           NH2      ARG  11  -3.385  11.726 -18.429
   67    H    ARG  11           H        ARG  11  -7.040  10.963 -11.450
   68    HA   ARG  11           HA       ARG  11  -4.560  12.569 -11.818
   69   1HB   ARG  11          1HB       ARG  11  -6.839  11.857 -13.442
   70   2HB   ARG  11          2HB       ARG  11  -6.821  13.611 -13.354
   71   1HG   ARG  11          1HG       ARG  11  -4.437  13.684 -14.122
   72   2HG   ARG  11          2HG       ARG  11  -4.391  11.922 -14.210
   73   1HD   ARG  11          1HD       ARG  11  -6.692  12.540 -15.734
   74   2HD   ARG  11          2HD       ARG  11  -5.610  13.876 -16.132
   75    HE   ARG  11           HE       ARG  11  -4.614  10.990 -16.366
   76   1HH1  ARG  11          1HH1      ARG  11  -2.851  11.089 -17.828
   77   2HH1  ARG  11          2HH1      ARG  11  -3.168  11.985 -19.398
   78   1HH2  ARG  11          1HH2      ARG  11  -5.994  13.542 -18.212
   79   2HH2  ARG  11          2HH2      ARG  11  -4.859  13.229 -19.620
   80    H    ALA  12           H        ALA  12  -7.792  13.113 -10.514
   81    HA   ALA  12           HA       ALA  12  -7.648  16.041 -10.165
   82   1HB   ALA  12          1HB       ALA  12  -9.608  15.775  -8.660
   83   2HB   ALA  12          2HB       ALA  12  -9.820  14.854 -10.163
   84   3HB   ALA  12          3HB       ALA  12  -9.403  14.006  -8.653
   85    H    PHE  13           H        PHE  13  -6.586  13.259  -8.285
   86    HA   PHE  13           HA       PHE  13  -6.084  14.638  -5.736
   87   1HB   PHE  13          1HB       PHE  13  -6.422  12.099  -6.201
   88   2HB   PHE  13          2HB       PHE  13  -4.735  12.034  -6.640
   89    HD1  PHE  13           HD1      PHE  13  -4.347  10.430  -4.732
   90    HD2  PHE  13           HD2      PHE  13  -5.791  14.412  -3.963
   91    HE1  PHE  13           HE1      PHE  13  -3.819  10.173  -2.342
   92    HE2  PHE  13           HE2      PHE  13  -5.249  14.137  -1.580
   93    HZ   PHE  13           HZ       PHE  13  -4.268  12.022  -0.763
   94    H    LEU  14           H        LEU  14  -3.817  13.313  -8.176
   95    HA   LEU  14           HA       LEU  14  -1.574  15.130  -7.165
   96   1HB   LEU  14          1HB       LEU  14  -0.064  13.517  -7.701
   97   2HB   LEU  14          2HB       LEU  14  -0.820  13.145  -9.235
   98    HG   LEU  14           HG       LEU  14  -2.341  12.133  -6.840
   99   1HD1  LEU  14          1HD1      LEU  14  -2.594  10.111  -8.284
  100   2HD1  LEU  14          2HD1      LEU  14  -3.038  11.578  -9.175
  101   3HD1  LEU  14          3HD1      LEU  14  -1.469  10.795  -9.485
  102   1HD2  LEU  14          1HD2      LEU  14   0.406  10.898  -7.554
  103   2HD2  LEU  14          2HD2      LEU  14  -0.022  11.685  -6.015
  104   3HD2  LEU  14          3HD2      LEU  14  -0.812  10.170  -6.475
  105    H    SER  15           H        SER  15  -0.800  16.703  -8.378
  106    HA   SER  15           HA       SER  15  -2.224  17.744 -10.728
  107   1HB   SER  15          1HB       SER  15  -0.645  18.917  -8.868
  108   2HB   SER  15          2HB       SER  15   0.570  18.732 -10.136
  109    HG   SER  15           HG       SER  15  -0.883  20.656 -10.076
  110    H    GLU  16           H        GLU  16  -0.528  18.534 -12.582
  111    HA   GLU  16           HA       GLU  16   0.132  16.055 -14.120
  112   1HB   GLU  16          1HB       GLU  16  -0.906  18.372 -14.949
  113   2HB   GLU  16          2HB       GLU  16   0.770  18.840 -15.156
  114   1HG   GLU  16          1HG       GLU  16  -0.326  16.247 -16.405
  115   2HG   GLU  16          2HG       GLU  16   1.164  17.082 -16.810
  116    H    GLU  17           H        GLU  17   1.804  18.637 -12.436
  117    HA   GLU  17           HA       GLU  17   4.510  18.243 -13.542
  118   1HB   GLU  17          1HB       GLU  17   5.372  19.719 -11.913
  119   2HB   GLU  17          2HB       GLU  17   3.784  20.332 -12.333
  120   1HG   GLU  17          1HG       GLU  17   4.356  18.663  -9.798
  121   2HG   GLU  17          2HG       GLU  17   2.829  19.430 -10.199
  122    H    MET  18           H        MET  18   2.701  16.842 -10.861
  123    HA   MET  18           HA       MET  18   4.946  15.196  -9.769
  124   1HB   MET  18          1HB       MET  18   1.987  14.673  -9.183
  125   2HB   MET  18          2HB       MET  18   3.388  14.264  -8.209
  126   1HG   MET  18          1HG       MET  18   2.651  17.202  -8.753
  127   2HG   MET  18          2HG       MET  18   1.939  16.277  -7.420
  128   1HE   MET  18          1HE       MET  18   3.914  14.477  -6.040
  129   2HE   MET  18          2HE       MET  18   4.821  15.579  -4.962
  130   3HE   MET  18          3HE       MET  18   3.057  15.788  -5.169
  131    H    ILE  19           H        ILE  19   2.197  14.769 -11.951
  132    HA   ILE  19           HA       ILE  19   2.261  11.920 -12.459
  133    HB   ILE  19           HB       ILE  19   1.388  14.286 -14.129
  134   1HG1  ILE  19          1HG1      ILE  19  -0.227  11.759 -13.461
  135   2HG1  ILE  19          2HG1      ILE  19  -0.011  13.014 -12.259
  136   1HG2  ILE  19          1HG2      ILE  19   0.723  12.818 -16.049
  137   2HG2  ILE  19          2HG2      ILE  19   2.474  12.794 -15.844
  138   3HG2  ILE  19          3HG2      ILE  19   1.504  11.415 -15.277
  139   1HD1  ILE  19          1HD1      ILE  19  -1.398  13.440 -14.972
  140   2HD1  ILE  19          2HD1      ILE  19  -2.147  13.384 -13.364
  141   3HD1  ILE  19          3HD1      ILE  19  -1.064  14.731 -13.786
  142    H    ALA  20           H        ALA  20   4.318  14.572 -13.559
  143    HA   ALA  20           HA       ALA  20   5.770  13.412 -15.726
  144   1HB   ALA  20          1HB       ALA  20   7.588  15.035 -15.201
  145   2HB   ALA  20          2HB       ALA  20   5.988  15.793 -15.084
  146   3HB   ALA  20          3HB       ALA  20   6.878  15.360 -13.602
  147    H    GLU  21           H        GLU  21   6.626  13.324 -12.250
  148    HA   GLU  21           HA       GLU  21   9.097  11.829 -12.430
  149   1HB   GLU  21          1HB       GLU  21   8.527  11.138  -9.972
  150   2HB   GLU  21          2HB       GLU  21   7.099  12.140 -10.141
  151   1HG   GLU  21          1HG       GLU  21  10.041  12.993 -10.140
  152   2HG   GLU  21          2HG       GLU  21   8.853  14.035 -10.905
  153    H    PHE  22           H        PHE  22   5.726  10.820 -12.381
  154    HA   PHE  22           HA       PHE  22   6.202   7.928 -11.914
  155   1HB   PHE  22          1HB       PHE  22   3.651   9.254 -13.019
  156   2HB   PHE  22          2HB       PHE  22   3.791   7.634 -12.393
  157    HD1  PHE  22           HD1      PHE  22   2.765  10.877 -11.492
  158    HD2  PHE  22           HD2      PHE  22   4.896   7.511  -9.861
  159    HE1  PHE  22           HE1      PHE  22   2.345  11.701  -9.214
  160    HE2  PHE  22           HE2      PHE  22   4.465   8.353  -7.589
  161    HZ   PHE  22           HZ       PHE  22   3.180  10.438  -7.260
  162    H    LYS  23           H        LYS  23   5.889  10.034 -14.713
  163    HA   LYS  23           HA       LYS  23   5.253   8.072 -16.807
  164   1HB   LYS  23          1HB       LYS  23   6.963  10.516 -17.435
  165   2HB   LYS  23          2HB       LYS  23   5.740   9.741 -18.418
  166   1HG   LYS  23          1HG       LYS  23   4.005  10.605 -16.613
  167   2HG   LYS  23          2HG       LYS  23   5.330  11.601 -16.031
  168   1HD   LYS  23          1HD       LYS  23   4.570  11.692 -18.998
  169   2HD   LYS  23          2HD       LYS  23   5.470  12.891 -18.062
  170   1HE   LYS  23          1HE       LYS  23   3.404  13.483 -16.754
  171   2HE   LYS  23          2HE       LYS  23   2.478  12.237 -17.605
  172   1HZ   LYS  23          1HZ       LYS  23   3.342  13.571 -19.698
  173   2HZ   LYS  23          2HZ       LYS  23   3.464  14.812 -18.614
  174   3HZ   LYS  23          3HZ       LYS  23   2.008  14.072 -18.861
  175    H    ALA  24           H        ALA  24   8.275   9.242 -15.378
  176    HA   ALA  24           HA       ALA  24  10.202   8.060 -17.224
  177   1HB   ALA  24          1HB       ALA  24  11.864   8.359 -15.399
  178   2HB   ALA  24          2HB       ALA  24  10.849   9.802 -15.587
  179   3HB   ALA  24          3HB       ALA  24  10.564   8.687 -14.227
  180    H    ALA  25           H        ALA  25   8.987   6.894 -14.063
  181    HA   ALA  25           HA       ALA  25  10.343   4.285 -14.071
  182   1HB   ALA  25          1HB       ALA  25   8.849   3.733 -12.160
  183   2HB   ALA  25          2HB       ALA  25   9.555   5.349 -11.974
  184   3HB   ALA  25          3HB       ALA  25   7.854   5.174 -12.476
  185    H    PHE  26           H        PHE  26   7.413   5.476 -15.538
  186    HA   PHE  26           HA       PHE  26   5.920   2.951 -15.811
  187   1HB   PHE  26          1HB       PHE  26   4.587   4.894 -16.044
  188   2HB   PHE  26          2HB       PHE  26   5.671   5.674 -17.165
  189    HD1  PHE  26           HD1      PHE  26   3.591   2.482 -16.955
  190    HD2  PHE  26           HD2      PHE  26   5.013   5.675 -19.464
  191    HE1  PHE  26           HE1      PHE  26   2.152   1.695 -18.790
  192    HE2  PHE  26           HE2      PHE  26   3.576   4.865 -21.292
  193    HZ   PHE  26           HZ       PHE  26   2.155   2.871 -20.964
  194    H    ASP  27           H        ASP  27   8.244   4.704 -17.835
  195    HA   ASP  27           HA       ASP  27   8.147   2.943 -20.191
  196   1HB   ASP  27          1HB       ASP  27  10.034   5.130 -19.283
  197   2HB   ASP  27          2HB       ASP  27  10.636   3.995 -20.469
  198    H    MET  28           H        MET  28  10.272   3.115 -17.342
  199    HA   MET  28           HA       MET  28  12.141   1.000 -17.862
  200   1HB   MET  28          1HB       MET  28  11.064   2.203 -15.323
  201   2HB   MET  28          2HB       MET  28  12.714   2.036 -15.895
  202   1HG   MET  28          1HG       MET  28  11.044   0.030 -14.327
  203   2HG   MET  28          2HG       MET  28  12.306  -0.596 -15.401
  204   1HE   MET  28          1HE       MET  28  11.957   2.715 -13.116
  205   2HE   MET  28          2HE       MET  28  13.689   2.928 -12.721
  206   3HE   MET  28          3HE       MET  28  13.147   3.012 -14.423
  207    H    PHE  29           H        PHE  29   9.120   0.657 -15.971
  208    HA   PHE  29           HA       PHE  29   8.919  -2.174 -15.790
  209   1HB   PHE  29          1HB       PHE  29   6.303  -0.774 -16.369
  210   2HB   PHE  29          2HB       PHE  29   7.238  -0.112 -15.055
  211    HD1  PHE  29           HD1      PHE  29   4.984  -2.771 -16.041
  212    HD2  PHE  29           HD2      PHE  29   8.008  -1.783 -13.141
  213    HE1  PHE  29           HE1      PHE  29   4.127  -4.517 -14.533
  214    HE2  PHE  29           HE2      PHE  29   7.131  -3.530 -11.647
  215    HZ   PHE  29           HZ       PHE  29   5.200  -4.904 -12.341
  216    H    ASP  30           H        ASP  30   8.087  -0.040 -18.484
  217    HA   ASP  30           HA       ASP  30   6.893  -2.173 -20.213
  218   1HB   ASP  30          1HB       ASP  30   7.798   0.497 -21.358
  219   2HB   ASP  30          2HB       ASP  30   6.453   0.471 -20.241
  220    H    ALA  31           H        ALA  31   7.814  -2.761 -22.280
  221    HA   ALA  31           HA       ALA  31  10.821  -3.268 -22.094
  222   1HB   ALA  31          1HB       ALA  31  10.414  -5.135 -23.703
  223   2HB   ALA  31          2HB       ALA  31   9.415  -5.292 -22.245
  224   3HB   ALA  31          3HB       ALA  31   8.681  -4.736 -23.771
  225    H    ASP  32           H        ASP  32   8.253  -2.113 -24.256
  226    HA   ASP  32           HA       ASP  32  10.193  -1.227 -26.409
  227   1HB   ASP  32          1HB       ASP  32   8.478  -1.218 -27.886
  228   2HB   ASP  32          2HB       ASP  32   7.402  -0.349 -26.816
  229    H    GLY  33           H        GLY  33   7.555   0.291 -24.506
  230   1HA   GLY  33          1HA       GLY  33   8.324   2.308 -22.964
  231   2HA   GLY  33          2HA       GLY  33   9.195   2.866 -24.374
  232    H    GLY  34           H        GLY  34   6.451   3.229 -22.595
  233   1HA   GLY  34          1HA       GLY  34   4.388   4.476 -22.891
  234   2HA   GLY  34          2HA       GLY  34   5.295   5.364 -24.123
  235    H    GLY  35           H        GLY  35   3.541   2.309 -23.627
  236   1HA   GLY  35          1HA       GLY  35   1.794   2.590 -25.986
  237   2HA   GLY  35          2HA       GLY  35   3.140   1.522 -26.408
  238    H    ASP  36           H        ASP  36   1.686   1.839 -23.204
  239    HA   ASP  36           HA       ASP  36   0.278   0.389 -21.888
  240   1HB   ASP  36          1HB       ASP  36  -1.117  -1.287 -22.862
  241   2HB   ASP  36          2HB       ASP  36  -0.071  -1.516 -24.243
  242    H    ILE  37           H        ILE  37   0.300  -2.014 -21.205
  243    HA   ILE  37           HA       ILE  37   3.048  -3.294 -21.483
  244    HB   ILE  37           HB       ILE  37   1.989  -3.278 -18.691
  245   1HG1  ILE  37          1HG1      ILE  37   2.951  -0.705 -19.976
  246   2HG1  ILE  37          2HG1      ILE  37   1.764  -0.957 -18.711
  247   1HG2  ILE  37          1HG2      ILE  37   4.375  -3.421 -18.092
  248   2HG2  ILE  37          2HG2      ILE  37   4.005  -4.599 -19.360
  249   3HG2  ILE  37          3HG2      ILE  37   4.864  -3.096 -19.773
  250   1HD1  ILE  37          1HD1      ILE  37   4.811  -1.082 -18.290
  251   2HD1  ILE  37          2HD1      ILE  37   3.690   0.183 -17.741
  252   3HD1  ILE  37          3HD1      ILE  37   3.596  -1.446 -17.034
  253    H    SER  38           H        SER  38   2.598  -5.153 -22.334
  254    HA   SER  38           HA       SER  38   0.146  -6.767 -21.786
  255   1HB   SER  38          1HB       SER  38   1.604  -6.724 -23.962
  256   2HB   SER  38          2HB       SER  38   0.888  -8.247 -23.429
  257    HG   SER  38           HG       SER  38   3.079  -8.423 -23.979
  258    H    THR  39           H        THR  39   0.749  -9.227 -21.316
  259    HA   THR  39           HA       THR  39   1.646  -9.346 -18.474
  260    HB   THR  39           HB       THR  39   1.339 -11.995 -19.111
  261    HG1  THR  39           HG1      THR  39   0.500 -12.114 -20.961
  262   1HG2  THR  39          1HG2      THR  39  -0.936 -11.891 -18.193
  263   2HG2  THR  39          2HG2      THR  39   0.099 -10.776 -17.272
  264   3HG2  THR  39          3HG2      THR  39  -1.042 -10.140 -18.487
  265    H    LYS  40           H        LYS  40   2.941 -10.163 -21.640
  266    HA   LYS  40           HA       LYS  40   5.239 -11.759 -20.822
  267   1HB   LYS  40          1HB       LYS  40   4.472 -11.843 -23.093
  268   2HB   LYS  40          2HB       LYS  40   4.677 -10.133 -23.369
  269   1HG   LYS  40          1HG       LYS  40   6.381 -12.020 -24.255
  270   2HG   LYS  40          2HG       LYS  40   6.941 -10.417 -23.857
  271   1HD   LYS  40          1HD       LYS  40   7.390 -11.660 -21.404
  272   2HD   LYS  40          2HD       LYS  40   7.444 -13.030 -22.475
  273   1HE   LYS  40          1HE       LYS  40   9.105 -10.942 -23.652
  274   2HE   LYS  40          2HE       LYS  40   9.599 -11.198 -21.983
  275   1HZ   LYS  40          1HZ       LYS  40   9.775 -12.993 -24.273
  276   2HZ   LYS  40          2HZ       LYS  40   9.380 -13.734 -22.850
  277   3HZ   LYS  40          3HZ       LYS  40  10.775 -12.855 -22.965
  278    H    GLU  41           H        GLU  41   4.687  -8.282 -21.216
  279    HA   GLU  41           HA       GLU  41   7.527  -7.458 -20.839
  280   1HB   GLU  41          1HB       GLU  41   6.865  -5.232 -21.148
  281   2HB   GLU  41          2HB       GLU  41   5.237  -5.501 -20.562
  282   1HG   GLU  41          1HG       GLU  41   6.172  -6.769 -23.200
  283   2HG   GLU  41          2HG       GLU  41   4.533  -6.550 -22.627
  284    H    LEU  42           H        LEU  42   4.615  -7.680 -18.854
  285    HA   LEU  42           HA       LEU  42   5.349  -6.118 -16.544
  286   1HB   LEU  42          1HB       LEU  42   3.385  -8.305 -17.095
  287   2HB   LEU  42          2HB       LEU  42   3.918  -8.268 -15.428
  288    HG   LEU  42           HG       LEU  42   3.338  -5.558 -15.864
  289   1HD1  LEU  42          1HD1      LEU  42   1.324  -7.649 -14.826
  290   2HD1  LEU  42          2HD1      LEU  42   2.702  -7.059 -13.885
  291   3HD1  LEU  42          3HD1      LEU  42   1.419  -5.926 -14.378
  292   1HD2  LEU  42          1HD2      LEU  42   1.157  -5.386 -17.011
  293   2HD2  LEU  42          2HD2      LEU  42   2.314  -6.136 -18.138
  294   3HD2  LEU  42          3HD2      LEU  42   1.114  -7.143 -17.307
  295    H    GLY  43           H        GLY  43   6.101  -9.479 -17.392
  296   1HA   GLY  43          1HA       GLY  43   7.533 -11.153 -16.377
  297   2HA   GLY  43          2HA       GLY  43   7.277 -10.315 -14.843
  298    H    THR  44           H        THR  44   8.597  -8.722 -17.682
  299    HA   THR  44           HA       THR  44  11.393  -9.212 -17.471
  300    HB   THR  44           HB       THR  44   9.869  -6.821 -18.541
  301    HG1  THR  44           HG1      THR  44   9.929  -8.386 -19.934
  302   1HG2  THR  44          1HG2      THR  44  11.979  -5.837 -19.452
  303   2HG2  THR  44          2HG2      THR  44  11.938  -5.738 -17.679
  304   3HG2  THR  44          3HG2      THR  44  12.946  -6.972 -18.478
  305    H    VAL  45           H        VAL  45   9.555  -6.562 -15.935
  306    HA   VAL  45           HA       VAL  45  11.903  -5.539 -14.404
  307    HB   VAL  45           HB       VAL  45   9.129  -4.612 -14.899
  308   1HG1  VAL  45          1HG1      VAL  45  11.672  -2.988 -14.264
  309   2HG1  VAL  45          2HG1      VAL  45  11.283  -3.591 -15.880
  310   3HG1  VAL  45          3HG1      VAL  45  10.197  -2.423 -15.092
  311   1HG2  VAL  45          1HG2      VAL  45   8.841  -3.190 -12.934
  312   2HG2  VAL  45          2HG2      VAL  45   9.071  -4.845 -12.325
  313   3HG2  VAL  45          3HG2      VAL  45  10.409  -3.690 -12.248
  314    H    MET  46           H        MET  46   9.190  -7.704 -13.862
  315    HA   MET  46           HA       MET  46   9.113  -7.902 -10.980
  316   1HB   MET  46          1HB       MET  46   8.442  -9.909 -13.177
  317   2HB   MET  46          2HB       MET  46   8.488 -10.441 -11.506
  318   1HG   MET  46          1HG       MET  46   6.889  -8.164 -11.250
  319   2HG   MET  46          2HG       MET  46   6.463  -8.706 -12.882
  320   1HE   MET  46          1HE       MET  46   4.148  -9.736 -12.824
  321   2HE   MET  46          2HE       MET  46   3.471 -10.560 -11.389
  322   3HE   MET  46          3HE       MET  46   3.971  -8.848 -11.278
  323    NH1  ARG  47           NH1      ARG  47  17.352 -11.607 -17.295
  324    NH2  ARG  47           NH2      ARG  47  18.277 -12.933 -15.697
  325    H    ARG  47           H        ARG  47  11.405  -9.156 -13.324
  326    HA   ARG  47           HA       ARG  47  12.733 -11.139 -11.543
  327   1HB   ARG  47          1HB       ARG  47  13.591 -11.903 -13.470
  328   2HB   ARG  47          2HB       ARG  47  12.693 -10.645 -14.310
  329   1HG   ARG  47          1HG       ARG  47  14.638  -9.071 -14.152
  330   2HG   ARG  47          2HG       ARG  47  15.558 -10.274 -13.246
  331   1HD   ARG  47          1HD       ARG  47  14.478 -11.264 -15.899
  332   2HD   ARG  47          2HD       ARG  47  15.658  -9.967 -16.010
  333    HE   ARG  47           HE       ARG  47  16.561 -12.170 -14.205
  334   1HH1  ARG  47          1HH1      ARG  47  16.614 -10.939 -17.544
  335   2HH1  ARG  47          2HH1      ARG  47  18.098 -11.955 -17.906
  336   1HH2  ARG  47          1HH2      ARG  47  18.248 -13.278 -14.731
  337   2HH2  ARG  47          2HH2      ARG  47  18.959 -13.187 -16.420
  338    H    MET  48           H        MET  48  13.170  -7.749 -12.325
  339    HA   MET  48           HA       MET  48  15.904  -7.190 -11.826
  340   1HB   MET  48          1HB       MET  48  13.408  -5.550 -11.487
  341   2HB   MET  48          2HB       MET  48  14.790  -5.002 -10.556
  342   1HG   MET  48          1HG       MET  48  16.080  -5.284 -12.948
  343   2HG   MET  48          2HG       MET  48  14.436  -5.077 -13.574
  344   1HE   MET  48          1HE       MET  48  13.063  -2.861 -13.588
  345   2HE   MET  48          2HE       MET  48  14.049  -1.371 -13.664
  346   3HE   MET  48          3HE       MET  48  14.460  -2.765 -14.705
  347    H    LEU  49           H        LEU  49  13.308  -7.340  -9.366
  348    HA   LEU  49           HA       LEU  49  14.785  -6.710  -6.995
  349   1HB   LEU  49          1HB       LEU  49  12.459  -6.875  -6.668
  350   2HB   LEU  49          2HB       LEU  49  13.119  -8.201  -5.737
  351    HG   LEU  49           HG       LEU  49  12.397  -9.091  -8.477
  352   1HD1  LEU  49          1HD1      LEU  49  10.074  -8.021  -6.755
  353   2HD1  LEU  49          2HD1      LEU  49  10.694  -7.213  -8.207
  354   3HD1  LEU  49          3HD1      LEU  49   9.950  -8.826  -8.340
  355   1HD2  LEU  49          1HD2      LEU  49  11.268 -10.926  -7.290
  356   2HD2  LEU  49          2HD2      LEU  49  12.799 -10.611  -6.437
  357   3HD2  LEU  49          3HD2      LEU  49  11.276 -10.020  -5.755
  358    H    GLY  50           H        GLY  50  14.120  -9.984  -8.289
  359   1HA   GLY  50          1HA       GLY  50  16.481 -11.281  -8.645
  360   2HA   GLY  50          2HA       GLY  50  16.623 -11.059  -6.895
  361    H    GLN  51           H        GLN  51  13.904 -11.959  -9.029
  362    HA   GLN  51           HA       GLN  51  13.642 -14.659  -7.594
  363   1HB   GLN  51          1HB       GLN  51  11.004 -13.903  -8.412
  364   2HB   GLN  51          2HB       GLN  51  11.670 -12.484  -7.625
  365   1HG   GLN  51          1HG       GLN  51  11.275 -15.275  -6.422
  366   2HG   GLN  51          2HG       GLN  51  10.499 -13.782  -5.945
  367   1HE2  GLN  51          1HE2      GLN  51  13.356 -12.674  -3.946
  368   2HE2  GLN  51          2HE2      GLN  51  11.886 -12.115  -4.891
  369    H    ASN  52           H        ASN  52  11.710 -15.768  -9.089
  370    HA   ASN  52           HA       ASN  52  12.099 -15.263 -12.012
  371   1HB   ASN  52          1HB       ASN  52  12.791 -18.089 -11.078
  372   2HB   ASN  52          2HB       ASN  52  14.024 -16.847 -11.088
  373   1HD2  ASN  52          1HD2      ASN  52  13.892 -18.798 -14.402
  374   2HD2  ASN  52          2HD2      ASN  52  13.999 -19.257 -12.629
  375    HA   PRO  53           HA       PRO  53   7.827 -16.993 -10.934
  376   1HB   PRO  53          1HB       PRO  53   6.917 -14.827 -10.928
  377   2HB   PRO  53          2HB       PRO  53   6.329 -15.333 -12.520
  378   1HG   PRO  53          1HG       PRO  53   8.006 -14.219 -13.730
  379   2HG   PRO  53          2HG       PRO  53   7.888 -13.102 -12.350
  380   1HD   PRO  53          1HD       PRO  53   9.957 -13.890 -11.430
  381   2HD   PRO  53          2HD       PRO  53  10.258 -14.443 -13.104
  382    H    THR  54           H        THR  54   5.936 -17.598 -12.555
  383    HA   THR  54           HA       THR  54   7.128 -19.040 -14.979
  384    HB   THR  54           HB       THR  54   5.908 -20.242 -12.833
  385    HG1  THR  54           HG1      THR  54   7.112 -21.061 -14.660
  386   1HG2  THR  54          1HG2      THR  54   3.725 -21.167 -13.538
  387   2HG2  THR  54          2HG2      THR  54   3.606 -19.399 -13.386
  388   3HG2  THR  54          3HG2      THR  54   3.715 -20.150 -14.999
  389    H    LYS  55           H        LYS  55   5.728 -19.278 -16.816
  390    HA   LYS  55           HA       LYS  55   4.729 -16.721 -17.773
  391   1HB   LYS  55          1HB       LYS  55   4.060 -19.458 -19.020
  392   2HB   LYS  55          2HB       LYS  55   5.634 -18.707 -19.181
  393   1HG   LYS  55          1HG       LYS  55   3.313 -16.976 -19.990
  394   2HG   LYS  55          2HG       LYS  55   4.910 -17.105 -20.705
  395   1HD   LYS  55          1HD       LYS  55   4.301 -19.056 -22.018
  396   2HD   LYS  55          2HD       LYS  55   2.935 -17.958 -22.128
  397   1HE   LYS  55          1HE       LYS  55   3.124 -20.505 -20.437
  398   2HE   LYS  55          2HE       LYS  55   1.855 -19.317 -20.148
  399   1HZ   LYS  55          1HZ       LYS  55   2.178 -20.177 -22.928
  400   2HZ   LYS  55          2HZ       LYS  55   0.796 -19.919 -22.060
  401   3HZ   LYS  55          3HZ       LYS  55   1.634 -21.331 -21.878
  402    H    GLU  56           H        GLU  56   3.149 -19.584 -16.442
  403    HA   GLU  56           HA       GLU  56   0.358 -18.811 -16.932
  404   1HB   GLU  56          1HB       GLU  56   1.748 -20.949 -15.364
  405   2HB   GLU  56          2HB       GLU  56   0.167 -20.505 -14.752
  406   1HG   GLU  56          1HG       GLU  56   0.705 -21.345 -17.676
  407   2HG   GLU  56          2HG       GLU  56   0.210 -22.456 -16.411
  408    H    GLU  57           H        GLU  57   2.681 -18.233 -14.344
  409    HA   GLU  57           HA       GLU  57   0.811 -17.196 -12.300
  410   1HB   GLU  57          1HB       GLU  57   3.757 -16.455 -12.352
  411   2HB   GLU  57          2HB       GLU  57   3.264 -18.102 -12.022
  412   1HG   GLU  57          1HG       GLU  57   1.792 -16.103 -10.329
  413   2HG   GLU  57          2HG       GLU  57   2.554 -17.619  -9.863
  414    H    LEU  58           H        LEU  58   2.661 -15.807 -14.956
  415    HA   LEU  58           HA       LEU  58   2.405 -12.958 -14.400
  416   1HB   LEU  58          1HB       LEU  58   3.186 -14.671 -16.679
  417   2HB   LEU  58          2HB       LEU  58   2.291 -13.268 -17.225
  418    HG   LEU  58           HG       LEU  58   4.702 -12.797 -17.255
  419   1HD1  LEU  58          1HD1      LEU  58   4.819 -13.221 -14.196
  420   2HD1  LEU  58          2HD1      LEU  58   5.380 -14.425 -15.365
  421   3HD1  LEU  58          3HD1      LEU  58   6.177 -12.835 -15.283
  422   1HD2  LEU  58          1HD2      LEU  58   4.748 -10.669 -16.010
  423   2HD2  LEU  58          2HD2      LEU  58   3.100 -10.920 -16.637
  424   3HD2  LEU  58          3HD2      LEU  58   3.447 -11.218 -14.924
  425    H    ASP  59           H        ASP  59   0.263 -15.368 -15.823
  426    HA   ASP  59           HA       ASP  59  -1.811 -13.493 -16.816
  427   1HB   ASP  59          1HB       ASP  59  -1.433 -15.792 -17.805
  428   2HB   ASP  59          2HB       ASP  59  -2.082 -16.514 -16.351
  429    H    ALA  60           H        ALA  60  -1.225 -15.315 -13.864
  430    HA   ALA  60           HA       ALA  60  -3.832 -14.967 -12.562
  431   1HB   ALA  60          1HB       ALA  60  -2.657 -15.641 -10.473
  432   2HB   ALA  60          2HB       ALA  60  -2.229 -16.703 -11.829
  433   3HB   ALA  60          3HB       ALA  60  -1.074 -15.466 -11.269
  434    H    ILE  61           H        ILE  61  -0.889 -13.031 -12.722
  435    HA   ILE  61           HA       ILE  61  -1.427 -11.170 -10.512
  436    HB   ILE  61           HB       ILE  61   0.574 -11.329 -12.715
  437   1HG1  ILE  61          1HG1      ILE  61   1.869 -11.781 -10.902
  438   2HG1  ILE  61          2HG1      ILE  61   0.532 -11.450  -9.821
  439   1HG2  ILE  61          1HG2      ILE  61   1.358  -8.952 -12.520
  440   2HG2  ILE  61          2HG2      ILE  61  -0.267  -9.015 -13.200
  441   3HG2  ILE  61          3HG2      ILE  61  -0.044  -8.554 -11.497
  442   1HD1  ILE  61          1HD1      ILE  61   1.132  -9.052  -9.619
  443   2HD1  ILE  61          2HD1      ILE  61   2.528 -10.084  -9.240
  444   3HD1  ILE  61          3HD1      ILE  61   2.444  -9.256 -10.812
  445    H    ILE  62           H        ILE  62  -2.140 -11.184 -13.987
  446    HA   ILE  62           HA       ILE  62  -3.309  -8.450 -14.097
  447    HB   ILE  62           HB       ILE  62  -3.309 -10.754 -16.101
  448   1HG1  ILE  62          1HG1      ILE  62  -1.615  -8.294 -15.663
  449   2HG1  ILE  62          2HG1      ILE  62  -1.176  -9.860 -16.311
  450   1HG2  ILE  62          1HG2      ILE  62  -4.356  -9.225 -17.795
  451   2HG2  ILE  62          2HG2      ILE  62  -5.463  -9.497 -16.450
  452   3HG2  ILE  62          3HG2      ILE  62  -4.568  -7.964 -16.555
  453   1HD1  ILE  62          1HD1      ILE  62  -2.594  -7.658 -17.926
  454   2HD1  ILE  62          2HD1      ILE  62  -0.913  -8.210 -18.079
  455   3HD1  ILE  62          3HD1      ILE  62  -2.244  -9.300 -18.532
  456    H    GLU  63           H        GLU  63  -4.461 -11.767 -13.692
  457    HA   GLU  63           HA       GLU  63  -7.289 -11.539 -13.862
  458   1HB   GLU  63          1HB       GLU  63  -5.750 -13.599 -13.227
  459   2HB   GLU  63          2HB       GLU  63  -6.087 -13.143 -11.569
  460   1HG   GLU  63          1HG       GLU  63  -8.322 -13.687 -13.626
  461   2HG   GLU  63          2HG       GLU  63  -7.603 -14.955 -12.648
  462    H    GLU  64           H        GLU  64  -5.316 -11.045 -10.912
  463    HA   GLU  64           HA       GLU  64  -7.351 -10.246  -9.071
  464   1HB   GLU  64          1HB       GLU  64  -4.382  -9.804  -9.216
  465   2HB   GLU  64          2HB       GLU  64  -5.257  -8.722  -8.150
  466   1HG   GLU  64          1HG       GLU  64  -6.325 -10.937  -7.126
  467   2HG   GLU  64          2HG       GLU  64  -4.696 -10.460  -6.679
  468    H    VAL  65           H        VAL  65  -5.075  -7.827 -10.355
  469    HA   VAL  65           HA       VAL  65  -6.996  -5.589 -10.139
  470    HB   VAL  65           HB       VAL  65  -4.335  -5.579 -10.065
  471   1HG1  VAL  65          1HG1      VAL  65  -3.278  -4.670 -12.142
  472   2HG1  VAL  65          2HG1      VAL  65  -3.934  -6.294 -12.426
  473   3HG1  VAL  65          3HG1      VAL  65  -4.804  -4.867 -13.039
  474   1HG2  VAL  65          1HG2      VAL  65  -5.941  -3.197 -11.223
  475   2HG2  VAL  65          2HG2      VAL  65  -5.723  -3.580  -9.498
  476   3HG2  VAL  65          3HG2      VAL  65  -4.328  -3.101 -10.476
  477    H    ASP  66           H        ASP  66  -6.367  -4.270 -12.636
  478    HA   ASP  66           HA       ASP  66  -7.355  -3.943 -14.796
  479   1HB   ASP  66          1HB       ASP  66  -7.383  -6.926 -15.336
  480   2HB   ASP  66          2HB       ASP  66  -5.835  -6.174 -15.027
  481    H    GLU  67           H        GLU  67  -9.153  -3.502 -13.155
  482    HA   GLU  67           HA       GLU  67 -11.503  -5.387 -13.170
  483   1HB   GLU  67          1HB       GLU  67 -12.475  -4.057 -11.500
  484   2HB   GLU  67          2HB       GLU  67 -10.761  -4.052 -11.127
  485   1HG   GLU  67          1HG       GLU  67 -10.508  -1.750 -11.617
  486   2HG   GLU  67          2HG       GLU  67 -11.800  -1.734 -12.804
  487    H    ASP  68           H        ASP  68 -10.529  -4.149 -15.699
  488    HA   ASP  68           HA       ASP  68 -12.996  -2.531 -16.519
  489   1HB   ASP  68          1HB       ASP  68 -11.647  -0.843 -17.119
  490   2HB   ASP  68          2HB       ASP  68 -11.120  -1.843 -18.453
  491    H    GLY  69           H        GLY  69 -10.487  -4.857 -17.497
  492   1HA   GLY  69          1HA       GLY  69 -11.055  -7.051 -18.618
  493   2HA   GLY  69          2HA       GLY  69 -12.515  -6.294 -19.271
  494    H    SER  70           H        SER  70  -9.043  -5.454 -19.277
  495    HA   SER  70           HA       SER  70  -9.190  -4.905 -22.293
  496   1HB   SER  70          1HB       SER  70  -7.188  -3.334 -21.807
  497   2HB   SER  70          2HB       SER  70  -8.796  -2.812 -21.297
  498    HG   SER  70           HG       SER  70  -7.514  -2.500 -19.597
  499    H    GLY  71           H        GLY  71  -7.259  -6.236 -19.624
  500   1HA   GLY  71          1HA       GLY  71  -5.810  -8.234 -19.676
  501   2HA   GLY  71          2HA       GLY  71  -5.962  -8.261 -21.438
  502    H    THR  72           H        THR  72  -5.120  -5.370 -19.636
  503    HA   THR  72           HA       THR  72  -2.167  -5.590 -20.052
  504    HB   THR  72           HB       THR  72  -1.856  -3.648 -21.509
  505    HG1  THR  72           HG1      THR  72  -4.249  -3.058 -20.912
  506   1HG2  THR  72          1HG2      THR  72  -2.561  -4.533 -23.696
  507   2HG2  THR  72          2HG2      THR  72  -1.973  -5.878 -22.694
  508   3HG2  THR  72          3HG2      THR  72  -3.723  -5.649 -22.946
  509    H    ILE  73           H        ILE  73  -1.348  -3.089 -19.685
  510    HA   ILE  73           HA       ILE  73  -2.875  -1.829 -17.369
  511    HB   ILE  73           HB       ILE  73   0.080  -2.584 -17.106
  512   1HG1  ILE  73          1HG1      ILE  73  -2.412  -4.094 -16.317
  513   2HG1  ILE  73          2HG1      ILE  73  -0.814  -4.691 -16.713
  514   1HG2  ILE  73          1HG2      ILE  73  -0.089  -1.753 -14.764
  515   2HG2  ILE  73          2HG2      ILE  73  -0.558  -0.465 -15.882
  516   3HG2  ILE  73          3HG2      ILE  73  -1.809  -1.354 -14.978
  517   1HD1  ILE  73          1HD1      ILE  73  -1.582  -3.500 -13.984
  518   2HD1  ILE  73          2HD1      ILE  73  -1.269  -5.204 -14.376
  519   3HD1  ILE  73          3HD1      ILE  73   0.062  -4.024 -14.443
  520    H    ASP  74           H        ASP  74  -3.312  -0.424 -19.189
  521    HA   ASP  74           HA       ASP  74  -1.216   1.135 -20.559
  522   1HB   ASP  74          1HB       ASP  74  -2.890   2.279 -21.698
  523   2HB   ASP  74          2HB       ASP  74  -3.986   2.314 -20.336
  524    H    PHE  75           H        PHE  75  -0.862   3.430 -20.320
  525    HA   PHE  75           HA       PHE  75  -0.128   4.349 -17.674
  526   1HB   PHE  75          1HB       PHE  75  -0.764   6.129 -20.107
  527   2HB   PHE  75          2HB       PHE  75   0.741   5.279 -19.883
  528    HD1  PHE  75           HD1      PHE  75  -1.096   8.302 -19.103
  529    HD2  PHE  75           HD2      PHE  75   2.165   5.852 -17.729
  530    HE1  PHE  75           HE1      PHE  75  -0.237  10.179 -17.764
  531    HE2  PHE  75           HE2      PHE  75   3.004   7.742 -16.391
  532    HZ   PHE  75           HZ       PHE  75   1.815   9.906 -16.414
  533    H    GLU  76           H        GLU  76  -3.179   4.390 -19.370
  534    HA   GLU  76           HA       GLU  76  -4.461   6.429 -17.543
  535   1HB   GLU  76          1HB       GLU  76  -5.375   5.032 -20.080
  536   2HB   GLU  76          2HB       GLU  76  -6.554   5.768 -19.015
  537   1HG   GLU  76          1HG       GLU  76  -4.753   7.044 -20.975
  538   2HG   GLU  76          2HG       GLU  76  -6.233   7.641 -20.256
  539    H    GLU  77           H        GLU  77  -3.533   4.178 -16.220
  540    HA   GLU  77           HA       GLU  77  -5.956   3.311 -14.739
  541   1HB   GLU  77          1HB       GLU  77  -6.474   1.395 -15.717
  542   2HB   GLU  77          2HB       GLU  77  -5.213   1.612 -16.910
  543   1HG   GLU  77          1HG       GLU  77  -3.574   0.534 -15.144
  544   2HG   GLU  77          2HG       GLU  77  -5.020   0.058 -14.262
  545    H    PHE  78           H        PHE  78  -2.527   2.759 -15.457
  546    HA   PHE  78           HA       PHE  78  -1.639   1.532 -12.999
  547   1HB   PHE  78          1HB       PHE  78  -0.038   3.531 -14.717
  548   2HB   PHE  78          2HB       PHE  78  -0.236   1.844 -15.115
  549    HD1  PHE  78           HD1      PHE  78  -0.047   1.149 -11.869
  550    HD2  PHE  78           HD2      PHE  78   2.450   3.152 -14.742
  551    HE1  PHE  78           HE1      PHE  78   1.944   0.628 -10.518
  552    HE2  PHE  78           HE2      PHE  78   4.430   2.619 -13.381
  553    HZ   PHE  78           HZ       PHE  78   4.184   1.349 -11.276
  554    H    LEU  79           H        LEU  79  -2.315   4.888 -13.828
  555    HA   LEU  79           HA       LEU  79  -1.108   6.228 -11.527
  556   1HB   LEU  79          1HB       LEU  79  -2.911   8.069 -12.067
  557   2HB   LEU  79          2HB       LEU  79  -3.372   7.058 -13.419
  558    HG   LEU  79           HG       LEU  79  -1.454   7.527 -14.659
  559   1HD1  LEU  79          1HD1      LEU  79  -0.911   9.956 -14.473
  560   2HD1  LEU  79          2HD1      LEU  79  -2.651   9.687 -14.265
  561   3HD1  LEU  79          3HD1      LEU  79  -1.630  10.020 -12.844
  562   1HD2  LEU  79          1HD2      LEU  79   0.130   8.135 -12.072
  563   2HD2  LEU  79          2HD2      LEU  79   0.265   6.662 -13.063
  564   3HD2  LEU  79          3HD2      LEU  79   0.779   8.218 -13.729
  565    H    VAL  80           H        VAL  80  -4.379   4.961 -12.127
  566    HA   VAL  80           HA       VAL  80  -5.603   5.814  -9.578
  567    HB   VAL  80           HB       VAL  80  -6.445   4.115 -11.875
  568   1HG1  VAL  80          1HG1      VAL  80  -8.348   3.018 -10.673
  569   2HG1  VAL  80          2HG1      VAL  80  -6.797   2.411 -10.079
  570   3HG1  VAL  80          3HG1      VAL  80  -7.712   3.587  -9.108
  571   1HG2  VAL  80          1HG2      VAL  80  -8.051   6.032 -10.061
  572   2HG2  VAL  80          2HG2      VAL  80  -7.282   6.481 -11.601
  573   3HG2  VAL  80          3HG2      VAL  80  -8.610   5.310 -11.590
  574    H    MET  81           H        MET  81  -3.733   3.042 -10.679
  575    HA   MET  81           HA       MET  81  -4.102   1.163  -8.505
  576   1HB   MET  81          1HB       MET  81  -2.633   1.051 -10.804
  577   2HB   MET  81          2HB       MET  81  -1.329   1.394  -9.682
  578   1HG   MET  81          1HG       MET  81  -2.353  -0.648  -8.261
  579   2HG   MET  81          2HG       MET  81  -3.112  -1.079  -9.802
  580   1HE   MET  81          1HE       MET  81   0.180  -0.627  -7.760
  581   2HE   MET  81          2HE       MET  81   1.476  -0.860  -8.971
  582   3HE   MET  81          3HE       MET  81   0.506   0.641  -8.984
  583    H    MET  82           H        MET  82  -1.532   3.615  -8.932
  584    HA   MET  82           HA       MET  82  -0.284   3.184  -6.296
  585   1HB   MET  82          1HB       MET  82   0.063   5.253  -8.496
  586   2HB   MET  82          2HB       MET  82   0.733   5.603  -6.914
  587   1HG   MET  82          1HG       MET  82   1.385   2.860  -8.040
  588   2HG   MET  82          2HG       MET  82   2.087   4.252  -8.875
  589   1HE   MET  82          1HE       MET  82   4.257   2.393  -7.765
  590   2HE   MET  82          2HE       MET  82   3.074   1.655  -6.645
  591   3HE   MET  82          3HE       MET  82   4.566   2.400  -5.999
  592    H    VAL  83           H        VAL  83  -2.864   5.236  -7.488
  593    HA   VAL  83           HA       VAL  83  -2.885   7.285  -5.396
  594    HB   VAL  83           HB       VAL  83  -4.494   6.688  -7.736
  595   1HG1  VAL  83          1HG1      VAL  83  -6.728   7.524  -6.993
  596   2HG1  VAL  83          2HG1      VAL  83  -6.336   5.998  -6.188
  597   3HG1  VAL  83          3HG1      VAL  83  -6.188   7.530  -5.295
  598   1HG2  VAL  83          1HG2      VAL  83  -4.316   9.272  -6.048
  599   2HG2  VAL  83          2HG2      VAL  83  -3.263   8.852  -7.419
  600   3HG2  VAL  83          3HG2      VAL  83  -4.987   9.139  -7.695
  601    NH1  ARG  84           NH1      ARG  84  -8.041  -1.216  -7.811
  602    NH2  ARG  84           NH2      ARG  84  -8.762  -2.140  -5.865
  603    H    ARG  84           H        ARG  84  -4.661   4.223  -5.827
  604    HA   ARG  84           HA       ARG  84  -6.547   4.300  -3.646
  605   1HB   ARG  84          1HB       ARG  84  -5.131   2.007  -5.075
  606   2HB   ARG  84          2HB       ARG  84  -6.025   1.665  -3.601
  607   1HG   ARG  84          1HG       ARG  84  -7.460   3.305  -5.716
  608   2HG   ARG  84          2HG       ARG  84  -8.130   2.187  -4.525
  609   1HD   ARG  84          1HD       ARG  84  -6.297   0.757  -6.364
  610   2HD   ARG  84          2HD       ARG  84  -7.537   1.615  -7.281
  611    HE   ARG  84           HE       ARG  84  -8.990   0.285  -5.205
  612   1HH1  ARG  84          1HH1      ARG  84  -8.990  -2.006  -4.874
  613   2HH1  ARG  84          2HH1      ARG  84  -8.818  -3.016  -6.396
  614   1HH2  ARG  84          1HH2      ARG  84  -7.667  -0.390  -8.291
  615   2HH2  ARG  84          2HH2      ARG  84  -8.209  -2.142  -8.220
  616    H    GLN  85           H        GLN  85  -3.206   3.006  -3.656
  617    HA   GLN  85           HA       GLN  85  -3.172   2.283  -0.777
  618   1HB   GLN  85          1HB       GLN  85  -1.007   2.427  -2.932
  619   2HB   GLN  85          2HB       GLN  85  -0.584   2.172  -1.249
  620   1HG   GLN  85          1HG       GLN  85  -1.397   0.209  -3.164
  621   2HG   GLN  85          2HG       GLN  85  -2.749   0.317  -2.058
  622   1HE2  GLN  85          1HE2      GLN  85   0.907  -0.978  -0.512
  623   2HE2  GLN  85          2HE2      GLN  85   0.846   0.082  -2.008
  624    H    MET  86           H        MET  86  -2.214   5.063  -2.717
  625    HA   MET  86           HA       MET  86  -0.492   6.511  -0.915
  626   1HB   MET  86          1HB       MET  86  -2.119   8.477  -2.285
  627   2HB   MET  86          2HB       MET  86  -1.903   7.128  -3.385
  628   1HG   MET  86          1HG       MET  86   0.685   7.805  -2.109
  629   2HG   MET  86          2HG       MET  86   0.266   7.691  -3.826
  630   1HE   MET  86          1HE       MET  86  -2.367   9.768  -3.795
  631   2HE   MET  86          2HE       MET  86  -1.566  11.269  -4.347
  632   3HE   MET  86          3HE       MET  86  -1.192   9.715  -5.146
  633    H    LYS  87           H        LYS  87  -4.005   6.270  -1.085
  634    HA   LYS  87           HA       LYS  87  -4.920   8.418   0.573
  635   1HB   LYS  87          1HB       LYS  87  -6.035   5.597   0.179
  636   2HB   LYS  87          2HB       LYS  87  -6.732   6.649   1.402
  637   1HG   LYS  87          1HG       LYS  87  -7.718   6.593  -1.076
  638   2HG   LYS  87          2HG       LYS  87  -6.430   7.728  -1.443
  639   1HD   LYS  87          1HD       LYS  87  -7.571   8.818   0.910
  640   2HD   LYS  87          2HD       LYS  87  -7.799   9.373  -0.745
  641   1HE   LYS  87          1HE       LYS  87  -9.601   7.104   0.246
  642   2HE   LYS  87          2HE       LYS  87  -9.930   8.748   0.810
  643   1HZ   LYS  87          1HZ       LYS  87 -10.174   7.649  -1.882
  644   2HZ   LYS  87          2HZ       LYS  87  -9.659   9.216  -1.790
  645   3HZ   LYS  87          3HZ       LYS  87 -11.101   8.780  -1.113
  646    H    GLU  88           H        GLU  88  -5.356   8.615   2.772
  647    HA   GLU  88           HA       GLU  88  -3.566   6.950   4.622
  648   1HB   GLU  88          1HB       GLU  88  -3.120   9.523   4.222
  649   2HB   GLU  88          2HB       GLU  88  -4.475   9.779   5.304
  650   1HG   GLU  88          1HG       GLU  88  -3.016   8.023   6.859
  651   2HG   GLU  88          2HG       GLU  88  -1.706   8.688   5.900
  652    H    ASP  89           H        ASP  89  -5.428   5.477   4.547
  653    HA   ASP  89           HA       ASP  89  -7.906   6.305   6.108
  654   1HB   ASP  89          1HB       ASP  89  -7.413   3.590   4.762
  655   2HB   ASP  89          2HB       ASP  89  -8.112   4.962   3.933
  656    H    ALA  90           H        ALA  90  -7.336   6.438   8.171
  657    HA   ALA  90           HA       ALA  90  -5.625   4.316   9.518
  658   1HB   ALA  90          1HB       ALA  90  -5.592   5.876  11.482
  659   2HB   ALA  90          2HB       ALA  90  -5.070   6.713  10.007
  660   3HB   ALA  90          3HB       ALA  90  -6.706   6.992  10.653
   
  Start of MODEL          30
 Raw file had  660 H/Q atoms
  Start of MODEL   30
    1   1H    ALA   1          1H        ALA   1 -24.531   6.050 -12.435
    2   2H    ALA   1          2H        ALA   1 -25.263   5.371 -11.082
    3   3H    ALA   1          3H        ALA   1 -26.080   6.528 -11.988
    4    HA   ALA   1           HA       ALA   1 -25.074   8.250 -11.080
    5   1HB   ALA   1          1HB       ALA   1 -25.878   6.480  -9.214
    6   2HB   ALA   1          2HB       ALA   1 -25.051   7.978  -8.747
    7   3HB   ALA   1          3HB       ALA   1 -24.148   6.442  -8.798
    8    H    SER   2           H        SER   2 -22.987   5.380 -11.055
    9    HA   SER   2           HA       SER   2 -20.460   7.089 -11.161
   10   1HB   SER   2          1HB       SER   2 -19.228   5.208 -10.391
   11   2HB   SER   2          2HB       SER   2 -20.707   5.222  -9.428
   12    HG   SER   2           HG       SER   2 -20.075   3.178 -10.323
   13    H    MET   3           H        MET   3 -18.898   6.700 -12.758
   14    HA   MET   3           HA       MET   3 -19.776   5.238 -15.300
   15   1HB   MET   3          1HB       MET   3 -18.986   8.181 -15.050
   16   2HB   MET   3          2HB       MET   3 -18.783   7.321 -16.565
   17   1HG   MET   3          1HG       MET   3 -21.189   6.943 -16.795
   18   2HG   MET   3          2HG       MET   3 -21.495   7.401 -15.114
   19   1HE   MET   3          1HE       MET   3 -19.954  10.465 -18.328
   20   2HE   MET   3          2HE       MET   3 -20.126   8.710 -18.627
   21   3HE   MET   3          3HE       MET   3 -18.863   9.302 -17.510
   22    H    THR   4           H        THR   4 -17.082   7.469 -14.755
   23    HA   THR   4           HA       THR   4 -15.096   5.202 -14.546
   24    HB   THR   4           HB       THR   4 -13.581   6.366 -16.272
   25    HG1  THR   4           HG1      THR   4 -14.911   7.317 -17.932
   26   1HG2  THR   4          1HG2      THR   4 -15.991   5.095 -17.656
   27   2HG2  THR   4          2HG2      THR   4 -14.913   4.097 -16.656
   28   3HG2  THR   4          3HG2      THR   4 -14.269   4.967 -18.072
   29    H    ASP   5           H        ASP   5 -15.237   6.122 -12.368
   30    HA   ASP   5           HA       ASP   5 -14.173   8.897 -11.864
   31   1HB   ASP   5          1HB       ASP   5 -15.409   6.778 -10.054
   32   2HB   ASP   5          2HB       ASP   5 -14.462   8.070  -9.352
   33    H    GLN   6           H        GLN   6 -13.107   5.574 -11.782
   34    HA   GLN   6           HA       GLN   6 -10.483   6.146 -10.390
   35   1HB   GLN   6          1HB       GLN   6 -10.010   3.729 -10.736
   36   2HB   GLN   6          2HB       GLN   6 -11.511   4.022  -9.876
   37   1HG   GLN   6          1HG       GLN   6 -11.764   3.666 -12.872
   38   2HG   GLN   6          2HG       GLN   6 -12.866   3.189 -11.599
   39   1HE2  GLN   6          1HE2      GLN   6  -9.752   0.607 -12.599
   40   2HE2  GLN   6          2HE2      GLN   6  -9.551   2.420 -12.792
   41    H    GLN   7           H        GLN   7 -10.234   7.853 -12.170
   42    HA   GLN   7           HA       GLN   7  -7.933   7.116 -13.816
   43   1HB   GLN   7          1HB       GLN   7  -8.910   7.501 -16.132
   44   2HB   GLN   7          2HB       GLN   7  -9.345   5.978 -15.371
   45   1HG   GLN   7          1HG       GLN   7 -11.525   6.379 -15.744
   46   2HG   GLN   7          2HG       GLN   7 -11.481   7.748 -14.642
   47   1HE2  GLN   7          1HE2      GLN   7 -11.977  10.037 -17.356
   48   2HE2  GLN   7          2HE2      GLN   7 -12.095   9.643 -15.568
   49    H    ALA   8           H        ALA   8 -10.818   9.234 -13.775
   50    HA   ALA   8           HA       ALA   8  -9.234  11.696 -14.478
   51   1HB   ALA   8          1HB       ALA   8 -11.436  12.858 -14.418
   52   2HB   ALA   8          2HB       ALA   8 -11.499  11.404 -15.432
   53   3HB   ALA   8          3HB       ALA   8 -12.231  11.387 -13.807
   54    H    GLU   9           H        GLU   9 -10.745  10.187 -11.673
   55    HA   GLU   9           HA       GLU   9 -10.665  12.483  -9.827
   56   1HB   GLU   9          1HB       GLU   9 -11.643  11.144  -8.254
   57   2HB   GLU   9          2HB       GLU   9 -12.011  10.173  -9.672
   58   1HG   GLU   9          1HG       GLU   9 -11.179   8.450  -8.407
   59   2HG   GLU   9          2HG       GLU   9  -9.627   8.973  -9.052
   60    H    ALA  10           H        ALA  10  -8.435   9.859 -10.607
   61    HA   ALA  10           HA       ALA  10  -6.559  10.259  -8.352
   62   1HB   ALA  10          1HB       ALA  10  -5.073   8.689  -9.586
   63   2HB   ALA  10          2HB       ALA  10  -6.735   8.074  -9.501
   64   3HB   ALA  10          3HB       ALA  10  -6.123   8.773 -11.021
   65    NH1  ARG  11           NH1      ARG  11  -5.332  12.052 -17.725
   66    NH2  ARG  11           NH2      ARG  11  -7.535  12.569 -17.916
   67    H    ARG  11           H        ARG  11  -6.846  11.477 -11.643
   68    HA   ARG  11           HA       ARG  11  -4.122  12.656 -11.918
   69   1HB   ARG  11          1HB       ARG  11  -5.966  12.014 -13.784
   70   2HB   ARG  11          2HB       ARG  11  -6.499  13.667 -13.518
   71   1HG   ARG  11          1HG       ARG  11  -3.913  14.294 -13.847
   72   2HG   ARG  11          2HG       ARG  11  -3.830  12.726 -14.655
   73   1HD   ARG  11          1HD       ARG  11  -5.375  15.220 -15.479
   74   2HD   ARG  11          2HD       ARG  11  -4.345  14.184 -16.469
   75    HE   ARG  11           HE       ARG  11  -7.192  13.464 -15.594
   76   1HH1  ARG  11          1HH1      ARG  11  -8.346  13.065 -17.529
   77   2HH1  ARG  11          2HH1      ARG  11  -7.519  11.976 -18.753
   78   1HH2  ARG  11          1HH2      ARG  11  -4.446  12.202 -17.229
   79   2HH2  ARG  11          2HH2      ARG  11  -5.486  11.447 -18.540
   80    H    ALA  12           H        ALA  12  -7.306  13.751 -10.857
   81    HA   ALA  12           HA       ALA  12  -6.696  16.633 -10.546
   82   1HB   ALA  12          1HB       ALA  12  -8.793  16.736  -9.214
   83   2HB   ALA  12          2HB       ALA  12  -9.033  15.836 -10.725
   84   3HB   ALA  12          3HB       ALA  12  -8.896  14.958  -9.181
   85    H    PHE  13           H        PHE  13  -6.335  13.751  -8.550
   86    HA   PHE  13           HA       PHE  13  -5.758  14.985  -5.976
   87   1HB   PHE  13          1HB       PHE  13  -6.325  12.520  -6.514
   88   2HB   PHE  13          2HB       PHE  13  -4.650  12.286  -6.940
   89    HD1  PHE  13           HD1      PHE  13  -4.663  10.537  -5.056
   90    HD2  PHE  13           HD2      PHE  13  -5.275  14.715  -4.219
   91    HE1  PHE  13           HE1      PHE  13  -4.141  10.150  -2.682
   92    HE2  PHE  13           HE2      PHE  13  -4.749  14.307  -1.851
   93    HZ   PHE  13           HZ       PHE  13  -4.182  12.029  -1.077
   94    H    LEU  14           H        LEU  14  -3.528  13.585  -8.407
   95    HA   LEU  14           HA       LEU  14  -1.238  15.357  -7.376
   96   1HB   LEU  14          1HB       LEU  14   0.028  13.416  -8.899
   97   2HB   LEU  14          2HB       LEU  14  -0.079  13.441  -7.152
   98    HG   LEU  14           HG       LEU  14  -2.320  12.053  -7.460
   99   1HD1  LEU  14          1HD1      LEU  14  -2.401  10.646  -9.521
  100   2HD1  LEU  14          2HD1      LEU  14  -2.549  12.365  -9.929
  101   3HD1  LEU  14          3HD1      LEU  14  -1.006  11.519 -10.205
  102   1HD2  LEU  14          1HD2      LEU  14   0.425  10.753  -8.055
  103   2HD2  LEU  14          2HD2      LEU  14  -0.261  11.062  -6.441
  104   3HD2  LEU  14          3HD2      LEU  14  -1.038   9.891  -7.516
  105    H    SER  15           H        SER  15  -0.848  16.980  -8.649
  106    HA   SER  15           HA       SER  15  -2.117  17.452 -11.238
  107   1HB   SER  15          1HB       SER  15  -1.165  19.585 -11.189
  108   2HB   SER  15          2HB       SER  15  -1.243  19.173  -9.474
  109    HG   SER  15           HG       SER  15   0.863  18.916  -9.402
  110    H    GLU  16           H        GLU  16  -0.231  18.530 -12.879
  111    HA   GLU  16           HA       GLU  16   0.832  16.145 -14.299
  112   1HB   GLU  16          1HB       GLU  16  -0.093  17.931 -15.626
  113   2HB   GLU  16          2HB       GLU  16   0.959  19.139 -14.914
  114   1HG   GLU  16          1HG       GLU  16   1.383  17.659 -17.321
  115   2HG   GLU  16          2HG       GLU  16   2.537  16.963 -16.196
  116    H    GLU  17           H        GLU  17   2.103  18.728 -12.290
  117    HA   GLU  17           HA       GLU  17   4.973  18.418 -12.898
  118   1HB   GLU  17          1HB       GLU  17   5.489  19.889 -11.132
  119   2HB   GLU  17          2HB       GLU  17   3.972  20.462 -11.799
  120   1HG   GLU  17          1HG       GLU  17   2.739  19.923  -9.852
  121   2HG   GLU  17          2HG       GLU  17   3.795  18.595  -9.401
  122    H    MET  18           H        MET  18   2.782  16.999 -10.505
  123    HA   MET  18           HA       MET  18   4.860  15.382  -9.080
  124   1HB   MET  18          1HB       MET  18   1.790  15.283  -8.937
  125   2HB   MET  18          2HB       MET  18   2.844  14.228  -8.013
  126   1HG   MET  18          1HG       MET  18   3.508  15.911  -6.526
  127   2HG   MET  18          2HG       MET  18   3.405  17.196  -7.741
  128   1HE   MET  18          1HE       MET  18   1.759  19.028  -7.347
  129   2HE   MET  18          2HE       MET  18   0.524  18.918  -6.057
  130   3HE   MET  18          3HE       MET  18   2.246  18.634  -5.668
  131    H    ILE  19           H        ILE  19   2.548  14.969 -11.702
  132    HA   ILE  19           HA       ILE  19   2.570  12.075 -11.986
  133    HB   ILE  19           HB       ILE  19   1.798  14.350 -13.785
  134   1HG1  ILE  19          1HG1      ILE  19   0.197  11.779 -13.572
  135   2HG1  ILE  19          2HG1      ILE  19   0.372  12.699 -12.093
  136   1HG2  ILE  19          1HG2      ILE  19   1.443  12.892 -15.793
  137   2HG2  ILE  19          2HG2      ILE  19   3.159  12.975 -15.398
  138   3HG2  ILE  19          3HG2      ILE  19   2.227  11.523 -14.966
  139   1HD1  ILE  19          1HD1      ILE  19  -0.881  13.803 -14.676
  140   2HD1  ILE  19          2HD1      ILE  19  -1.706  13.376 -13.163
  141   3HD1  ILE  19          3HD1      ILE  19  -0.587  14.759 -13.198
  142    H    ALA  20           H        ALA  20   4.763  14.624 -13.063
  143    HA   ALA  20           HA       ALA  20   6.403  13.314 -14.999
  144   1HB   ALA  20          1HB       ALA  20   8.198  14.927 -14.378
  145   2HB   ALA  20          2HB       ALA  20   6.615  15.723 -14.479
  146   3HB   ALA  20          3HB       ALA  20   7.331  15.363 -12.887
  147    H    GLU  21           H        GLU  21   6.496  13.110 -11.467
  148    HA   GLU  21           HA       GLU  21   9.030  11.725 -11.096
  149   1HB   GLU  21          1HB       GLU  21   7.765  10.845  -8.911
  150   2HB   GLU  21          2HB       GLU  21   6.536  12.002  -9.382
  151   1HG   GLU  21          1HG       GLU  21   8.004  13.091  -7.781
  152   2HG   GLU  21          2HG       GLU  21   9.458  12.562  -8.611
  153    H    PHE  22           H        PHE  22   5.703  10.553 -11.541
  154    HA   PHE  22           HA       PHE  22   6.395   7.646 -11.484
  155   1HB   PHE  22          1HB       PHE  22   3.777   8.942 -12.461
  156   2HB   PHE  22          2HB       PHE  22   4.034   7.257 -12.098
  157    HD1  PHE  22           HD1      PHE  22   3.958  10.647 -10.452
  158    HD2  PHE  22           HD2      PHE  22   3.860   6.386  -9.849
  159    HE1  PHE  22           HE1      PHE  22   3.370  10.984  -8.088
  160    HE2  PHE  22           HE2      PHE  22   3.256   6.744  -7.491
  161    HZ   PHE  22           HZ       PHE  22   3.011   9.039  -6.605
  162    H    LYS  23           H        LYS  23   6.470  10.171 -13.837
  163    HA   LYS  23           HA       LYS  23   5.997   8.693 -16.347
  164   1HB   LYS  23          1HB       LYS  23   6.721  11.397 -15.633
  165   2HB   LYS  23          2HB       LYS  23   7.987  10.824 -16.695
  166   1HG   LYS  23          1HG       LYS  23   5.567  11.946 -17.504
  167   2HG   LYS  23          2HG       LYS  23   5.212  10.235 -17.665
  168   1HD   LYS  23          1HD       LYS  23   7.556  11.706 -19.020
  169   2HD   LYS  23          2HD       LYS  23   7.324   9.956 -19.097
  170   1HE   LYS  23          1HE       LYS  23   4.914  11.624 -19.886
  171   2HE   LYS  23          2HE       LYS  23   6.300  11.703 -20.984
  172   1HZ   LYS  23          1HZ       LYS  23   5.154   9.876 -21.751
  173   2HZ   LYS  23          2HZ       LYS  23   4.661   9.363 -20.260
  174   3HZ   LYS  23          3HZ       LYS  23   6.221   9.116 -20.744
  175    H    ALA  24           H        ALA  24   8.971   9.594 -14.576
  176    HA   ALA  24           HA       ALA  24  10.951   8.449 -16.352
  177   1HB   ALA  24          1HB       ALA  24  12.496   8.509 -14.404
  178   2HB   ALA  24          2HB       ALA  24  11.553  10.006 -14.523
  179   3HB   ALA  24          3HB       ALA  24  11.135   8.787 -13.292
  180    H    ALA  25           H        ALA  25   9.942   7.063 -13.208
  181    HA   ALA  25           HA       ALA  25  11.087   4.419 -13.553
  182   1HB   ALA  25          1HB       ALA  25   9.666   3.740 -11.627
  183   2HB   ALA  25          2HB       ALA  25  10.438   5.309 -11.333
  184   3HB   ALA  25          3HB       ALA  25   8.710   5.235 -11.763
  185    H    PHE  26           H        PHE  26   8.034   5.803 -14.577
  186    HA   PHE  26           HA       PHE  26   6.333   3.551 -15.023
  187   1HB   PHE  26          1HB       PHE  26   5.482   5.802 -15.437
  188   2HB   PHE  26          2HB       PHE  26   6.579   6.070 -16.765
  189    HD1  PHE  26           HD1      PHE  26   3.537   4.172 -15.666
  190    HD2  PHE  26           HD2      PHE  26   6.059   5.138 -19.015
  191    HE1  PHE  26           HE1      PHE  26   1.846   3.274 -17.213
  192    HE2  PHE  26           HE2      PHE  26   4.349   4.248 -20.548
  193    HZ   PHE  26           HZ       PHE  26   2.244   3.316 -19.652
  194    H    ASP  27           H        ASP  27   8.726   4.938 -17.294
  195    HA   ASP  27           HA       ASP  27   8.389   2.971 -19.432
  196   1HB   ASP  27          1HB       ASP  27  10.013   4.076 -20.614
  197   2HB   ASP  27          2HB       ASP  27   9.585   5.337 -19.481
  198    H    MET  28           H        MET  28  10.434   3.116 -16.569
  199    HA   MET  28           HA       MET  28  12.347   0.998 -17.156
  200   1HB   MET  28          1HB       MET  28  12.143   2.694 -15.041
  201   2HB   MET  28          2HB       MET  28  11.407   1.288 -14.294
  202   1HG   MET  28          1HG       MET  28  13.421  -0.047 -14.493
  203   2HG   MET  28          2HG       MET  28  14.144   1.060 -15.671
  204   1HE   MET  28          1HE       MET  28  12.263   1.521 -12.127
  205   2HE   MET  28          2HE       MET  28  13.098   3.009 -11.589
  206   3HE   MET  28          3HE       MET  28  12.107   3.033 -13.077
  207    H    PHE  29           H        PHE  29   9.083   0.959 -15.790
  208    HA   PHE  29           HA       PHE  29   9.025  -1.964 -15.170
  209   1HB   PHE  29          1HB       PHE  29   6.488  -0.288 -15.431
  210   2HB   PHE  29          2HB       PHE  29   7.594   0.066 -14.131
  211    HD1  PHE  29           HD1      PHE  29   5.265  -2.499 -15.501
  212    HD2  PHE  29           HD2      PHE  29   7.917  -1.551 -12.245
  213    HE1  PHE  29           HE1      PHE  29   4.290  -4.319 -14.161
  214    HE2  PHE  29           HE2      PHE  29   6.925  -3.373 -10.922
  215    HZ   PHE  29           HZ       PHE  29   5.116  -4.758 -11.873
  216    H    ASP  30           H        ASP  30   8.091   0.187 -17.798
  217    HA   ASP  30           HA       ASP  30   6.525  -1.822 -19.338
  218   1HB   ASP  30          1HB       ASP  30   6.393   0.857 -19.395
  219   2HB   ASP  30          2HB       ASP  30   7.608   0.701 -20.642
  220    H    ALA  31           H        ALA  31   7.131  -2.904 -21.174
  221    HA   ALA  31           HA       ALA  31  10.054  -3.595 -21.447
  222   1HB   ALA  31          1HB       ALA  31   9.244  -5.450 -22.910
  223   2HB   ALA  31          2HB       ALA  31   8.403  -5.429 -21.348
  224   3HB   ALA  31          3HB       ALA  31   7.576  -4.838 -22.812
  225    H    ASP  32           H        ASP  32   7.493  -1.954 -23.209
  226    HA   ASP  32           HA       ASP  32   9.150  -1.446 -25.686
  227   1HB   ASP  32          1HB       ASP  32   7.193   0.032 -26.404
  228   2HB   ASP  32          2HB       ASP  32   6.355  -0.428 -24.940
  229    H    GLY  33           H        GLY  33   7.299   0.876 -23.714
  230   1HA   GLY  33          1HA       GLY  33   8.906   2.350 -22.116
  231   2HA   GLY  33          2HA       GLY  33   9.722   2.725 -23.617
  232    H    GLY  34           H        GLY  34   6.437   2.703 -22.197
  233   1HA   GLY  34          1HA       GLY  34   5.190   4.871 -21.755
  234   2HA   GLY  34          2HA       GLY  34   6.005   5.573 -23.158
  235    H    GLY  35           H        GLY  35   3.737   2.988 -22.256
  236   1HA   GLY  35          1HA       GLY  35   1.769   3.808 -24.361
  237   2HA   GLY  35          2HA       GLY  35   2.509   2.244 -24.728
  238    H    ASP  36           H        ASP  36   2.793   0.972 -22.432
  239    HA   ASP  36           HA       ASP  36   0.709   0.920 -20.432
  240   1HB   ASP  36          1HB       ASP  36  -0.873  -0.823 -21.312
  241   2HB   ASP  36          2HB       ASP  36  -1.013   0.745 -22.073
  242    H    ILE  37           H        ILE  37   0.448  -1.338 -19.522
  243    HA   ILE  37           HA       ILE  37   3.048  -2.940 -19.774
  244    HB   ILE  37           HB       ILE  37   1.796  -2.858 -17.065
  245   1HG1  ILE  37          1HG1      ILE  37   2.976  -0.350 -18.262
  246   2HG1  ILE  37          2HG1      ILE  37   1.767  -0.544 -17.008
  247   1HG2  ILE  37          1HG2      ILE  37   4.115  -3.191 -16.300
  248   2HG2  ILE  37          2HG2      ILE  37   3.746  -4.328 -17.605
  249   3HG2  ILE  37          3HG2      ILE  37   4.747  -2.894 -17.938
  250   1HD1  ILE  37          1HD1      ILE  37   4.797  -0.865 -16.570
  251   2HD1  ILE  37          2HD1      ILE  37   3.754   0.460 -16.011
  252   3HD1  ILE  37          3HD1      ILE  37   3.554  -1.169 -15.327
  253    H    SER  38           H        SER  38   2.483  -4.713 -20.733
  254    HA   SER  38           HA       SER  38  -0.135  -6.120 -20.393
  255   1HB   SER  38          1HB       SER  38   0.652  -7.710 -21.979
  256   2HB   SER  38          2HB       SER  38   1.282  -6.152 -22.520
  257    HG   SER  38           HG       SER  38   2.669  -8.120 -21.015
  258    H    THR  39           H        THR  39   0.582  -8.739 -20.176
  259    HA   THR  39           HA       THR  39   1.138  -9.046 -17.239
  260    HB   THR  39           HB       THR  39   0.858 -11.638 -18.076
  261    HG1  THR  39           HG1      THR  39  -0.577 -11.738 -19.679
  262   1HG2  THR  39          1HG2      THR  39  -1.491 -11.557 -17.365
  263   2HG2  THR  39          2HG2      THR  39  -0.533 -10.520 -16.283
  264   3HG2  THR  39          3HG2      THR  39  -1.552  -9.789 -17.551
  265    H    LYS  40           H        LYS  40   2.614  -9.899 -20.351
  266    HA   LYS  40           HA       LYS  40   4.885 -11.425 -19.316
  267   1HB   LYS  40          1HB       LYS  40   3.995 -11.485 -21.670
  268   2HB   LYS  40          2HB       LYS  40   4.696  -9.923 -22.005
  269   1HG   LYS  40          1HG       LYS  40   6.075 -11.768 -22.887
  270   2HG   LYS  40          2HG       LYS  40   6.086 -12.596 -21.352
  271   1HD   LYS  40          1HD       LYS  40   8.102 -10.817 -22.379
  272   2HD   LYS  40          2HD       LYS  40   7.302  -9.931 -21.113
  273   1HE   LYS  40          1HE       LYS  40   8.536 -10.926 -19.557
  274   2HE   LYS  40          2HE       LYS  40   7.741 -12.460 -19.881
  275   1HZ   LYS  40          1HZ       LYS  40  10.350 -11.477 -20.822
  276   2HZ   LYS  40          2HZ       LYS  40   9.547 -12.543 -21.796
  277   3HZ   LYS  40          3HZ       LYS  40   9.937 -12.970 -20.249
  278    H    GLU  41           H        GLU  41   4.362  -8.005 -20.128
  279    HA   GLU  41           HA       GLU  41   7.165  -7.104 -19.756
  280   1HB   GLU  41          1HB       GLU  41   6.494  -4.958 -20.288
  281   2HB   GLU  41          2HB       GLU  41   4.918  -5.114 -19.545
  282   1HG   GLU  41          1HG       GLU  41   5.648  -6.555 -22.169
  283   2HG   GLU  41          2HG       GLU  41   4.059  -6.427 -21.444
  284    H    LEU  42           H        LEU  42   4.271  -7.310 -17.755
  285    HA   LEU  42           HA       LEU  42   5.048  -5.608 -15.522
  286   1HB   LEU  42          1HB       LEU  42   2.832  -7.319 -16.143
  287   2HB   LEU  42          2HB       LEU  42   3.460  -7.927 -14.627
  288    HG   LEU  42           HG       LEU  42   3.310  -5.515 -13.689
  289   1HD1  LEU  42          1HD1      LEU  42   1.764  -3.928 -14.867
  290   2HD1  LEU  42          2HD1      LEU  42   3.210  -4.256 -15.834
  291   3HD1  LEU  42          3HD1      LEU  42   1.665  -5.035 -16.260
  292   1HD2  LEU  42          1HD2      LEU  42   0.656  -6.859 -14.543
  293   2HD2  LEU  42          2HD2      LEU  42   1.605  -7.251 -13.087
  294   3HD2  LEU  42          3HD2      LEU  42   0.850  -5.654 -13.243
  295    H    GLY  43           H        GLY  43   5.470  -9.101 -16.096
  296   1HA   GLY  43          1HA       GLY  43   6.939  -9.561 -13.504
  297   2HA   GLY  43          2HA       GLY  43   6.547 -10.789 -14.704
  298    H    THR  44           H        THR  44   8.003  -8.005 -16.075
  299    HA   THR  44           HA       THR  44  10.592  -9.446 -16.605
  300    HB   THR  44           HB       THR  44   9.618  -6.715 -17.585
  301    HG1  THR  44           HG1      THR  44  10.049  -9.115 -19.002
  302   1HG2  THR  44          1HG2      THR  44  11.500  -6.789 -19.230
  303   2HG2  THR  44          2HG2      THR  44  12.108  -6.669 -17.565
  304   3HG2  THR  44          3HG2      THR  44  12.167  -8.230 -18.424
  305    H    VAL  45           H        VAL  45   9.423  -6.543 -14.936
  306    HA   VAL  45           HA       VAL  45  12.102  -5.596 -14.052
  307    HB   VAL  45           HB       VAL  45   9.314  -4.594 -13.836
  308   1HG1  VAL  45          1HG1      VAL  45   9.717  -3.073 -11.898
  309   2HG1  VAL  45          2HG1      VAL  45   9.768  -4.760 -11.374
  310   3HG1  VAL  45          3HG1      VAL  45  11.286  -3.856 -11.573
  311   1HG2  VAL  45          1HG2      VAL  45  12.022  -3.114 -14.021
  312   2HG2  VAL  45          2HG2      VAL  45  10.965  -3.527 -15.392
  313   3HG2  VAL  45          3HG2      VAL  45  10.409  -2.370 -14.174
  314    H    MET  46           H        MET  46   9.463  -7.533 -12.733
  315    HA   MET  46           HA       MET  46  10.372  -7.584  -9.916
  316   1HB   MET  46          1HB       MET  46   8.533  -9.660 -11.235
  317   2HB   MET  46          2HB       MET  46   8.702  -9.313  -9.524
  318   1HG   MET  46          1HG       MET  46   7.961  -6.786 -10.578
  319   2HG   MET  46          2HG       MET  46   7.028  -7.932 -11.555
  320   1HE   MET  46          1HE       MET  46   6.074 -10.341 -10.057
  321   2HE   MET  46          2HE       MET  46   4.691  -9.761  -9.084
  322   3HE   MET  46          3HE       MET  46   4.899  -9.188 -10.764
  323    NH1  ARG  47           NH1      ARG  47   7.702 -12.949 -10.773
  324    NH2  ARG  47           NH2      ARG  47   6.750 -14.375 -12.265
  325    H    ARG  47           H        ARG  47  10.870  -9.596 -12.773
  326    HA   ARG  47           HA       ARG  47  12.091 -11.947 -11.484
  327   1HB   ARG  47          1HB       ARG  47  13.082 -12.279 -13.920
  328   2HB   ARG  47          2HB       ARG  47  12.066 -10.910 -14.349
  329   1HG   ARG  47          1HG       ARG  47  11.264 -13.721 -13.722
  330   2HG   ARG  47          2HG       ARG  47  10.516 -12.537 -14.794
  331   1HD   ARG  47          1HD       ARG  47  10.244 -12.461 -11.709
  332   2HD   ARG  47          2HD       ARG  47   9.472 -11.361 -12.840
  333    HE   ARG  47           HE       ARG  47   8.542 -13.846 -13.769
  334   1HH1  ARG  47          1HH1      ARG  47   8.468 -12.298 -10.566
  335   2HH1  ARG  47          2HH1      ARG  47   6.923 -13.198 -10.154
  336   1HH2  ARG  47          1HH2      ARG  47   6.787 -14.813 -13.192
  337   2HH2  ARG  47          2HH2      ARG  47   6.038 -14.525 -11.542
  338    H    MET  48           H        MET  48  13.310  -8.875 -12.686
  339    HA   MET  48           HA       MET  48  16.125  -9.251 -12.931
  340   1HB   MET  48          1HB       MET  48  16.071  -6.771 -11.643
  341   2HB   MET  48          2HB       MET  48  14.428  -6.891 -12.245
  342   1HG   MET  48          1HG       MET  48  16.550  -7.599 -14.277
  343   2HG   MET  48          2HG       MET  48  15.051  -6.676 -14.474
  344   1HE   MET  48          1HE       MET  48  14.811  -4.204 -12.862
  345   2HE   MET  48          2HE       MET  48  15.915  -3.036 -13.646
  346   3HE   MET  48          3HE       MET  48  14.923  -4.135 -14.648
  347    H    LEU  49           H        LEU  49  14.159  -9.255 -10.032
  348    HA   LEU  49           HA       LEU  49  15.886  -8.627  -7.889
  349   1HB   LEU  49          1HB       LEU  49  13.376  -9.680  -8.000
  350   2HB   LEU  49          2HB       LEU  49  14.307  -9.508  -6.528
  351    HG   LEU  49           HG       LEU  49  15.149 -11.998  -7.066
  352   1HD1  LEU  49          1HD1      LEU  49  12.458 -12.002  -8.572
  353   2HD1  LEU  49          2HD1      LEU  49  14.043 -12.060  -9.363
  354   3HD1  LEU  49          3HD1      LEU  49  13.535 -13.395  -8.300
  355   1HD2  LEU  49          1HD2      LEU  49  13.356 -12.918  -5.656
  356   2HD2  LEU  49          2HD2      LEU  49  13.683 -11.265  -5.080
  357   3HD2  LEU  49          3HD2      LEU  49  12.255 -11.582  -6.077
  358    H    GLY  50           H        GLY  50  15.610 -11.820  -9.480
  359   1HA   GLY  50          1HA       GLY  50  17.966 -13.065  -8.158
  360   2HA   GLY  50          2HA       GLY  50  18.446 -12.343  -9.700
  361    H    GLN  51           H        GLN  51  15.458 -14.014  -8.703
  362    HA   GLN  51           HA       GLN  51  16.059 -16.479 -10.321
  363   1HB   GLN  51          1HB       GLN  51  14.212 -15.774  -8.147
  364   2HB   GLN  51          2HB       GLN  51  13.334 -16.544  -9.454
  365   1HG   GLN  51          1HG       GLN  51  15.911 -17.899  -8.624
  366   2HG   GLN  51          2HG       GLN  51  14.420 -18.608  -9.204
  367   1HE2  GLN  51          1HE2      GLN  51  13.931 -19.602  -5.779
  368   2HE2  GLN  51          2HE2      GLN  51  14.272 -20.101  -7.511
  369    H    ASN  52           H        ASN  52  13.965 -17.257 -11.592
  370    HA   ASN  52           HA       ASN  52  12.535 -15.102 -13.091
  371   1HB   ASN  52          1HB       ASN  52  14.901 -15.530 -14.174
  372   2HB   ASN  52          2HB       ASN  52  14.213 -17.005 -14.818
  373   1HD2  ASN  52          1HD2      ASN  52  13.814 -13.989 -17.197
  374   2HD2  ASN  52          2HD2      ASN  52  15.210 -14.570 -16.158
  375    HA   PRO  53           HA       PRO  53   9.976 -19.098 -12.854
  376   1HB   PRO  53          1HB       PRO  53   7.547 -17.974 -12.191
  377   2HB   PRO  53          2HB       PRO  53   8.847 -18.281 -11.029
  378   1HG   PRO  53          1HG       PRO  53   8.076 -15.635 -12.327
  379   2HG   PRO  53          2HG       PRO  53   8.551 -15.937 -10.639
  380   1HD   PRO  53          1HD       PRO  53  10.863 -15.741 -11.189
  381   2HD   PRO  53          2HD       PRO  53  10.281 -14.988 -12.704
  382    H    THR  54           H        THR  54   7.672 -19.426 -13.969
  383    HA   THR  54           HA       THR  54   7.992 -18.714 -16.861
  384    HB   THR  54           HB       THR  54   7.165 -21.013 -15.763
  385    HG1  THR  54           HG1      THR  54   5.818 -20.945 -17.947
  386   1HG2  THR  54          1HG2      THR  54   4.741 -21.405 -16.060
  387   2HG2  THR  54          2HG2      THR  54   5.000 -20.161 -14.815
  388   3HG2  THR  54          3HG2      THR  54   4.467 -19.690 -16.449
  389    H    LYS  55           H        LYS  55   5.644 -18.370 -17.935
  390    HA   LYS  55           HA       LYS  55   4.919 -15.573 -17.073
  391   1HB   LYS  55          1HB       LYS  55   3.911 -17.071 -19.569
  392   2HB   LYS  55          2HB       LYS  55   3.832 -15.347 -19.272
  393   1HG   LYS  55          1HG       LYS  55   6.028 -14.960 -19.854
  394   2HG   LYS  55          2HG       LYS  55   6.618 -16.499 -19.253
  395   1HD   LYS  55          1HD       LYS  55   4.794 -16.788 -21.636
  396   2HD   LYS  55          2HD       LYS  55   6.198 -15.781 -21.953
  397   1HE   LYS  55          1HE       LYS  55   7.557 -17.794 -20.799
  398   2HE   LYS  55          2HE       LYS  55   6.137 -18.746 -21.225
  399   1HZ   LYS  55          1HZ       LYS  55   7.566 -18.907 -23.055
  400   2HZ   LYS  55          2HZ       LYS  55   7.993 -17.311 -23.042
  401   3HZ   LYS  55          3HZ       LYS  55   6.493 -17.760 -23.568
  402    H    GLU  56           H        GLU  56   3.548 -18.802 -17.288
  403    HA   GLU  56           HA       GLU  56   0.745 -18.420 -17.224
  404   1HB   GLU  56          1HB       GLU  56   2.382 -20.558 -15.768
  405   2HB   GLU  56          2HB       GLU  56   1.743 -20.642 -17.399
  406   1HG   GLU  56          1HG       GLU  56  -0.616 -20.645 -16.479
  407   2HG   GLU  56          2HG       GLU  56   0.011 -20.503 -14.845
  408    H    GLU  57           H        GLU  57   2.890 -18.656 -14.367
  409    HA   GLU  57           HA       GLU  57   0.927 -18.206 -12.295
  410   1HB   GLU  57          1HB       GLU  57   3.932 -17.852 -12.348
  411   2HB   GLU  57          2HB       GLU  57   2.959 -19.062 -11.540
  412   1HG   GLU  57          1HG       GLU  57   4.137 -16.807 -10.333
  413   2HG   GLU  57          2HG       GLU  57   2.470 -16.272 -10.505
  414    H    LEU  58           H        LEU  58   2.820 -15.930 -14.234
  415    HA   LEU  58           HA       LEU  58   2.248 -13.492 -12.743
  416   1HB   LEU  58          1HB       LEU  58   3.152 -13.972 -15.632
  417   2HB   LEU  58          2HB       LEU  58   2.906 -12.360 -14.993
  418    HG   LEU  58           HG       LEU  58   4.857 -14.453 -13.832
  419   1HD1  LEU  58          1HD1      LEU  58   6.684 -12.958 -14.720
  420   2HD1  LEU  58          2HD1      LEU  58   5.699 -13.616 -16.034
  421   3HD1  LEU  58          3HD1      LEU  58   5.468 -11.928 -15.516
  422   1HD2  LEU  58          1HD2      LEU  58   4.480 -11.491 -13.047
  423   2HD2  LEU  58          2HD2      LEU  58   4.005 -12.902 -12.069
  424   3HD2  LEU  58          3HD2      LEU  58   5.719 -12.598 -12.404
  425    H    ASP  59           H        ASP  59   0.592 -15.200 -15.342
  426    HA   ASP  59           HA       ASP  59  -1.294 -13.162 -16.207
  427   1HB   ASP  59          1HB       ASP  59  -0.893 -15.197 -17.553
  428   2HB   ASP  59          2HB       ASP  59  -1.599 -16.213 -16.317
  429    H    ALA  60           H        ALA  60  -1.311 -15.436 -13.522
  430    HA   ALA  60           HA       ALA  60  -4.065 -14.891 -12.552
  431   1HB   ALA  60          1HB       ALA  60  -3.343 -16.089 -10.492
  432   2HB   ALA  60          2HB       ALA  60  -2.902 -16.990 -11.955
  433   3HB   ALA  60          3HB       ALA  60  -1.653 -16.096 -11.050
  434    H    ILE  61           H        ILE  61  -0.811 -13.677 -11.809
  435    HA   ILE  61           HA       ILE  61  -1.291 -11.994  -9.536
  436    HB   ILE  61           HB       ILE  61   0.823 -12.182 -11.573
  437   1HG1  ILE  61          1HG1      ILE  61   0.558 -12.387  -8.716
  438   2HG1  ILE  61          2HG1      ILE  61   1.969 -12.723  -9.697
  439   1HG2  ILE  61          1HG2      ILE  61   1.819  -9.895 -11.283
  440   2HG2  ILE  61          2HG2      ILE  61   0.254  -9.792 -12.088
  441   3HG2  ILE  61          3HG2      ILE  61   0.387  -9.367 -10.365
  442   1HD1  ILE  61          1HD1      ILE  61   1.368  -9.991  -8.415
  443   2HD1  ILE  61          2HD1      ILE  61   2.617 -11.164  -7.943
  444   3HD1  ILE  61          3HD1      ILE  61   2.740 -10.325  -9.508
  445    H    ILE  62           H        ILE  62  -1.903 -11.470 -12.977
  446    HA   ILE  62           HA       ILE  62  -2.844  -8.638 -12.641
  447    HB   ILE  62           HB       ILE  62  -2.665 -10.477 -15.069
  448   1HG1  ILE  62          1HG1      ILE  62  -0.990  -8.234 -13.939
  449   2HG1  ILE  62          2HG1      ILE  62  -0.506  -9.653 -14.844
  450   1HG2  ILE  62          1HG2      ILE  62  -3.469  -8.591 -16.519
  451   2HG2  ILE  62          2HG2      ILE  62  -4.736  -9.082 -15.396
  452   3HG2  ILE  62          3HG2      ILE  62  -3.806  -7.600 -15.077
  453   1HD1  ILE  62          1HD1      ILE  62  -1.675  -7.107 -16.117
  454   2HD1  ILE  62          2HD1      ILE  62   0.001  -7.690 -16.188
  455   3HD1  ILE  62          3HD1      ILE  62  -1.286  -8.605 -17.007
  456    H    GLU  63           H        GLU  63  -4.167 -11.886 -13.074
  457    HA   GLU  63           HA       GLU  63  -6.937 -11.455 -13.519
  458   1HB   GLU  63          1HB       GLU  63  -5.897 -13.557 -11.551
  459   2HB   GLU  63          2HB       GLU  63  -5.723 -13.702 -13.290
  460   1HG   GLU  63          1HG       GLU  63  -8.270 -13.620 -13.520
  461   2HG   GLU  63          2HG       GLU  63  -7.655 -15.014 -12.649
  462    H    GLU  64           H        GLU  64  -5.078 -11.090 -10.536
  463    HA   GLU  64           HA       GLU  64  -7.491 -10.524  -8.824
  464   1HB   GLU  64          1HB       GLU  64  -4.965  -9.945  -7.474
  465   2HB   GLU  64          2HB       GLU  64  -4.826 -11.471  -8.326
  466   1HG   GLU  64          1HG       GLU  64  -7.392 -11.225  -6.787
  467   2HG   GLU  64          2HG       GLU  64  -6.265 -12.567  -6.881
  468    H    VAL  65           H        VAL  65  -4.638  -8.827 -10.111
  469    HA   VAL  65           HA       VAL  65  -5.750  -6.135  -9.177
  470    HB   VAL  65           HB       VAL  65  -3.459  -6.803  -8.357
  471   1HG1  VAL  65          1HG1      VAL  65  -3.416  -4.193 -10.003
  472   2HG1  VAL  65          2HG1      VAL  65  -4.302  -4.380  -8.478
  473   3HG1  VAL  65          3HG1      VAL  65  -2.530  -4.543  -8.499
  474   1HG2  VAL  65          1HG2      VAL  65  -1.468  -6.695  -9.773
  475   2HG2  VAL  65          2HG2      VAL  65  -2.593  -7.819 -10.573
  476   3HG2  VAL  65          3HG2      VAL  65  -2.409  -6.172 -11.191
  477    H    ASP  66           H        ASP  66  -7.104  -7.149 -11.222
  478    HA   ASP  66           HA       ASP  66  -6.970  -5.142 -13.328
  479   1HB   ASP  66          1HB       ASP  66  -4.918  -7.019 -13.734
  480   2HB   ASP  66          2HB       ASP  66  -6.190  -7.627 -14.768
  481    H    GLU  67           H        GLU  67  -8.941  -6.000 -11.800
  482    HA   GLU  67           HA       GLU  67 -10.633  -8.120 -13.111
  483   1HB   GLU  67          1HB       GLU  67 -10.349  -7.571 -10.527
  484   2HB   GLU  67          2HB       GLU  67 -11.839  -8.226 -11.180
  485   1HG   GLU  67          1HG       GLU  67 -12.993  -6.098 -11.005
  486   2HG   GLU  67          2HG       GLU  67 -11.499  -5.188 -10.868
  487    H    ASP  68           H        ASP  68  -9.932  -5.594 -14.549
  488    HA   ASP  68           HA       ASP  68 -12.562  -4.078 -14.738
  489   1HB   ASP  68          1HB       ASP  68 -10.715  -2.949 -16.607
  490   2HB   ASP  68          2HB       ASP  68 -11.335  -2.258 -15.126
  491    H    GLY  69           H        GLY  69 -10.263  -5.975 -16.688
  492   1HA   GLY  69          1HA       GLY  69 -12.381  -6.316 -18.892
  493   2HA   GLY  69          2HA       GLY  69 -11.514  -7.724 -18.264
  494    H    SER  70           H        SER  70 -10.187  -4.486 -18.805
  495    HA   SER  70           HA       SER  70  -9.029  -4.646 -21.402
  496   1HB   SER  70          1HB       SER  70  -9.054  -2.630 -19.831
  497   2HB   SER  70          2HB       SER  70  -7.599  -2.839 -20.810
  498    HG   SER  70           HG       SER  70  -6.498  -3.515 -19.084
  499    H    GLY  71           H        GLY  71  -7.465  -5.551 -18.302
  500   1HA   GLY  71          1HA       GLY  71  -5.880  -7.766 -19.690
  501   2HA   GLY  71          2HA       GLY  71  -6.155  -7.645 -17.947
  502    H    THR  72           H        THR  72  -5.207  -4.912 -19.937
  503    HA   THR  72           HA       THR  72  -2.292  -5.108 -19.200
  504    HB   THR  72           HB       THR  72  -2.196  -2.862 -20.574
  505    HG1  THR  72           HG1      THR  72  -4.582  -2.858 -20.555
  506   1HG2  THR  72          1HG2      THR  72  -1.996  -4.035 -22.729
  507   2HG2  THR  72          2HG2      THR  72  -1.231  -5.022 -21.465
  508   3HG2  THR  72          3HG2      THR  72  -2.834  -5.472 -22.103
  509    H    ILE  73           H        ILE  73  -1.424  -2.639 -18.829
  510    HA   ILE  73           HA       ILE  73  -3.035  -1.255 -16.647
  511    HB   ILE  73           HB       ILE  73  -0.237  -2.406 -16.193
  512   1HG1  ILE  73          1HG1      ILE  73  -2.536  -3.761 -15.754
  513   2HG1  ILE  73          2HG1      ILE  73  -1.154  -3.907 -14.690
  514   1HG2  ILE  73          1HG2      ILE  73  -0.151  -1.205 -14.012
  515   2HG2  ILE  73          2HG2      ILE  73  -0.324  -0.032 -15.324
  516   3HG2  ILE  73          3HG2      ILE  73  -1.730  -0.444 -14.313
  517   1HD1  ILE  73          1HD1      ILE  73  -3.602  -2.142 -14.102
  518   2HD1  ILE  73          2HD1      ILE  73  -3.155  -3.674 -13.321
  519   3HD1  ILE  73          3HD1      ILE  73  -2.140  -2.232 -13.081
  520    H    ASP  74           H        ASP  74  -3.289   0.246 -18.353
  521    HA   ASP  74           HA       ASP  74  -1.096   1.568 -19.813
  522   1HB   ASP  74          1HB       ASP  74  -4.030   2.228 -19.381
  523   2HB   ASP  74          2HB       ASP  74  -3.208   1.689 -20.839
  524    H    PHE  75           H        PHE  75  -1.187   4.152 -19.542
  525    HA   PHE  75           HA       PHE  75   0.392   4.697 -17.113
  526   1HB   PHE  75          1HB       PHE  75   0.804   5.826 -19.329
  527   2HB   PHE  75          2HB       PHE  75  -0.702   6.692 -19.187
  528    HD1  PHE  75           HD1      PHE  75  -0.933   8.038 -16.755
  529    HD2  PHE  75           HD2      PHE  75   2.761   7.012 -18.711
  530    HE1  PHE  75           HE1      PHE  75   0.230   9.820 -15.518
  531    HE2  PHE  75           HE2      PHE  75   3.907   8.795 -17.457
  532    HZ   PHE  75           HZ       PHE  75   2.650  10.191 -15.854
  533    H    GLU  76           H        GLU  76  -2.814   5.768 -18.262
  534    HA   GLU  76           HA       GLU  76  -3.536   7.435 -15.974
  535   1HB   GLU  76          1HB       GLU  76  -5.492   7.868 -17.007
  536   2HB   GLU  76          2HB       GLU  76  -4.612   7.239 -18.383
  537   1HG   GLU  76          1HG       GLU  76  -5.752   4.912 -17.801
  538   2HG   GLU  76          2HG       GLU  76  -6.810   5.851 -16.769
  539    H    GLU  77           H        GLU  77  -3.881   4.005 -16.671
  540    HA   GLU  77           HA       GLU  77  -5.641   3.336 -14.361
  541   1HB   GLU  77          1HB       GLU  77  -5.868   1.861 -16.177
  542   2HB   GLU  77          2HB       GLU  77  -4.145   1.676 -16.408
  543   1HG   GLU  77          1HG       GLU  77  -5.483   0.611 -13.856
  544   2HG   GLU  77          2HG       GLU  77  -3.920   0.154 -14.524
  545    H    PHE  78           H        PHE  78  -2.193   3.462 -14.994
  546    HA   PHE  78           HA       PHE  78  -1.213   1.995 -12.667
  547   1HB   PHE  78          1HB       PHE  78   0.180   2.622 -14.699
  548   2HB   PHE  78          2HB       PHE  78   0.202   4.287 -14.177
  549    HD1  PHE  78           HD1      PHE  78   2.788   3.868 -14.310
  550    HD2  PHE  78           HD2      PHE  78   0.312   1.883 -11.406
  551    HE1  PHE  78           HE1      PHE  78   4.778   3.337 -12.960
  552    HE2  PHE  78           HE2      PHE  78   2.313   1.348 -10.077
  553    HZ   PHE  78           HZ       PHE  78   4.545   2.079 -10.845
  554    H    LEU  79           H        LEU  79  -2.023   5.400 -13.230
  555    HA   LEU  79           HA       LEU  79  -1.115   6.468 -10.639
  556   1HB   LEU  79          1HB       LEU  79  -2.749   8.419 -11.241
  557   2HB   LEU  79          2HB       LEU  79  -3.067   7.567 -12.736
  558    HG   LEU  79           HG       LEU  79  -0.362   7.631 -12.974
  559   1HD1  LEU  79          1HD1      LEU  79  -0.898  10.163 -11.296
  560   2HD1  LEU  79          2HD1      LEU  79  -0.056   8.723 -10.691
  561   3HD1  LEU  79          3HD1      LEU  79   0.652   9.668 -12.025
  562   1HD2  LEU  79          1HD2      LEU  79  -0.575   9.608 -14.419
  563   2HD2  LEU  79          2HD2      LEU  79  -2.098   8.694 -14.556
  564   3HD2  LEU  79          3HD2      LEU  79  -2.038  10.156 -13.561
  565    H    VAL  80           H        VAL  80  -4.120   5.067 -11.827
  566    HA   VAL  80           HA       VAL  80  -5.855   5.723  -9.552
  567    HB   VAL  80           HB       VAL  80  -6.064   3.673 -11.781
  568   1HG1  VAL  80          1HG1      VAL  80  -8.303   2.940 -10.937
  569   2HG1  VAL  80          2HG1      VAL  80  -7.024   2.473  -9.808
  570   3HG1  VAL  80          3HG1      VAL  80  -8.063   3.868  -9.434
  571   1HG2  VAL  80          1HG2      VAL  80  -7.928   6.006 -10.987
  572   2HG2  VAL  80          2HG2      VAL  80  -6.741   6.047 -12.312
  573   3HG2  VAL  80          3HG2      VAL  80  -8.117   4.937 -12.399
  574    H    MET  81           H        MET  81  -3.739   2.984 -10.348
  575    HA   MET  81           HA       MET  81  -4.299   1.142  -8.188
  576   1HB   MET  81          1HB       MET  81  -2.580   0.995 -10.270
  577   2HB   MET  81          2HB       MET  81  -1.418   1.512  -9.062
  578   1HG   MET  81          1HG       MET  81  -3.225  -0.882  -8.435
  579   2HG   MET  81          2HG       MET  81  -1.633  -0.483  -7.767
  580   1HE   MET  81          1HE       MET  81  -3.660  -1.688 -10.928
  581   2HE   MET  81          2HE       MET  81  -2.546  -2.971 -11.488
  582   3HE   MET  81          3HE       MET  81  -3.250  -3.058  -9.848
  583    H    MET  82           H        MET  82  -1.599   3.485  -8.315
  584    HA   MET  82           HA       MET  82  -0.849   3.198  -5.494
  585   1HB   MET  82          1HB       MET  82  -0.059   5.122  -7.706
  586   2HB   MET  82          2HB       MET  82   0.324   5.571  -6.055
  587   1HG   MET  82          1HG       MET  82   2.048   4.154  -7.554
  588   2HG   MET  82          2HG       MET  82   1.093   2.771  -7.006
  589   1HE   MET  82          1HE       MET  82   2.006   1.428  -4.834
  590   2HE   MET  82          2HE       MET  82   0.485   2.301  -4.483
  591   3HE   MET  82          3HE       MET  82   1.823   2.334  -3.298
  592    H    VAL  83           H        VAL  83  -3.189   5.194  -7.154
  593    HA   VAL  83           HA       VAL  83  -3.456   7.431  -5.325
  594    HB   VAL  83           HB       VAL  83  -4.966   6.430  -7.629
  595   1HG1  VAL  83          1HG1      VAL  83  -4.844   9.293  -6.494
  596   2HG1  VAL  83          2HG1      VAL  83  -3.554   8.585  -7.477
  597   3HG1  VAL  83          3HG1      VAL  83  -5.178   8.796  -8.173
  598   1HG2  VAL  83          1HG2      VAL  83  -7.187   7.346  -7.190
  599   2HG2  VAL  83          2HG2      VAL  83  -6.848   6.203  -5.870
  600   3HG2  VAL  83          3HG2      VAL  83  -6.708   7.943  -5.580
  601    NH1  ARG  84           NH1      ARG  84  -9.894   0.199  -7.777
  602    NH2  ARG  84           NH2      ARG  84 -10.524  -1.239  -6.136
  603    H    ARG  84           H        ARG  84  -5.217   4.327  -5.509
  604    HA   ARG  84           HA       ARG  84  -7.145   4.691  -3.363
  605   1HB   ARG  84          1HB       ARG  84  -6.006   2.321  -4.829
  606   2HB   ARG  84          2HB       ARG  84  -6.607   1.978  -3.214
  607   1HG   ARG  84          1HG       ARG  84  -8.824   2.353  -3.746
  608   2HG   ARG  84          2HG       ARG  84  -8.473   3.657  -4.882
  609   1HD   ARG  84          1HD       ARG  84  -8.482   2.251  -6.688
  610   2HD   ARG  84          2HD       ARG  84  -7.390   1.096  -5.921
  611    HE   ARG  84           HE       ARG  84  -9.963   0.713  -4.657
  612   1HH1  ARG  84          1HH1      ARG  84 -10.581  -1.435  -5.130
  613   2HH1  ARG  84          2HH1      ARG  84 -10.871  -1.831  -6.898
  614   1HH2  ARG  84          1HH2      ARG  84  -9.390   1.056  -8.032
  615   2HH2  ARG  84          2HH2      ARG  84 -10.369  -0.448  -8.416
  616    H    GLN  85           H        GLN  85  -3.884   3.219  -3.306
  617    HA   GLN  85           HA       GLN  85  -3.847   2.518  -0.451
  618   1HB   GLN  85          1HB       GLN  85  -1.282   2.404  -0.822
  619   2HB   GLN  85          2HB       GLN  85  -1.587   2.872  -2.485
  620   1HG   GLN  85          1HG       GLN  85  -3.077   0.461  -1.346
  621   2HG   GLN  85          2HG       GLN  85  -2.717   0.829  -3.019
  622   1HE2  GLN  85          1HE2      GLN  85   0.347  -0.803  -0.699
  623   2HE2  GLN  85          2HE2      GLN  85  -0.905   0.301   0.062
  624    H    MET  86           H        MET  86  -3.045   5.410  -2.275
  625    HA   MET  86           HA       MET  86  -1.439   6.835  -0.280
  626   1HB   MET  86          1HB       MET  86  -2.781   8.822  -1.854
  627   2HB   MET  86          2HB       MET  86  -2.571   7.445  -2.920
  628   1HG   MET  86          1HG       MET  86  -0.080   8.069  -1.373
  629   2HG   MET  86          2HG       MET  86  -0.295   7.736  -3.100
  630   1HE   MET  86          1HE       MET  86  -2.556   9.807  -4.053
  631   2HE   MET  86          2HE       MET  86  -1.563  11.215  -4.530
  632   3HE   MET  86          3HE       MET  86  -1.031   9.564  -4.961
  633    H    LYS  87           H        LYS  87  -4.882   6.389  -0.732
  634    HA   LYS  87           HA       LYS  87  -5.791   8.695   0.960
  635   1HB   LYS  87          1HB       LYS  87  -7.118   7.437  -1.000
  636   2HB   LYS  87          2HB       LYS  87  -7.943   8.179   0.362
  637   1HG   LYS  87          1HG       LYS  87  -8.504   6.138   1.384
  638   2HG   LYS  87          2HG       LYS  87  -7.188   5.243   0.643
  639   1HD   LYS  87          1HD       LYS  87  -8.485   5.646  -1.640
  640   2HD   LYS  87          2HD       LYS  87  -9.021   4.407  -0.512
  641   1HE   LYS  87          1HE       LYS  87 -11.041   5.471  -0.055
  642   2HE   LYS  87          2HE       LYS  87 -10.316   7.084  -0.020
  643   1HZ   LYS  87          1HZ       LYS  87 -10.096   6.536  -2.616
  644   2HZ   LYS  87          2HZ       LYS  87 -11.437   7.245  -1.962
  645   3HZ   LYS  87          3HZ       LYS  87 -11.433   5.624  -2.281
  646    H    GLU  88           H        GLU  88  -5.089   5.268   1.329
  647    HA   GLU  88           HA       GLU  88  -6.330   4.612   3.825
  648   1HB   GLU  88          1HB       GLU  88  -5.312   2.854   2.579
  649   2HB   GLU  88          2HB       GLU  88  -3.734   3.619   2.566
  650   1HG   GLU  88          1HG       GLU  88  -3.580   3.235   5.102
  651   2HG   GLU  88          2HG       GLU  88  -5.122   2.398   5.038
  652    H    ASP  89           H        ASP  89  -6.352   6.361   5.176
  653    HA   ASP  89           HA       ASP  89  -4.290   6.450   7.248
  654   1HB   ASP  89          1HB       ASP  89  -4.215   8.859   5.346
  655   2HB   ASP  89          2HB       ASP  89  -2.929   7.714   5.648
  656    H    ALA  90           H        ALA  90  -5.915   6.240   8.644
  657    HA   ALA  90           HA       ALA  90  -7.832   8.580   9.085
  658   1HB   ALA  90          1HB       ALA  90  -9.773   7.019   9.379
  659   2HB   ALA  90          2HB       ALA  90  -9.128   6.915   7.729
  660   3HB   ALA  90          3HB       ALA  90  -8.765   5.628   8.906
   
  Start of MODEL          31
 Raw file had  660 H/Q atoms
  Start of MODEL   31
    1   1H    ALA   1          1H        ALA   1 -16.619   2.025 -20.141
    2   2H    ALA   1          2H        ALA   1 -15.636   0.822 -19.498
    3   3H    ALA   1          3H        ALA   1 -16.955   1.388 -18.622
    4    HA   ALA   1           HA       ALA   1 -15.492   2.617 -17.556
    5   1HB   ALA   1          1HB       ALA   1 -13.543   2.829 -19.899
    6   2HB   ALA   1          2HB       ALA   1 -13.679   1.292 -19.022
    7   3HB   ALA   1          3HB       ALA   1 -13.194   2.772 -18.155
    8    H    SER   2           H        SER   2 -17.609   3.757 -18.458
    9    HA   SER   2           HA       SER   2 -17.136   6.056 -20.354
   10   1HB   SER   2          1HB       SER   2 -19.269   5.153 -20.680
   11   2HB   SER   2          2HB       SER   2 -19.578   4.909 -18.959
   12    HG   SER   2           HG       SER   2 -20.553   6.766 -20.191
   13    H    MET   3           H        MET   3 -17.642   5.447 -16.900
   14    HA   MET   3           HA       MET   3 -16.555   8.188 -16.169
   15   1HB   MET   3          1HB       MET   3 -19.120   8.316 -16.431
   16   2HB   MET   3          2HB       MET   3 -19.252   7.276 -15.025
   17   1HG   MET   3          1HG       MET   3 -19.485   9.466 -14.127
   18   2HG   MET   3          2HG       MET   3 -17.802   9.068 -13.758
   19   1HE   MET   3          1HE       MET   3 -16.991  11.083 -13.312
   20   2HE   MET   3          2HE       MET   3 -17.040  12.584 -14.283
   21   3HE   MET   3          3HE       MET   3 -15.788  11.352 -14.613
   22    H    THR   4           H        THR   4 -14.842   7.408 -15.109
   23    HA   THR   4           HA       THR   4 -15.184   5.188 -13.062
   24    HB   THR   4           HB       THR   4 -12.439   5.481 -13.349
   25    HG1  THR   4           HG1      THR   4 -13.042   5.219 -15.933
   26   1HG2  THR   4          1HG2      THR   4 -13.141   3.227 -13.327
   27   2HG2  THR   4          2HG2      THR   4 -12.686   3.439 -15.033
   28   3HG2  THR   4          3HG2      THR   4 -14.403   3.468 -14.554
   29    H    ASP   5           H        ASP   5 -15.631   6.019 -11.150
   30    HA   ASP   5           HA       ASP   5 -14.659   8.707 -10.250
   31   1HB   ASP   5          1HB       ASP   5 -16.743   6.777  -9.289
   32   2HB   ASP   5          2HB       ASP   5 -15.930   7.658  -8.016
   33    H    GLN   6           H        GLN   6 -14.036   5.312  -9.588
   34    HA   GLN   6           HA       GLN   6 -12.461   5.299  -7.212
   35   1HB   GLN   6          1HB       GLN   6 -12.179   3.145  -7.752
   36   2HB   GLN   6          2HB       GLN   6 -12.966   3.460  -9.287
   37   1HG   GLN   6          1HG       GLN   6 -10.801   3.856 -10.414
   38   2HG   GLN   6          2HG       GLN   6  -9.931   3.792  -8.898
   39   1HE2  GLN   6          1HE2      GLN   6  -9.535   0.421 -10.508
   40   2HE2  GLN   6          2HE2      GLN   6  -9.191   2.160 -10.983
   41    H    GLN   7           H        GLN   7 -11.400   5.992 -10.548
   42    HA   GLN   7           HA       GLN   7  -8.560   6.603  -9.776
   43   1HB   GLN   7          1HB       GLN   7  -8.317   7.295 -12.222
   44   2HB   GLN   7          2HB       GLN   7  -8.778   5.624 -11.933
   45   1HG   GLN   7          1HG       GLN   7 -11.204   6.206 -12.428
   46   2HG   GLN   7          2HG       GLN   7 -10.714   7.843 -12.835
   47   1HE2  GLN   7          1HE2      GLN   7  -9.877   4.711 -15.443
   48   2HE2  GLN   7          2HE2      GLN   7 -10.374   4.406 -13.704
   49    H    ALA   8           H        ALA   8 -11.548   8.343 -10.442
   50    HA   ALA   8           HA       ALA   8 -10.617  11.042 -10.847
   51   1HB   ALA   8          1HB       ALA   8 -12.874  11.769 -10.089
   52   2HB   ALA   8          2HB       ALA   8 -12.978  10.379 -11.186
   53   3HB   ALA   8          3HB       ALA   8 -13.212  10.149  -9.434
   54    H    GLU   9           H        GLU   9 -11.035   9.155  -7.894
   55    HA   GLU   9           HA       GLU   9 -10.790  11.354  -5.938
   56   1HB   GLU   9          1HB       GLU   9  -9.957   8.612  -5.009
   57   2HB   GLU   9          2HB       GLU   9 -11.004   9.806  -4.256
   58   1HG   GLU   9          1HG       GLU   9 -12.727   9.175  -6.234
   59   2HG   GLU   9          2HG       GLU   9 -11.766   7.704  -6.338
   60    H    ALA  10           H        ALA  10  -8.502   8.814  -7.002
   61    HA   ALA  10           HA       ALA  10  -6.219   9.711  -5.395
   62   1HB   ALA  10          1HB       ALA  10  -4.881   8.135  -6.781
   63   2HB   ALA  10          2HB       ALA  10  -6.399   7.391  -6.246
   64   3HB   ALA  10          3HB       ALA  10  -6.228   7.950  -7.930
   65    NH1  ARG  11           NH1      ARG  11  -6.020  15.894 -14.251
   66    NH2  ARG  11           NH2      ARG  11  -5.877  14.715 -16.187
   67    H    ARG  11           H        ARG  11  -7.469  10.621  -8.534
   68    HA   ARG  11           HA       ARG  11  -5.011  11.903  -9.640
   69   1HB   ARG  11          1HB       ARG  11  -7.346  11.009 -10.805
   70   2HB   ARG  11          2HB       ARG  11  -7.724  12.720 -10.669
   71   1HG   ARG  11          1HG       ARG  11  -5.053  12.664 -11.708
   72   2HG   ARG  11          2HG       ARG  11  -5.914  11.391 -12.576
   73   1HD   ARG  11          1HD       ARG  11  -7.783  13.058 -13.106
   74   2HD   ARG  11          2HD       ARG  11  -6.834  14.338 -12.349
   75    HE   ARG  11           HE       ARG  11  -5.514  12.790 -14.611
   76   1HH1  ARG  11          1HH1      ARG  11  -5.862  13.796 -16.644
   77   2HH1  ARG  11          2HH1      ARG  11  -5.823  15.631 -16.647
   78   1HH2  ARG  11          1HH2      ARG  11  -6.159  15.877 -13.235
   79   2HH2  ARG  11          2HH2      ARG  11  -5.903  16.725 -14.842
   80    H    ALA  12           H        ALA  12  -7.992  12.994  -8.042
   81    HA   ALA  12           HA       ALA  12  -7.524  15.902  -8.312
   82   1HB   ALA  12          1HB       ALA  12  -9.398  16.163  -6.700
   83   2HB   ALA  12          2HB       ALA  12  -9.804  14.999  -7.977
   84   3HB   ALA  12          3HB       ALA  12  -9.380  14.418  -6.348
   85    H    PHE  13           H        PHE  13  -6.673  13.439  -5.942
   86    HA   PHE  13           HA       PHE  13  -5.743  15.262  -3.811
   87   1HB   PHE  13          1HB       PHE  13  -6.561  12.957  -3.368
   88   2HB   PHE  13          2HB       PHE  13  -5.218  12.261  -4.237
   89    HD1  PHE  13           HD1      PHE  13  -5.734  11.447  -1.452
   90    HD2  PHE  13           HD2      PHE  13  -3.461  14.827  -2.841
   91    HE1  PHE  13           HE1      PHE  13  -4.400  11.415   0.616
   92    HE2  PHE  13           HE2      PHE  13  -2.138  14.777  -0.768
   93    HZ   PHE  13           HZ       PHE  13  -2.601  13.074   0.961
   94    H    LEU  14           H        LEU  14  -4.162  13.307  -6.338
   95    HA   LEU  14           HA       LEU  14  -1.404  14.419  -5.668
   96   1HB   LEU  14          1HB       LEU  14  -0.455  12.660  -6.980
   97   2HB   LEU  14          2HB       LEU  14  -1.945  12.341  -7.840
   98    HG   LEU  14           HG       LEU  14  -2.825  11.655  -5.348
   99   1HD1  LEU  14          1HD1      LEU  14  -2.340   9.281  -5.947
  100   2HD1  LEU  14          2HD1      LEU  14  -2.886  10.187  -7.369
  101   3HD1  LEU  14          3HD1      LEU  14  -1.158   9.802  -7.174
  102   1HD2  LEU  14          1HD2      LEU  14   0.207  11.048  -5.214
  103   2HD2  LEU  14          2HD2      LEU  14  -0.689  12.156  -4.146
  104   3HD2  LEU  14          3HD2      LEU  14  -1.029  10.420  -4.094
  105    H    SER  15           H        SER  15  -1.021  16.296  -6.552
  106    HA   SER  15           HA       SER  15  -2.339  17.465  -8.893
  107   1HB   SER  15          1HB       SER  15   0.333  18.600  -8.151
  108   2HB   SER  15          2HB       SER  15  -0.825  18.481  -6.823
  109    HG   SER  15           HG       SER  15  -1.327  20.327  -7.740
  110    H    GLU  16           H        GLU  16  -0.664  18.488 -10.599
  111    HA   GLU  16           HA       GLU  16   0.228  16.215 -12.307
  112   1HB   GLU  16          1HB       GLU  16  -0.918  18.382 -13.103
  113   2HB   GLU  16          2HB       GLU  16   0.624  19.192 -12.903
  114   1HG   GLU  16          1HG       GLU  16   0.421  18.597 -15.244
  115   2HG   GLU  16          2HG       GLU  16   1.665  17.558 -14.570
  116    H    GLU  17           H        GLU  17   1.692  18.695 -10.300
  117    HA   GLU  17           HA       GLU  17   4.497  18.364 -11.242
  118   1HB   GLU  17          1HB       GLU  17   3.919  19.495  -8.490
  119   2HB   GLU  17          2HB       GLU  17   5.191  19.912  -9.622
  120   1HG   GLU  17          1HG       GLU  17   2.219  20.565 -10.140
  121   2HG   GLU  17          2HG       GLU  17   3.292  21.644  -9.266
  122    H    MET  18           H        MET  18   2.465  17.002  -8.704
  123    HA   MET  18           HA       MET  18   4.608  15.467  -7.312
  124   1HB   MET  18          1HB       MET  18   1.648  14.763  -7.061
  125   2HB   MET  18          2HB       MET  18   2.939  14.575  -5.888
  126   1HG   MET  18          1HG       MET  18   1.381  17.097  -6.596
  127   2HG   MET  18          2HG       MET  18   3.033  17.274  -5.981
  128   1HE   MET  18          1HE       MET  18   1.572  18.692  -4.007
  129   2HE   MET  18          2HE       MET  18   1.773  17.815  -2.460
  130   3HE   MET  18          3HE       MET  18   3.159  17.977  -3.580
  131    H    ILE  19           H        ILE  19   2.220  14.882  -9.843
  132    HA   ILE  19           HA       ILE  19   2.458  11.989 -10.111
  133    HB   ILE  19           HB       ILE  19   1.515  14.165 -11.998
  134   1HG1  ILE  19          1HG1      ILE  19  -0.216  11.774 -11.538
  135   2HG1  ILE  19          2HG1      ILE  19  -0.607  13.479 -11.451
  136   1HG2  ILE  19          1HG2      ILE  19   0.977  12.490 -13.785
  137   2HG2  ILE  19          2HG2      ILE  19   2.720  12.569 -13.530
  138   3HG2  ILE  19          3HG2      ILE  19   1.794  11.206 -12.859
  139   1HD1  ILE  19          1HD1      ILE  19   0.244  13.680  -9.131
  140   2HD1  ILE  19          2HD1      ILE  19  -0.933  12.357  -9.253
  141   3HD1  ILE  19          3HD1      ILE  19   0.805  11.985  -9.164
  142    H    ALA  20           H        ALA  20   4.352  14.712 -11.327
  143    HA   ALA  20           HA       ALA  20   6.077  13.428 -13.246
  144   1HB   ALA  20          1HB       ALA  20   7.658  15.313 -12.847
  145   2HB   ALA  20          2HB       ALA  20   5.983  15.885 -12.973
  146   3HB   ALA  20          3HB       ALA  20   6.771  15.785 -11.378
  147    H    GLU  21           H        GLU  21   6.252  13.577  -9.715
  148    HA   GLU  21           HA       GLU  21   9.010  12.651  -9.341
  149   1HB   GLU  21          1HB       GLU  21   8.397  12.237  -6.983
  150   2HB   GLU  21          2HB       GLU  21   6.690  12.386  -7.352
  151   1HG   GLU  21          1HG       GLU  21   6.842  14.771  -7.707
  152   2HG   GLU  21          2HG       GLU  21   8.579  14.728  -7.952
  153    H    PHE  22           H        PHE  22   5.892  11.056  -9.709
  154    HA   PHE  22           HA       PHE  22   6.935   8.291  -9.142
  155   1HB   PHE  22          1HB       PHE  22   4.141   9.072 -10.172
  156   2HB   PHE  22          2HB       PHE  22   4.627   7.528  -9.524
  157    HD1  PHE  22           HD1      PHE  22   3.058  10.586  -8.641
  158    HD2  PHE  22           HD2      PHE  22   5.720   7.612  -7.028
  159    HE1  PHE  22           HE1      PHE  22   2.584  11.382  -6.364
  160    HE2  PHE  22           HE2      PHE  22   5.229   8.422  -4.757
  161    HZ   PHE  22           HZ       PHE  22   3.699  10.333  -4.422
  162    H    LYS  23           H        LYS  23   6.450  10.383 -11.875
  163    HA   LYS  23           HA       LYS  23   5.931   8.646 -14.098
  164   1HB   LYS  23          1HB       LYS  23   7.135  11.341 -13.776
  165   2HB   LYS  23          2HB       LYS  23   7.884  10.466 -15.092
  166   1HG   LYS  23          1HG       LYS  23   5.902  11.965 -15.712
  167   2HG   LYS  23          2HG       LYS  23   4.854  10.870 -14.828
  168   1HD   LYS  23          1HD       LYS  23   5.620   8.956 -16.363
  169   2HD   LYS  23          2HD       LYS  23   4.642  10.211 -17.132
  170   1HE   LYS  23          1HE       LYS  23   7.567  10.832 -17.265
  171   2HE   LYS  23          2HE       LYS  23   6.354  10.863 -18.553
  172   1HZ   LYS  23          1HZ       LYS  23   7.744   9.117 -19.133
  173   2HZ   LYS  23          2HZ       LYS  23   6.516   8.299 -18.388
  174   3HZ   LYS  23          3HZ       LYS  23   7.938   8.561 -17.589
  175    H    ALA  24           H        ALA  24   9.088   9.536 -12.675
  176    HA   ALA  24           HA       ALA  24  10.849   8.117 -14.473
  177   1HB   ALA  24          1HB       ALA  24  12.552   8.255 -12.665
  178   2HB   ALA  24          2HB       ALA  24  11.680   9.788 -12.845
  179   3HB   ALA  24          3HB       ALA  24  11.303   8.706 -11.480
  180    H    ALA  25           H        ALA  25   9.599   7.075 -11.281
  181    HA   ALA  25           HA       ALA  25  10.753   4.396 -11.211
  182   1HB   ALA  25          1HB       ALA  25   9.130   3.951  -9.379
  183   2HB   ALA  25          2HB       ALA  25   9.907   5.533  -9.177
  184   3HB   ALA  25          3HB       ALA  25   8.229   5.436  -9.770
  185    H    PHE  26           H        PHE  26   7.925   5.709 -12.784
  186    HA   PHE  26           HA       PHE  26   6.284   3.275 -13.041
  187   1HB   PHE  26          1HB       PHE  26   5.255   5.482 -13.381
  188   2HB   PHE  26          2HB       PHE  26   6.265   5.826 -14.760
  189    HD1  PHE  26           HD1      PHE  26   3.040   4.838 -13.842
  190    HD2  PHE  26           HD2      PHE  26   6.098   3.726 -16.656
  191    HE1  PHE  26           HE1      PHE  26   1.338   3.837 -15.313
  192    HE2  PHE  26           HE2      PHE  26   4.380   2.738 -18.118
  193    HZ   PHE  26           HZ       PHE  26   2.002   2.795 -17.453
  194    H    ASP  27           H        ASP  27   8.691   4.856 -15.136
  195    HA   ASP  27           HA       ASP  27   8.549   2.989 -17.396
  196   1HB   ASP  27          1HB       ASP  27  10.933   4.769 -16.629
  197   2HB   ASP  27          2HB       ASP  27   9.539   5.309 -17.536
  198    H    MET  28           H        MET  28  10.346   3.054 -14.376
  199    HA   MET  28           HA       MET  28  12.322   0.957 -14.893
  200   1HB   MET  28          1HB       MET  28  11.084   1.844 -12.226
  201   2HB   MET  28          2HB       MET  28  12.591   2.391 -12.937
  202   1HG   MET  28          1HG       MET  28  13.790   0.503 -12.260
  203   2HG   MET  28          2HG       MET  28  12.412  -0.593 -12.457
  204   1HE   MET  28          1HE       MET  28  13.466   2.668 -10.325
  205   2HE   MET  28          2HE       MET  28  13.504   1.901  -8.710
  206   3HE   MET  28          3HE       MET  28  14.607   1.326  -9.995
  207    H    PHE  29           H        PHE  29   9.052   0.862 -13.478
  208    HA   PHE  29           HA       PHE  29   8.984  -2.033 -12.930
  209   1HB   PHE  29          1HB       PHE  29   6.787   0.092 -13.096
  210   2HB   PHE  29          2HB       PHE  29   6.358  -1.593 -12.966
  211    HD1  PHE  29           HD1      PHE  29   8.021  -2.856 -11.008
  212    HD2  PHE  29           HD2      PHE  29   6.742   1.255 -11.036
  213    HE1  PHE  29           HE1      PHE  29   8.293  -2.741  -8.564
  214    HE2  PHE  29           HE2      PHE  29   7.014   1.344  -8.592
  215    HZ   PHE  29           HZ       PHE  29   7.797  -0.644  -7.355
  216    H    ASP  30           H        ASP  30   8.111   0.009 -15.670
  217    HA   ASP  30           HA       ASP  30   6.607  -1.845 -17.306
  218   1HB   ASP  30          1HB       ASP  30   8.475   0.208 -18.583
  219   2HB   ASP  30          2HB       ASP  30   7.073   0.727 -17.675
  220    H    ALA  31           H        ALA  31  10.063  -0.976 -17.702
  221    HA   ALA  31           HA       ALA  31  11.976  -2.241 -18.430
  222   1HB   ALA  31          1HB       ALA  31  12.014  -4.664 -17.835
  223   2HB   ALA  31          2HB       ALA  31  11.406  -3.668 -16.498
  224   3HB   ALA  31          3HB       ALA  31  10.271  -4.634 -17.477
  225    H    ASP  32           H        ASP  32   9.656  -1.602 -20.217
  226    HA   ASP  32           HA       ASP  32  10.299  -3.521 -22.501
  227   1HB   ASP  32          1HB       ASP  32   7.570  -2.991 -21.386
  228   2HB   ASP  32          2HB       ASP  32   8.209  -4.397 -22.206
  229    H    GLY  33           H        GLY  33   8.006  -0.822 -22.406
  230   1HA   GLY  33          1HA       GLY  33   9.912   0.925 -24.077
  231   2HA   GLY  33          2HA       GLY  33   8.229   0.720 -24.505
  232    H    GLY  34           H        GLY  34   6.609   1.515 -22.962
  233   1HA   GLY  34          1HA       GLY  34   7.418   4.188 -21.790
  234   2HA   GLY  34          2HA       GLY  34   6.735   3.051 -20.621
  235    H    GLY  35           H        GLY  35   4.605   2.730 -20.517
  236   1HA   GLY  35          1HA       GLY  35   2.730   4.728 -21.396
  237   2HA   GLY  35          2HA       GLY  35   2.607   3.446 -22.609
  238    H    ASP  36           H        ASP  36   2.939   1.163 -21.210
  239    HA   ASP  36           HA       ASP  36   0.998   1.007 -18.906
  240   1HB   ASP  36          1HB       ASP  36  -0.833   0.824 -20.229
  241   2HB   ASP  36          2HB       ASP  36  -0.312  -0.837 -20.395
  242    H    ILE  37           H        ILE  37   1.433  -0.679 -17.664
  243    HA   ILE  37           HA       ILE  37   3.661  -2.581 -18.413
  244    HB   ILE  37           HB       ILE  37   2.524  -3.131 -15.780
  245   1HG1  ILE  37          1HG1      ILE  37   3.062  -0.212 -16.350
  246   2HG1  ILE  37          2HG1      ILE  37   1.963  -0.957 -15.205
  247   1HG2  ILE  37          1HG2      ILE  37   4.886  -3.080 -15.080
  248   2HG2  ILE  37          2HG2      ILE  37   4.736  -3.946 -16.616
  249   3HG2  ILE  37          3HG2      ILE  37   5.367  -2.282 -16.597
  250   1HD1  ILE  37          1HD1      ILE  37   4.997  -0.673 -14.774
  251   2HD1  ILE  37          2HD1      ILE  37   3.697   0.217 -13.954
  252   3HD1  ILE  37          3HD1      ILE  37   3.890  -1.527 -13.666
  253    H    SER  38           H        SER  38   3.101  -4.845 -17.080
  254    HA   SER  38           HA       SER  38   0.368  -5.916 -17.800
  255   1HB   SER  38          1HB       SER  38   2.684  -7.344 -19.155
  256   2HB   SER  38          2HB       SER  38   0.960  -7.380 -19.533
  257    HG   SER  38           HG       SER  38   2.399  -6.095 -20.900
  258    H    THR  39           H        THR  39   1.214  -8.626 -17.853
  259    HA   THR  39           HA       THR  39   1.602  -9.146 -14.914
  260    HB   THR  39           HB       THR  39   1.416 -11.657 -15.803
  261    HG1  THR  39           HG1      THR  39  -0.326 -10.785 -17.647
  262   1HG2  THR  39          1HG2      THR  39  -1.025 -11.618 -15.536
  263   2HG2  THR  39          2HG2      THR  39  -0.303 -10.535 -14.324
  264   3HG2  THR  39          3HG2      THR  39  -1.086  -9.857 -15.776
  265    H    LYS  40           H        LYS  40   3.145 -10.230 -17.968
  266    HA   LYS  40           HA       LYS  40   5.483 -11.489 -16.678
  267   1HB   LYS  40          1HB       LYS  40   5.746 -12.374 -18.690
  268   2HB   LYS  40          2HB       LYS  40   6.219 -10.844 -19.380
  269   1HG   LYS  40          1HG       LYS  40   3.301 -11.830 -19.108
  270   2HG   LYS  40          2HG       LYS  40   3.812 -10.419 -19.996
  271   1HD   LYS  40          1HD       LYS  40   3.982 -13.343 -20.823
  272   2HD   LYS  40          2HD       LYS  40   3.395 -11.942 -21.671
  273   1HE   LYS  40          1HE       LYS  40   5.355 -11.421 -22.659
  274   2HE   LYS  40          2HE       LYS  40   6.334 -11.730 -21.230
  275   1HZ   LYS  40          1HZ       LYS  40   6.469 -13.257 -23.334
  276   2HZ   LYS  40          2HZ       LYS  40   5.171 -14.034 -22.670
  277   3HZ   LYS  40          3HZ       LYS  40   6.593 -13.937 -21.833
  278    H    GLU  41           H        GLU  41   4.901  -8.391 -18.360
  279    HA   GLU  41           HA       GLU  41   7.506  -7.214 -18.345
  280   1HB   GLU  41          1HB       GLU  41   6.409  -4.968 -18.360
  281   2HB   GLU  41          2HB       GLU  41   4.872  -5.711 -17.975
  282   1HG   GLU  41          1HG       GLU  41   6.439  -6.399 -20.538
  283   2HG   GLU  41          2HG       GLU  41   4.805  -6.885 -20.142
  284    H    LEU  42           H        LEU  42   4.978  -6.976 -15.832
  285    HA   LEU  42           HA       LEU  42   6.531  -5.368 -13.900
  286   1HB   LEU  42          1HB       LEU  42   4.152  -7.232 -13.323
  287   2HB   LEU  42          2HB       LEU  42   3.988  -5.598 -13.928
  288    HG   LEU  42           HG       LEU  42   5.619  -5.813 -11.405
  289   1HD1  LEU  42          1HD1      LEU  42   4.267  -3.792 -10.783
  290   2HD1  LEU  42          2HD1      LEU  42   5.029  -3.595 -12.369
  291   3HD1  LEU  42          3HD1      LEU  42   3.291  -3.972 -12.263
  292   1HD2  LEU  42          1HD2      LEU  42   2.581  -6.398 -11.316
  293   2HD2  LEU  42          2HD2      LEU  42   3.879  -7.543 -10.893
  294   3HD2  LEU  42          3HD2      LEU  42   3.631  -6.090  -9.908
  295    H    GLY  43           H        GLY  43   6.073  -8.808 -14.515
  296   1HA   GLY  43          1HA       GLY  43   6.991 -10.128 -12.184
  297   2HA   GLY  43          2HA       GLY  43   7.331 -10.750 -13.803
  298    H    THR  44           H        THR  44   8.878  -8.322 -14.539
  299    HA   THR  44           HA       THR  44  11.536  -9.386 -13.960
  300    HB   THR  44           HB       THR  44  10.496  -7.049 -15.501
  301    HG1  THR  44           HG1      THR  44  11.007  -8.963 -16.461
  302   1HG2  THR  44          1HG2      THR  44  12.756  -6.040 -15.861
  303   2HG2  THR  44          2HG2      THR  44  12.205  -5.802 -14.189
  304   3HG2  THR  44          3HG2      THR  44  13.428  -7.046 -14.553
  305    H    VAL  45           H        VAL  45  10.521  -6.045 -13.247
  306    HA   VAL  45           HA       VAL  45  12.549  -5.406 -11.341
  307    HB   VAL  45           HB       VAL  45  10.015  -4.154 -12.154
  308   1HG1  VAL  45          1HG1      VAL  45   9.692  -2.670 -10.174
  309   2HG1  VAL  45          2HG1      VAL  45   9.380  -4.354  -9.737
  310   3HG1  VAL  45          3HG1      VAL  45  10.910  -3.589  -9.252
  311   1HG2  VAL  45          1HG2      VAL  45  12.662  -2.920 -11.141
  312   2HG2  VAL  45          2HG2      VAL  45  12.248  -3.240 -12.841
  313   3HG2  VAL  45          3HG2      VAL  45  11.328  -2.036 -11.927
  314    H    MET  46           H        MET  46   9.403  -6.968 -10.875
  315    HA   MET  46           HA       MET  46   9.144  -6.901  -7.993
  316   1HB   MET  46          1HB       MET  46   7.891  -9.229  -8.391
  317   2HB   MET  46          2HB       MET  46   8.086  -8.838 -10.090
  318   1HG   MET  46          1HG       MET  46   6.948  -6.574  -8.461
  319   2HG   MET  46          2HG       MET  46   6.474  -7.179 -10.057
  320   1HE   MET  46          1HE       MET  46   4.084  -6.367  -8.385
  321   2HE   MET  46          2HE       MET  46   3.491  -7.484  -7.121
  322   3HE   MET  46          3HE       MET  46   4.967  -6.516  -6.833
  323    NH1  ARG  47           NH1      ARG  47   9.196 -15.965  -7.684
  324    NH2  ARG  47           NH2      ARG  47   8.024 -15.635  -5.765
  325    H    ARG  47           H        ARG  47  10.205  -9.734  -9.900
  326    HA   ARG  47           HA       ARG  47  11.636 -10.929  -7.525
  327   1HB   ARG  47          1HB       ARG  47  10.493 -11.935 -10.078
  328   2HB   ARG  47          2HB       ARG  47  12.074 -12.624  -9.738
  329   1HG   ARG  47          1HG       ARG  47  10.910 -14.158  -8.507
  330   2HG   ARG  47          2HG       ARG  47  10.980 -12.930  -7.243
  331   1HD   ARG  47          1HD       ARG  47   8.694 -12.017  -8.231
  332   2HD   ARG  47          2HD       ARG  47   8.632 -13.520  -9.137
  333    HE   ARG  47           HE       ARG  47   7.970 -13.300  -6.312
  334   1HH1  ARG  47          1HH1      ARG  47   9.618 -15.551  -8.522
  335   2HH1  ARG  47          2HH1      ARG  47   9.201 -16.957  -7.419
  336   1HH2  ARG  47          1HH2      ARG  47   7.552 -14.973  -5.139
  337   2HH2  ARG  47          2HH2      ARG  47   8.110 -16.649  -5.635
  338    H    MET  48           H        MET  48  12.688  -8.486  -8.872
  339    HA   MET  48           HA       MET  48  15.164  -9.046 -10.364
  340   1HB   MET  48          1HB       MET  48  13.921  -6.716  -9.863
  341   2HB   MET  48          2HB       MET  48  15.620  -6.825 -10.284
  342   1HG   MET  48          1HG       MET  48  15.981  -6.910  -7.597
  343   2HG   MET  48          2HG       MET  48  14.367  -6.181  -7.578
  344   1HE   MET  48          1HE       MET  48  14.084  -3.674  -7.495
  345   2HE   MET  48          2HE       MET  48  14.787  -2.611  -8.748
  346   3HE   MET  48          3HE       MET  48  13.734  -3.974  -9.226
  347    H    LEU  49           H        LEU  49  14.263  -9.091  -6.966
  348    HA   LEU  49           HA       LEU  49  16.708  -9.053  -5.529
  349   1HB   LEU  49          1HB       LEU  49  15.674 -10.667  -3.884
  350   2HB   LEU  49          2HB       LEU  49  14.380 -10.999  -5.014
  351    HG   LEU  49           HG       LEU  49  14.674  -8.767  -3.101
  352   1HD1  LEU  49          1HD1      LEU  49  12.233  -9.660  -4.759
  353   2HD1  LEU  49          2HD1      LEU  49  12.740 -10.421  -3.241
  354   3HD1  LEU  49          3HD1      LEU  49  12.214  -8.720  -3.246
  355   1HD2  LEU  49          1HD2      LEU  49  13.798  -6.903  -4.446
  356   2HD2  LEU  49          2HD2      LEU  49  15.275  -7.484  -5.253
  357   3HD2  LEU  49          3HD2      LEU  49  13.689  -7.924  -5.903
  358    H    GLY  50           H        GLY  50  15.190 -11.939  -7.009
  359   1HA   GLY  50          1HA       GLY  50  17.129 -13.133  -8.567
  360   2HA   GLY  50          2HA       GLY  50  17.853 -13.418  -6.979
  361    H    GLN  51           H        GLN  51  14.909 -13.957  -8.873
  362    HA   GLN  51           HA       GLN  51  14.629 -16.764  -7.730
  363   1HB   GLN  51          1HB       GLN  51  11.947 -15.630  -7.905
  364   2HB   GLN  51          2HB       GLN  51  12.922 -14.605  -6.867
  365   1HG   GLN  51          1HG       GLN  51  12.171 -17.535  -6.478
  366   2HG   GLN  51          2HG       GLN  51  13.635 -16.948  -5.721
  367   1HE2  GLN  51          1HE2      GLN  51  11.827 -14.863  -3.319
  368   2HE2  GLN  51          2HE2      GLN  51  13.412 -15.070  -4.219
  369    H    ASN  52           H        ASN  52  12.240 -17.375  -8.964
  370    HA   ASN  52           HA       ASN  52  12.317 -16.484 -11.831
  371   1HB   ASN  52          1HB       ASN  52  13.946 -18.528 -11.410
  372   2HB   ASN  52          2HB       ASN  52  12.497 -19.509 -11.366
  373   1HD2  ASN  52          1HD2      ASN  52  13.458 -19.673 -14.918
  374   2HD2  ASN  52          2HD2      ASN  52  13.593 -20.489 -13.280
  375    HA   PRO  53           HA       PRO  53   7.964 -17.438 -10.227
  376   1HB   PRO  53          1HB       PRO  53   6.630 -15.259 -11.266
  377   2HB   PRO  53          2HB       PRO  53   7.652 -15.200  -9.822
  378   1HG   PRO  53          1HG       PRO  53   8.376 -14.342 -12.661
  379   2HG   PRO  53          2HG       PRO  53   8.703 -13.483 -11.138
  380   1HD   PRO  53          1HD       PRO  53  10.648 -14.818 -10.709
  381   2HD   PRO  53          2HD       PRO  53  10.574 -15.138 -12.467
  382    H    THR  54           H        THR  54   5.762 -17.366 -11.571
  383    HA   THR  54           HA       THR  54   6.204 -18.448 -14.401
  384    HB   THR  54           HB       THR  54   5.640 -20.141 -12.360
  385    HG1  THR  54           HG1      THR  54   6.067 -20.509 -14.606
  386   1HG2  THR  54          1HG2      THR  54   3.276 -20.867 -12.422
  387   2HG2  THR  54          2HG2      THR  54   3.375 -19.193 -11.829
  388   3HG2  THR  54          3HG2      THR  54   2.844 -19.518 -13.499
  389    H    LYS  55           H        LYS  55   4.104 -18.511 -15.619
  390    HA   LYS  55           HA       LYS  55   3.034 -15.753 -15.743
  391   1HB   LYS  55          1HB       LYS  55   2.794 -18.255 -17.411
  392   2HB   LYS  55          2HB       LYS  55   1.400 -17.198 -17.484
  393   1HG   LYS  55          1HG       LYS  55   3.105 -16.847 -19.303
  394   2HG   LYS  55          2HG       LYS  55   2.637 -15.385 -18.453
  395   1HD   LYS  55          1HD       LYS  55   4.781 -15.191 -17.343
  396   2HD   LYS  55          2HD       LYS  55   5.152 -15.684 -18.988
  397   1HE   LYS  55          1HE       LYS  55   5.397 -17.292 -16.427
  398   2HE   LYS  55          2HE       LYS  55   5.072 -18.186 -17.910
  399   1HZ   LYS  55          1HZ       LYS  55   7.110 -16.474 -18.600
  400   2HZ   LYS  55          2HZ       LYS  55   7.285 -18.068 -18.200
  401   3HZ   LYS  55          3HZ       LYS  55   7.496 -16.900 -17.051
  402    H    GLU  56           H        GLU  56   1.899 -18.893 -14.614
  403    HA   GLU  56           HA       GLU  56  -0.939 -18.278 -14.275
  404   1HB   GLU  56          1HB       GLU  56   0.417 -20.334 -12.503
  405   2HB   GLU  56          2HB       GLU  56   0.410 -20.595 -14.236
  406   1HG   GLU  56          1HG       GLU  56  -1.567 -21.692 -13.770
  407   2HG   GLU  56          2HG       GLU  56  -2.263 -20.089 -13.925
  408    H    GLU  57           H        GLU  57   1.847 -18.180 -12.057
  409    HA   GLU  57           HA       GLU  57   0.372 -17.445  -9.614
  410   1HB   GLU  57          1HB       GLU  57   2.376 -17.319  -8.490
  411   2HB   GLU  57          2HB       GLU  57   3.255 -16.635  -9.841
  412   1HG   GLU  57          1HG       GLU  57   2.552 -19.301 -10.696
  413   2HG   GLU  57          2HG       GLU  57   4.151 -18.683 -10.300
  414    H    LEU  58           H        LEU  58   1.962 -15.630 -12.199
  415    HA   LEU  58           HA       LEU  58   1.904 -12.978 -10.917
  416   1HB   LEU  58          1HB       LEU  58   2.738 -14.131 -13.520
  417   2HB   LEU  58          2HB       LEU  58   2.012 -12.549 -13.711
  418    HG   LEU  58           HG       LEU  58   4.170 -12.944 -11.575
  419   1HD1  LEU  58          1HD1      LEU  58   3.653 -10.528 -13.431
  420   2HD1  LEU  58          2HD1      LEU  58   2.936 -10.687 -11.821
  421   3HD1  LEU  58          3HD1      LEU  58   4.704 -10.577 -11.994
  422   1HD2  LEU  58          1HD2      LEU  58   5.981 -12.612 -13.216
  423   2HD2  LEU  58          2HD2      LEU  58   5.022 -14.029 -13.713
  424   3HD2  LEU  58          3HD2      LEU  58   4.812 -12.482 -14.555
  425    H    ASP  59           H        ASP  59  -0.253 -14.825 -12.999
  426    HA   ASP  59           HA       ASP  59  -2.092 -12.731 -13.846
  427   1HB   ASP  59          1HB       ASP  59  -1.981 -15.002 -14.921
  428   2HB   ASP  59          2HB       ASP  59  -2.723 -15.716 -13.509
  429    H    ALA  60           H        ALA  60  -1.896 -14.723 -10.947
  430    HA   ALA  60           HA       ALA  60  -4.441 -13.828  -9.691
  431   1HB   ALA  60          1HB       ALA  60  -3.562 -14.931  -7.639
  432   2HB   ALA  60          2HB       ALA  60  -3.412 -15.986  -9.057
  433   3HB   ALA  60          3HB       ALA  60  -1.972 -15.162  -8.406
  434    H    ILE  61           H        ILE  61  -1.005 -12.943  -9.432
  435    HA   ILE  61           HA       ILE  61  -1.033 -10.984  -7.336
  436    HB   ILE  61           HB       ILE  61   0.783 -11.616  -9.565
  437   1HG1  ILE  61          1HG1      ILE  61   0.853 -11.493  -6.684
  438   2HG1  ILE  61          2HG1      ILE  61   2.074 -12.117  -7.772
  439   1HG2  ILE  61          1HG2      ILE  61   2.036  -9.441  -9.638
  440   2HG2  ILE  61          2HG2      ILE  61   0.403  -9.237 -10.269
  441   3HG2  ILE  61          3HG2      ILE  61   0.789  -8.668  -8.628
  442   1HD1  ILE  61          1HD1      ILE  61   1.976  -9.209  -6.774
  443   2HD1  ILE  61          2HD1      ILE  61   3.126 -10.481  -6.310
  444   3HD1  ILE  61          3HD1      ILE  61   3.144  -9.838  -7.969
  445    H    ILE  62           H        ILE  62  -2.012 -10.763 -10.724
  446    HA   ILE  62           HA       ILE  62  -2.559  -7.822 -10.681
  447    HB   ILE  62           HB       ILE  62  -3.247  -9.915 -12.809
  448   1HG1  ILE  62          1HG1      ILE  62  -0.735  -8.449 -12.184
  449   2HG1  ILE  62          2HG1      ILE  62  -0.993  -9.853 -13.199
  450   1HG2  ILE  62          1HG2      ILE  62  -3.665  -7.993 -14.369
  451   2HG2  ILE  62          2HG2      ILE  62  -4.791  -7.937 -13.015
  452   3HG2  ILE  62          3HG2      ILE  62  -3.397  -6.833 -13.044
  453   1HD1  ILE  62          1HD1      ILE  62  -1.365  -6.948 -14.142
  454   2HD1  ILE  62          2HD1      ILE  62  -0.069  -8.079 -14.584
  455   3HD1  ILE  62          3HD1      ILE  62  -1.735  -8.393 -15.123
  456    H    GLU  63           H        GLU  63  -4.392 -10.861 -10.533
  457    HA   GLU  63           HA       GLU  63  -7.098 -10.017 -10.540
  458   1HB   GLU  63          1HB       GLU  63  -6.080 -12.109  -8.553
  459   2HB   GLU  63          2HB       GLU  63  -6.169 -12.412 -10.277
  460   1HG   GLU  63          1HG       GLU  63  -8.208 -12.885  -8.404
  461   2HG   GLU  63          2HG       GLU  63  -8.734 -11.363  -9.103
  462    H    GLU  64           H        GLU  64  -4.677  -9.678  -8.004
  463    HA   GLU  64           HA       GLU  64  -6.491  -8.669  -5.887
  464   1HB   GLU  64          1HB       GLU  64  -3.850  -9.614  -5.956
  465   2HB   GLU  64          2HB       GLU  64  -3.632  -7.914  -5.593
  466   1HG   GLU  64          1HG       GLU  64  -4.856 -10.103  -3.911
  467   2HG   GLU  64          2HG       GLU  64  -5.664  -8.550  -3.790
  468    H    VAL  65           H        VAL  65  -4.160  -7.186  -8.145
  469    HA   VAL  65           HA       VAL  65  -5.264  -4.400  -7.505
  470    HB   VAL  65           HB       VAL  65  -3.026  -3.625  -8.621
  471   1HG1  VAL  65          1HG1      VAL  65  -2.040  -6.398  -7.690
  472   2HG1  VAL  65          2HG1      VAL  65  -2.329  -5.975  -9.388
  473   3HG1  VAL  65          3HG1      VAL  65  -1.084  -5.107  -8.459
  474   1HG2  VAL  65          1HG2      VAL  65  -1.908  -3.474  -6.451
  475   2HG2  VAL  65          2HG2      VAL  65  -3.656  -3.384  -6.123
  476   3HG2  VAL  65          3HG2      VAL  65  -2.780  -4.890  -5.814
  477    H    ASP  66           H        ASP  66  -6.803  -5.911  -9.103
  478    HA   ASP  66           HA       ASP  66  -6.951  -4.350 -11.622
  479   1HB   ASP  66          1HB       ASP  66  -6.340  -7.320 -12.074
  480   2HB   ASP  66          2HB       ASP  66  -5.098  -6.090 -12.114
  481    H    GLU  67           H        GLU  67  -8.780  -4.233  -9.958
  482    HA   GLU  67           HA       GLU  67 -10.875  -6.398 -10.099
  483   1HB   GLU  67          1HB       GLU  67 -12.166  -4.483  -8.726
  484   2HB   GLU  67          2HB       GLU  67 -10.553  -3.827  -8.516
  485   1HG   GLU  67          1HG       GLU  67  -9.815  -5.691  -7.203
  486   2HG   GLU  67          2HG       GLU  67 -11.024  -6.779  -7.861
  487    H    ASP  68           H        ASP  68 -10.164  -5.284 -12.601
  488    HA   ASP  68           HA       ASP  68 -12.680  -3.745 -13.416
  489   1HB   ASP  68          1HB       ASP  68 -11.377  -2.004 -13.995
  490   2HB   ASP  68          2HB       ASP  68 -10.926  -2.966 -15.384
  491    H    GLY  69           H        GLY  69  -9.985  -5.112 -15.304
  492   1HA   GLY  69          1HA       GLY  69 -11.858  -6.459 -17.229
  493   2HA   GLY  69          2HA       GLY  69 -11.010  -7.617 -16.201
  494    H    SER  70           H        SER  70  -9.735  -4.525 -17.348
  495    HA   SER  70           HA       SER  70  -8.432  -5.104 -19.771
  496   1HB   SER  70          1HB       SER  70  -8.514  -2.866 -18.533
  497   2HB   SER  70          2HB       SER  70  -7.034  -3.212 -19.432
  498    HG   SER  70           HG       SER  70  -7.106  -2.480 -17.045
  499    H    GLY  71           H        GLY  71  -6.950  -5.486 -16.525
  500   1HA   GLY  71          1HA       GLY  71  -5.357  -7.911 -17.478
  501   2HA   GLY  71          2HA       GLY  71  -5.635  -7.471 -15.788
  502    H    THR  72           H        THR  72  -4.676  -5.137 -18.225
  503    HA   THR  72           HA       THR  72  -1.767  -5.130 -17.440
  504    HB   THR  72           HB       THR  72  -1.877  -2.959 -19.037
  505    HG1  THR  72           HG1      THR  72  -3.592  -4.334 -20.564
  506   1HG2  THR  72          1HG2      THR  72  -1.300  -4.335 -20.996
  507   2HG2  THR  72          2HG2      THR  72  -0.485  -5.003 -19.565
  508   3HG2  THR  72          3HG2      THR  72  -1.928  -5.811 -20.230
  509    H    ILE  73           H        ILE  73  -0.766  -3.572 -16.265
  510    HA   ILE  73           HA       ILE  73  -2.514  -1.800 -14.509
  511    HB   ILE  73           HB       ILE  73   0.430  -2.563 -14.148
  512   1HG1  ILE  73          1HG1      ILE  73  -1.689  -4.303 -13.777
  513   2HG1  ILE  73          2HG1      ILE  73  -0.170  -4.389 -12.910
  514   1HG2  ILE  73          1HG2      ILE  73   0.287  -1.526 -11.887
  515   2HG2  ILE  73          2HG2      ILE  73  -0.123  -0.321 -13.115
  516   3HG2  ILE  73          3HG2      ILE  73  -1.413  -1.075 -12.148
  517   1HD1  ILE  73          1HD1      ILE  73  -2.712  -3.057 -11.806
  518   2HD1  ILE  73          2HD1      ILE  73  -1.986  -4.597 -11.300
  519   3HD1  ILE  73          3HD1      ILE  73  -1.128  -3.071 -10.984
  520    H    ASP  74           H        ASP  74  -2.964  -0.359 -16.226
  521    HA   ASP  74           HA       ASP  74  -0.870   1.173 -17.656
  522   1HB   ASP  74          1HB       ASP  74  -3.037   2.778 -18.032
  523   2HB   ASP  74          2HB       ASP  74  -2.672   1.365 -18.996
  524    H    PHE  75           H        PHE  75  -1.193   3.713 -17.536
  525    HA   PHE  75           HA       PHE  75  -0.115   4.614 -14.929
  526   1HB   PHE  75          1HB       PHE  75   0.197   5.589 -17.434
  527   2HB   PHE  75          2HB       PHE  75  -1.158   6.595 -16.995
  528    HD1  PHE  75           HD1      PHE  75   0.227   6.169 -13.860
  529    HD2  PHE  75           HD2      PHE  75   1.244   8.030 -17.606
  530    HE1  PHE  75           HE1      PHE  75   1.777   7.686 -12.698
  531    HE2  PHE  75           HE2      PHE  75   2.794   9.535 -16.423
  532    HZ   PHE  75           HZ       PHE  75   3.053   9.376 -13.973
  533    H    GLU  76           H        GLU  76  -3.272   4.480 -16.438
  534    HA   GLU  76           HA       GLU  76  -4.588   6.276 -14.384
  535   1HB   GLU  76          1HB       GLU  76  -6.538   5.039 -16.123
  536   2HB   GLU  76          2HB       GLU  76  -6.130   6.725 -15.891
  537   1HG   GLU  76          1HG       GLU  76  -4.231   6.431 -17.620
  538   2HG   GLU  76          2HG       GLU  76  -4.821   4.807 -17.903
  539    H    GLU  77           H        GLU  77  -3.398   4.059 -13.291
  540    HA   GLU  77           HA       GLU  77  -5.651   2.812 -11.797
  541   1HB   GLU  77          1HB       GLU  77  -5.834   1.247 -13.568
  542   2HB   GLU  77          2HB       GLU  77  -4.104   1.094 -13.767
  543   1HG   GLU  77          1HG       GLU  77  -5.451   0.159 -11.170
  544   2HG   GLU  77          2HG       GLU  77  -3.864  -0.293 -11.781
  545    H    PHE  78           H        PHE  78  -2.205   2.734 -12.637
  546    HA   PHE  78           HA       PHE  78  -1.076   1.573 -10.270
  547   1HB   PHE  78          1HB       PHE  78   0.222   2.132 -12.361
  548   2HB   PHE  78          2HB       PHE  78   0.149   3.834 -11.981
  549    HD1  PHE  78           HD1      PHE  78   1.168   0.588 -10.237
  550    HD2  PHE  78           HD2      PHE  78   2.113   4.720 -10.976
  551    HE1  PHE  78           HE1      PHE  78   3.293   0.331  -9.021
  552    HE2  PHE  78           HE2      PHE  78   4.229   4.446  -9.751
  553    HZ   PHE  78           HZ       PHE  78   4.830   2.253  -8.785
  554    H    LEU  79           H        LEU  79  -1.965   4.947 -10.950
  555    HA   LEU  79           HA       LEU  79  -0.992   6.156  -8.466
  556   1HB   LEU  79          1HB       LEU  79  -3.353   7.217 -10.116
  557   2HB   LEU  79          2HB       LEU  79  -2.322   8.127  -9.032
  558    HG   LEU  79           HG       LEU  79  -1.525   6.949 -11.760
  559   1HD1  LEU  79          1HD1      LEU  79   0.331   8.478  -9.830
  560   2HD1  LEU  79          2HD1      LEU  79   0.375   6.722 -10.076
  561   3HD1  LEU  79          3HD1      LEU  79   0.759   7.816 -11.429
  562   1HD2  LEU  79          1HD2      LEU  79  -1.237   9.279 -12.488
  563   2HD2  LEU  79          2HD2      LEU  79  -2.849   9.160 -11.740
  564   3HD2  LEU  79          3HD2      LEU  79  -1.515   9.895 -10.839
  565    H    VAL  80           H        VAL  80  -4.062   4.679  -9.417
  566    HA   VAL  80           HA       VAL  80  -5.666   5.395  -7.051
  567    HB   VAL  80           HB       VAL  80  -6.140   2.892  -8.732
  568   1HG1  VAL  80          1HG1      VAL  80  -7.192   5.693  -9.471
  569   2HG1  VAL  80          2HG1      VAL  80  -5.785   4.956 -10.248
  570   3HG1  VAL  80          3HG1      VAL  80  -7.377   4.176 -10.389
  571   1HG2  VAL  80          1HG2      VAL  80  -8.514   3.204  -8.206
  572   2HG2  VAL  80          2HG2      VAL  80  -7.629   3.261  -6.664
  573   3HG2  VAL  80          3HG2      VAL  80  -8.203   4.763  -7.404
  574    H    MET  81           H        MET  81  -3.364   2.852  -7.850
  575    HA   MET  81           HA       MET  81  -3.762   1.023  -5.615
  576   1HB   MET  81          1HB       MET  81  -0.936   1.417  -6.626
  577   2HB   MET  81          2HB       MET  81  -2.142   0.938  -7.806
  578   1HG   MET  81          1HG       MET  81  -1.984  -0.661  -5.207
  579   2HG   MET  81          2HG       MET  81  -2.515  -1.183  -6.815
  580   1HE   MET  81          1HE       MET  81  -0.749  -0.966  -8.996
  581   2HE   MET  81          2HE       MET  81   0.643  -2.066  -8.765
  582   3HE   MET  81          3HE       MET  81  -1.006  -2.621  -8.360
  583    H    MET  82           H        MET  82  -1.112   3.396  -5.986
  584    HA   MET  82           HA       MET  82  -0.066   3.300  -3.327
  585   1HB   MET  82          1HB       MET  82   1.281   5.102  -3.857
  586   2HB   MET  82          2HB       MET  82   0.854   4.531  -5.460
  587   1HG   MET  82          1HG       MET  82  -0.834   6.747  -4.181
  588   2HG   MET  82          2HG       MET  82  -0.600   6.376  -5.893
  589   1HE   MET  82          1HE       MET  82   1.445   7.164  -2.605
  590   2HE   MET  82          2HE       MET  82   0.629   8.716  -2.954
  591   3HE   MET  82          3HE       MET  82   2.407   8.595  -3.093
  592    H    VAL  83           H        VAL  83  -2.832   5.065  -4.593
  593    HA   VAL  83           HA       VAL  83  -3.211   6.960  -2.376
  594    HB   VAL  83           HB       VAL  83  -4.463   6.502  -4.914
  595   1HG1  VAL  83          1HG1      VAL  83  -6.884   6.864  -4.414
  596   2HG1  VAL  83          2HG1      VAL  83  -6.343   5.308  -3.769
  597   3HG1  VAL  83          3HG1      VAL  83  -6.576   6.686  -2.667
  598   1HG2  VAL  83          1HG2      VAL  83  -4.950   8.787  -2.888
  599   2HG2  VAL  83          2HG2      VAL  83  -3.673   8.750  -4.126
  600   3HG2  VAL  83          3HG2      VAL  83  -5.370   8.813  -4.620
  601    NH1  ARG  84           NH1      ARG  84  -9.332  -1.166  -3.903
  602    NH2  ARG  84           NH2      ARG  84  -7.920  -2.890  -4.347
  603    H    ARG  84           H        ARG  84  -4.591   3.781  -3.192
  604    HA   ARG  84           HA       ARG  84  -6.677   3.485  -1.219
  605   1HB   ARG  84          1HB       ARG  84  -4.972   1.563  -2.796
  606   2HB   ARG  84          2HB       ARG  84  -5.656   0.917  -1.312
  607   1HG   ARG  84          1HG       ARG  84  -7.630   2.446  -2.983
  608   2HG   ARG  84          2HG       ARG  84  -7.840   0.943  -2.081
  609   1HD   ARG  84          1HD       ARG  84  -7.847   0.913  -4.755
  610   2HD   ARG  84          2HD       ARG  84  -6.089   0.941  -4.607
  611    HE   ARG  84           HE       ARG  84  -6.205  -1.289  -3.449
  612   1HH1  ARG  84          1HH1      ARG  84  -6.952  -3.211  -4.455
  613   2HH1  ARG  84          2HH1      ARG  84  -8.771  -3.455  -4.447
  614   1HH2  ARG  84          1HH2      ARG  84  -9.444  -0.163  -3.722
  615   2HH2  ARG  84          2HH2      ARG  84 -10.081  -1.863  -3.986
  616    H    GLN  85           H        GLN  85  -3.205   2.663  -0.979
  617    HA   GLN  85           HA       GLN  85  -3.322   1.735   1.851
  618   1HB   GLN  85          1HB       GLN  85  -0.919   2.427   0.065
  619   2HB   GLN  85          2HB       GLN  85  -0.787   1.799   1.697
  620   1HG   GLN  85          1HG       GLN  85  -2.565  -0.002   0.298
  621   2HG   GLN  85          2HG       GLN  85  -1.258   0.347  -0.812
  622   1HE2  GLN  85          1HE2      GLN  85   1.179  -0.964   1.840
  623   2HE2  GLN  85          2HE2      GLN  85   0.938   0.601   0.914
  624    H    MET  86           H        MET  86  -2.573   4.721   0.134
  625    HA   MET  86           HA       MET  86  -1.244   6.294   2.141
  626   1HB   MET  86          1HB       MET  86  -2.543   6.860  -0.412
  627   2HB   MET  86          2HB       MET  86  -3.038   8.078   0.749
  628   1HG   MET  86          1HG       MET  86  -0.225   7.894   1.176
  629   2HG   MET  86          2HG       MET  86  -0.412   7.727  -0.578
  630   1HE   MET  86          1HE       MET  86  -3.132   9.324  -1.236
  631   2HE   MET  86          2HE       MET  86  -2.501  10.967  -1.553
  632   3HE   MET  86          3HE       MET  86  -1.634   9.541  -2.194
  633    H    LYS  87           H        LYS  87  -4.667   5.586   1.651
  634    HA   LYS  87           HA       LYS  87  -6.003   7.453   3.363
  635   1HB   LYS  87          1HB       LYS  87  -6.662   4.555   2.660
  636   2HB   LYS  87          2HB       LYS  87  -7.574   5.356   3.931
  637   1HG   LYS  87          1HG       LYS  87  -8.003   5.535   1.109
  638   2HG   LYS  87          2HG       LYS  87  -7.421   7.126   1.571
  639   1HD   LYS  87          1HD       LYS  87  -9.240   7.042   3.478
  640   2HD   LYS  87          2HD       LYS  87  -9.732   7.342   1.815
  641   1HE   LYS  87          1HE       LYS  87 -10.592   5.065   1.522
  642   2HE   LYS  87          2HE       LYS  87  -9.810   4.492   3.002
  643   1HZ   LYS  87          1HZ       LYS  87 -12.261   6.038   2.706
  644   2HZ   LYS  87          2HZ       LYS  87 -11.321   6.446   4.002
  645   3HZ   LYS  87          3HZ       LYS  87 -11.860   4.894   3.828
  646    H    GLU  88           H        GLU  88  -4.953   7.996   5.190
  647    HA   GLU  88           HA       GLU  88  -3.906   6.017   7.173
  648   1HB   GLU  88          1HB       GLU  88  -3.594   8.179   8.605
  649   2HB   GLU  88          2HB       GLU  88  -4.071   9.068   7.172
  650   1HG   GLU  88          1HG       GLU  88  -1.911   9.005   6.459
  651   2HG   GLU  88          2HG       GLU  88  -2.041   7.268   6.243
  652    H    ASP  89           H        ASP  89  -6.742   8.057   6.713
  653    HA   ASP  89           HA       ASP  89  -8.014   7.657   9.358
  654   1HB   ASP  89          1HB       ASP  89  -9.164   8.600   6.679
  655   2HB   ASP  89          2HB       ASP  89 -10.179   8.333   8.077
  656    H    ALA  90           H        ALA  90  -9.432   6.149  10.010
  657    HA   ALA  90           HA       ALA  90 -10.398   3.960   8.125
  658   1HB   ALA  90          1HB       ALA  90  -9.775   2.137   9.733
  659   2HB   ALA  90          2HB       ALA  90  -8.328   2.983   9.151
  660   3HB   ALA  90          3HB       ALA  90  -8.947   3.310  10.788
   
  Start of MODEL          32
 Raw file had  660 H/Q atoms
  Start of MODEL   32
    1   1H    ALA   1          1H        ALA   1 -20.336   9.070 -17.661
    2   2H    ALA   1          2H        ALA   1 -19.738  10.132 -18.820
    3   3H    ALA   1          3H        ALA   1 -18.685   9.372 -17.752
    4    HA   ALA   1           HA       ALA   1 -19.709  11.848 -17.490
    5   1HB   ALA   1          1HB       ALA   1 -21.174  11.345 -15.269
    6   2HB   ALA   1          2HB       ALA   1 -21.524   9.824 -16.114
    7   3HB   ALA   1          3HB       ALA   1 -21.937  11.381 -16.877
    8    H    SER   2           H        SER   2 -18.951   8.872 -15.691
    9    HA   SER   2           HA       SER   2 -16.359   9.780 -14.678
   10   1HB   SER   2          1HB       SER   2 -16.993   9.946 -12.187
   11   2HB   SER   2          2HB       SER   2 -17.382  11.327 -13.215
   12    HG   SER   2           HG       SER   2 -19.470  10.800 -13.189
   13    H    MET   3           H        MET   3 -19.197   7.908 -13.546
   14    HA   MET   3           HA       MET   3 -19.547   5.564 -13.164
   15   1HB   MET   3          1HB       MET   3 -18.684   5.260 -15.430
   16   2HB   MET   3          2HB       MET   3 -17.017   5.365 -14.892
   17   1HG   MET   3          1HG       MET   3 -17.297   3.038 -15.139
   18   2HG   MET   3          2HG       MET   3 -17.594   3.229 -13.406
   19   1HE   MET   3          1HE       MET   3 -20.435   1.768 -16.660
   20   2HE   MET   3          2HE       MET   3 -19.066   0.859 -15.955
   21   3HE   MET   3          3HE       MET   3 -18.762   2.388 -16.831
   22    H    THR   4           H        THR   4 -16.061   5.154 -13.230
   23    HA   THR   4           HA       THR   4 -16.069   4.304 -10.335
   24    HB   THR   4           HB       THR   4 -13.649   3.572 -10.868
   25    HG1  THR   4           HG1      THR   4 -13.319   4.568 -12.734
   26   1HG2  THR   4          1HG2      THR   4 -14.914   1.637 -10.646
   27   2HG2  THR   4          2HG2      THR   4 -14.617   1.542 -12.397
   28   3HG2  THR   4          3HG2      THR   4 -16.174   2.160 -11.785
   29    H    ASP   5           H        ASP   5 -16.060   6.096  -9.113
   30    HA   ASP   5           HA       ASP   5 -14.126   8.372  -9.536
   31   1HB   ASP   5          1HB       ASP   5 -15.387   9.633  -8.104
   32   2HB   ASP   5          2HB       ASP   5 -15.637   8.331  -6.962
   33    H    GLN   6           H        GLN   6 -12.856   5.916  -9.210
   34    HA   GLN   6           HA       GLN   6 -11.678   5.777  -6.424
   35   1HB   GLN   6          1HB       GLN   6 -10.563   3.816  -7.081
   36   2HB   GLN   6          2HB       GLN   6 -12.111   3.726  -7.900
   37   1HG   GLN   6          1HG       GLN   6  -9.447   4.545  -9.210
   38   2HG   GLN   6          2HG       GLN   6 -10.986   4.580 -10.041
   39   1HE2  GLN   6          1HE2      GLN   6  -9.114   0.941  -9.391
   40   2HE2  GLN   6          2HE2      GLN   6  -8.643   2.432  -8.432
   41    H    GLN   7           H        GLN   7 -10.552   6.408  -9.762
   42    HA   GLN   7           HA       GLN   7  -7.853   7.416  -9.068
   43   1HB   GLN   7          1HB       GLN   7  -7.604   7.172 -11.307
   44   2HB   GLN   7          2HB       GLN   7  -9.332   6.911 -11.494
   45   1HG   GLN   7          1HG       GLN   7  -9.233   9.704 -11.261
   46   2HG   GLN   7          2HG       GLN   7  -7.735   9.364 -12.114
   47   1HE2  GLN   7          1HE2      GLN   7 -11.370   8.411 -13.950
   48   2HE2  GLN   7          2HE2      GLN   7 -11.232   8.487 -12.122
   49    H    ALA   8           H        ALA   8 -11.064   8.831  -9.393
   50    HA   ALA   8           HA       ALA   8 -10.384  11.669  -9.430
   51   1HB   ALA   8          1HB       ALA   8 -12.748  12.052  -8.748
   52   2HB   ALA   8          2HB       ALA   8 -12.636  10.845 -10.043
   53   3HB   ALA   8          3HB       ALA   8 -12.952  10.325  -8.368
   54    H    GLU   9           H        GLU   9 -10.755   9.311  -6.836
   55    HA   GLU   9           HA       GLU   9 -10.848  11.206  -4.561
   56   1HB   GLU   9          1HB       GLU   9 -10.419   8.175  -4.717
   57   2HB   GLU   9          2HB       GLU   9 -10.149   9.039  -3.210
   58   1HG   GLU   9          1HG       GLU   9 -12.596   7.989  -3.982
   59   2HG   GLU   9          2HG       GLU   9 -12.809   9.655  -4.506
   60    H    ALA  10           H        ALA  10  -8.307   8.886  -5.565
   61    HA   ALA  10           HA       ALA  10  -6.214   9.882  -3.779
   62   1HB   ALA  10          1HB       ALA  10  -4.663   8.486  -5.136
   63   2HB   ALA  10          2HB       ALA  10  -6.149   7.601  -4.743
   64   3HB   ALA  10          3HB       ALA  10  -5.911   8.255  -6.384
   65    NH1  ARG  11           NH1      ARG  11  -2.730  13.075 -12.697
   66    NH2  ARG  11           NH2      ARG  11  -3.155  11.158 -13.840
   67    H    ARG  11           H        ARG  11  -7.296  10.819  -6.977
   68    HA   ARG  11           HA       ARG  11  -4.891  12.338  -7.855
   69   1HB   ARG  11          1HB       ARG  11  -7.731  12.008  -8.899
   70   2HB   ARG  11          2HB       ARG  11  -6.812  13.409  -9.427
   71   1HG   ARG  11          1HG       ARG  11  -5.604  10.602  -9.646
   72   2HG   ARG  11          2HG       ARG  11  -6.692  11.229 -10.886
   73   1HD   ARG  11          1HD       ARG  11  -5.194  13.171 -11.316
   74   2HD   ARG  11          2HD       ARG  11  -4.123  12.705  -9.993
   75    HE   ARG  11           HE       ARG  11  -4.027  10.410 -11.590
   76   1HH1  ARG  11          1HH1      ARG  11  -2.862  13.619 -11.837
   77   2HH1  ARG  11          2HH1      ARG  11  -2.197  13.356 -13.527
   78   1HH2  ARG  11          1HH2      ARG  11  -3.569  10.219 -13.833
   79   2HH2  ARG  11          2HH2      ARG  11  -2.630  11.593 -14.606
   80    H    ALA  12           H        ALA  12  -8.034  13.157  -6.406
   81    HA   ALA  12           HA       ALA  12  -7.774  16.092  -6.483
   82   1HB   ALA  12          1HB       ALA  12  -9.685  16.125  -4.894
   83   2HB   ALA  12          2HB       ALA  12  -9.982  15.002  -6.236
   84   3HB   ALA  12          3HB       ALA  12  -9.537  14.370  -4.631
   85    H    PHE  13           H        PHE  13  -6.775  13.578  -4.224
   86    HA   PHE  13           HA       PHE  13  -6.071  15.319  -1.942
   87   1HB   PHE  13          1HB       PHE  13  -5.035  12.487  -2.524
   88   2HB   PHE  13          2HB       PHE  13  -6.616  12.810  -1.860
   89    HD1  PHE  13           HD1      PHE  13  -4.832  15.403  -0.396
   90    HD2  PHE  13           HD2      PHE  13  -4.935  11.101  -0.281
   91    HE1  PHE  13           HE1      PHE  13  -3.829  15.427   1.852
   92    HE2  PHE  13           HE2      PHE  13  -3.938  11.147   1.967
   93    HZ   PHE  13           HZ       PHE  13  -3.371  13.304   3.032
   94    H    LEU  14           H        LEU  14  -4.218  13.683  -4.521
   95    HA   LEU  14           HA       LEU  14  -1.587  14.937  -3.732
   96   1HB   LEU  14          1HB       LEU  14  -0.578  13.633  -5.516
   97   2HB   LEU  14          2HB       LEU  14  -2.122  13.300  -6.269
   98    HG   LEU  14           HG       LEU  14  -2.534  12.143  -3.765
   99   1HD1  LEU  14          1HD1      LEU  14  -2.208   9.959  -4.928
  100   2HD1  LEU  14          2HD1      LEU  14  -3.067  11.104  -5.974
  101   3HD1  LEU  14          3HD1      LEU  14  -1.341  10.766  -6.260
  102   1HD2  LEU  14          1HD2      LEU  14   0.444  11.658  -4.450
  103   2HD2  LEU  14          2HD2      LEU  14  -0.177  12.491  -3.004
  104   3HD2  LEU  14          3HD2      LEU  14  -0.500  10.765  -3.230
  105    H    SER  15           H        SER  15  -0.318  15.931  -5.586
  106    HA   SER  15           HA       SER  15  -2.046  17.950  -7.119
  107   1HB   SER  15          1HB       SER  15   0.882  18.501  -6.569
  108   2HB   SER  15          2HB       SER  15  -0.259  18.626  -5.227
  109    HG   SER  15           HG       SER  15  -0.266  20.557  -6.170
  110    H    GLU  16           H        GLU  16  -0.476  18.883  -8.975
  111    HA   GLU  16           HA       GLU  16  -0.164  16.693 -10.970
  112   1HB   GLU  16          1HB       GLU  16  -1.013  19.108 -11.396
  113   2HB   GLU  16          2HB       GLU  16   0.668  19.607 -11.385
  114   1HG   GLU  16          1HG       GLU  16  -0.572  19.012 -13.675
  115   2HG   GLU  16          2HG       GLU  16   1.128  18.631 -13.462
  116    H    GLU  17           H        GLU  17   1.909  18.728  -8.987
  117    HA   GLU  17           HA       GLU  17   4.485  17.852 -10.281
  118   1HB   GLU  17          1HB       GLU  17   3.867  19.733  -7.961
  119   2HB   GLU  17          2HB       GLU  17   5.505  19.185  -8.258
  120   1HG   GLU  17          1HG       GLU  17   3.734  20.943 -10.044
  121   2HG   GLU  17          2HG       GLU  17   5.090  20.081 -10.750
  122    H    MET  18           H        MET  18   2.560  17.221  -7.391
  123    HA   MET  18           HA       MET  18   4.385  15.476  -5.885
  124   1HB   MET  18          1HB       MET  18   1.437  14.830  -5.802
  125   2HB   MET  18          2HB       MET  18   1.883  16.466  -5.350
  126   1HG   MET  18          1HG       MET  18   2.529  13.863  -3.923
  127   2HG   MET  18          2HG       MET  18   3.705  15.180  -3.783
  128   1HE   MET  18          1HE       MET  18   3.418  15.566  -1.207
  129   2HE   MET  18          2HE       MET  18   1.832  15.666  -0.386
  130   3HE   MET  18          3HE       MET  18   2.335  14.139  -1.170
  131    H    ILE  19           H        ILE  19   2.148  14.992  -8.579
  132    HA   ILE  19           HA       ILE  19   2.118  12.052  -8.619
  133    HB   ILE  19           HB       ILE  19   1.262  14.197 -10.558
  134   1HG1  ILE  19          1HG1      ILE  19  -0.918  13.336 -10.244
  135   2HG1  ILE  19          2HG1      ILE  19  -0.366  11.707  -9.916
  136   1HG2  ILE  19          1HG2      ILE  19   0.727  12.547 -12.369
  137   2HG2  ILE  19          2HG2      ILE  19   2.468  12.608 -12.096
  138   3HG2  ILE  19          3HG2      ILE  19   1.525  11.246 -11.451
  139   1HD1  ILE  19          1HD1      ILE  19  -0.204  14.025  -7.900
  140   2HD1  ILE  19          2HD1      ILE  19  -1.290  12.620  -7.859
  141   3HD1  ILE  19          3HD1      ILE  19   0.459  12.390  -7.627
  142    H    ALA  20           H        ALA  20   4.200  14.555  -9.990
  143    HA   ALA  20           HA       ALA  20   5.756  13.081 -11.902
  144   1HB   ALA  20          1HB       ALA  20   7.508  14.827 -11.598
  145   2HB   ALA  20          2HB       ALA  20   5.886  15.542 -11.686
  146   3HB   ALA  20          3HB       ALA  20   6.715  15.406 -10.115
  147    H    GLU  21           H        GLU  21   6.169  13.396  -8.385
  148    HA   GLU  21           HA       GLU  21   8.814  12.241  -8.074
  149   1HB   GLU  21          1HB       GLU  21   8.190  11.818  -5.692
  150   2HB   GLU  21          2HB       GLU  21   6.512  12.177  -6.048
  151   1HG   GLU  21          1HG       GLU  21   8.890  14.135  -6.147
  152   2HG   GLU  21          2HG       GLU  21   7.319  14.549  -6.810
  153    H    PHE  22           H        PHE  22   5.600  10.821  -8.340
  154    HA   PHE  22           HA       PHE  22   6.462   8.015  -7.708
  155   1HB   PHE  22          1HB       PHE  22   3.746   8.964  -8.808
  156   2HB   PHE  22          2HB       PHE  22   4.113   7.383  -8.172
  157    HD1  PHE  22           HD1      PHE  22   4.107  11.011  -7.068
  158    HD2  PHE  22           HD2      PHE  22   3.778   6.890  -5.870
  159    HE1  PHE  22           HE1      PHE  22   3.636  11.709  -4.758
  160    HE2  PHE  22           HE2      PHE  22   3.299   7.610  -3.565
  161    HZ   PHE  22           HZ       PHE  22   3.230  10.016  -3.004
  162    H    LYS  23           H        LYS  23   5.930  10.045 -10.515
  163    HA   LYS  23           HA       LYS  23   5.591   8.228 -12.703
  164   1HB   LYS  23          1HB       LYS  23   6.602  10.992 -12.418
  165   2HB   LYS  23          2HB       LYS  23   7.507  10.137 -13.648
  166   1HG   LYS  23          1HG       LYS  23   4.943   9.460 -14.437
  167   2HG   LYS  23          2HG       LYS  23   4.617  10.979 -13.620
  168   1HD   LYS  23          1HD       LYS  23   6.916  10.946 -15.616
  169   2HD   LYS  23          2HD       LYS  23   5.857  12.285 -15.157
  170   1HE   LYS  23          1HE       LYS  23   4.862  11.848 -17.212
  171   2HE   LYS  23          2HE       LYS  23   3.956  10.637 -16.293
  172   1HZ   LYS  23          1HZ       LYS  23   5.356  10.042 -18.453
  173   2HZ   LYS  23          2HZ       LYS  23   5.140   8.949 -17.233
  174   3HZ   LYS  23          3HZ       LYS  23   6.556   9.792 -17.346
  175    H    ALA  24           H        ALA  24   8.596   9.223 -11.066
  176    HA   ALA  24           HA       ALA  24  10.584   7.972 -12.732
  177   1HB   ALA  24          1HB       ALA  24  12.074   8.024 -10.741
  178   2HB   ALA  24          2HB       ALA  24  11.173   9.542 -10.911
  179   3HB   ALA  24          3HB       ALA  24  10.688   8.354  -9.674
  180    H    ALA  25           H        ALA  25   9.208   6.669  -9.689
  181    HA   ALA  25           HA       ALA  25  10.398   3.986  -9.906
  182   1HB   ALA  25          1HB       ALA  25   8.934   3.410  -7.980
  183   2HB   ALA  25          2HB       ALA  25   9.746   4.965  -7.722
  184   3HB   ALA  25          3HB       ALA  25   8.022   4.926  -8.173
  185    H    PHE  26           H        PHE  26   7.604   5.447 -11.333
  186    HA   PHE  26           HA       PHE  26   5.764   3.167 -11.526
  187   1HB   PHE  26          1HB       PHE  26   4.762   5.280 -11.920
  188   2HB   PHE  26          2HB       PHE  26   5.968   5.792 -13.070
  189    HD1  PHE  26           HD1      PHE  26   5.561   5.450 -15.446
  190    HD2  PHE  26           HD2      PHE  26   3.161   3.302 -12.594
  191    HE1  PHE  26           HE1      PHE  26   4.049   4.723 -17.249
  192    HE2  PHE  26           HE2      PHE  26   1.658   2.588 -14.410
  193    HZ   PHE  26           HZ       PHE  26   2.099   3.293 -16.736
  194    H    ASP  27           H        ASP  27   8.163   4.531 -13.799
  195    HA   ASP  27           HA       ASP  27   7.845   2.462 -15.879
  196   1HB   ASP  27          1HB       ASP  27   8.747   4.760 -16.367
  197   2HB   ASP  27          2HB       ASP  27   9.668   3.444 -17.057
  198    H    MET  28           H        MET  28   9.899   2.873 -13.055
  199    HA   MET  28           HA       MET  28  11.897   0.809 -13.496
  200   1HB   MET  28          1HB       MET  28  10.836   1.287 -10.677
  201   2HB   MET  28          2HB       MET  28  11.674   2.579 -11.518
  202   1HG   MET  28          1HG       MET  28  12.864  -0.204 -10.917
  203   2HG   MET  28          2HG       MET  28  13.696   1.067 -11.828
  204   1HE   MET  28          1HE       MET  28  12.983  -0.442  -8.399
  205   2HE   MET  28          2HE       MET  28  12.900   0.941  -7.267
  206   3HE   MET  28          3HE       MET  28  11.561   0.649  -8.416
  207    H    PHE  29           H        PHE  29   8.610   0.685 -12.190
  208    HA   PHE  29           HA       PHE  29   8.612  -2.200 -11.448
  209   1HB   PHE  29          1HB       PHE  29   5.960  -1.741 -11.614
  210   2HB   PHE  29          2HB       PHE  29   6.444  -0.067 -11.667
  211    HD1  PHE  29           HD1      PHE  29   9.014  -1.479  -9.748
  212    HD2  PHE  29           HD2      PHE  29   4.814  -0.581  -9.451
  213    HE1  PHE  29           HE1      PHE  29   9.181  -1.450  -7.293
  214    HE2  PHE  29           HE2      PHE  29   5.004  -0.562  -6.997
  215    HZ   PHE  29           HZ       PHE  29   7.178  -1.009  -5.915
  216    H    ASP  30           H        ASP  30   7.679  -0.223 -14.231
  217    HA   ASP  30           HA       ASP  30   6.492  -2.388 -15.867
  218   1HB   ASP  30          1HB       ASP  30   7.651   0.079 -17.202
  219   2HB   ASP  30          2HB       ASP  30   6.319   0.298 -16.091
  220    H    ALA  31           H        ALA  31   7.887  -1.901 -18.316
  221    HA   ALA  31           HA       ALA  31  10.757  -2.833 -17.908
  222   1HB   ALA  31          1HB       ALA  31  10.421  -4.887 -19.290
  223   2HB   ALA  31          2HB       ALA  31   9.455  -4.929 -17.802
  224   3HB   ALA  31          3HB       ALA  31   8.669  -4.585 -19.365
  225    H    ASP  32           H        ASP  32   8.104  -2.155 -20.186
  226    HA   ASP  32           HA       ASP  32  10.038  -1.361 -22.386
  227   1HB   ASP  32          1HB       ASP  32   8.546  -2.497 -23.632
  228   2HB   ASP  32          2HB       ASP  32   7.575  -1.044 -23.563
  229    H    GLY  33           H        GLY  33   9.814   0.246 -20.023
  230   1HA   GLY  33          1HA       GLY  33   9.615   2.585 -19.361
  231   2HA   GLY  33          2HA       GLY  33  10.094   2.841 -21.024
  232    H    GLY  34           H        GLY  34   7.363   2.490 -18.817
  233   1HA   GLY  34          1HA       GLY  34   5.827   4.700 -20.065
  234   2HA   GLY  34          2HA       GLY  34   5.270   3.689 -18.725
  235    H    GLY  35           H        GLY  35   3.283   3.184 -19.387
  236   1HA   GLY  35          1HA       GLY  35   1.739   2.886 -21.507
  237   2HA   GLY  35          2HA       GLY  35   2.917   1.676 -22.034
  238    H    ASP  36           H        ASP  36   1.498   2.317 -18.830
  239    HA   ASP  36           HA       ASP  36   0.463   0.876 -17.203
  240   1HB   ASP  36          1HB       ASP  36  -1.429  -0.110 -17.910
  241   2HB   ASP  36          2HB       ASP  36  -0.572  -1.241 -18.932
  242    H    ILE  37           H        ILE  37   0.608  -1.310 -16.293
  243    HA   ILE  37           HA       ILE  37   3.289  -2.634 -16.925
  244    HB   ILE  37           HB       ILE  37   2.024  -3.531 -14.425
  245   1HG1  ILE  37          1HG1      ILE  37   1.786  -0.712 -14.746
  246   2HG1  ILE  37          2HG1      ILE  37   1.605  -1.645 -13.273
  247   1HG2  ILE  37          1HG2      ILE  37   4.325  -3.366 -13.556
  248   2HG2  ILE  37          2HG2      ILE  37   4.341  -4.130 -15.151
  249   3HG2  ILE  37          3HG2      ILE  37   4.845  -2.432 -14.979
  250   1HD1  ILE  37          1HD1      ILE  37   4.233  -0.330 -14.189
  251   2HD1  ILE  37          2HD1      ILE  37   3.182   0.167 -12.846
  252   3HD1  ILE  37          3HD1      ILE  37   4.067  -1.373 -12.751
  253    H    SER  38           H        SER  38   2.895  -5.060 -15.694
  254    HA   SER  38           HA       SER  38   0.413  -6.395 -16.752
  255   1HB   SER  38          1HB       SER  38   2.283  -6.188 -18.663
  256   2HB   SER  38          2HB       SER  38   1.245  -7.608 -18.511
  257    HG   SER  38           HG       SER  38   3.226  -8.400 -18.611
  258    H    THR  39           H        THR  39   1.318  -9.000 -16.664
  259    HA   THR  39           HA       THR  39   1.622  -9.464 -13.704
  260    HB   THR  39           HB       THR  39   1.494 -11.998 -14.593
  261    HG1  THR  39           HG1      THR  39   0.449 -12.190 -16.434
  262   1HG2  THR  39          1HG2      THR  39  -0.944 -11.994 -14.304
  263   2HG2  THR  39          2HG2      THR  39  -0.226 -10.910 -13.089
  264   3HG2  THR  39          3HG2      THR  39  -1.031 -10.232 -14.529
  265    H    LYS  40           H        LYS  40   3.211 -10.745 -16.660
  266    HA   LYS  40           HA       LYS  40   5.508 -11.958 -15.410
  267   1HB   LYS  40          1HB       LYS  40   5.377 -10.718 -18.209
  268   2HB   LYS  40          2HB       LYS  40   4.754 -12.300 -17.821
  269   1HG   LYS  40          1HG       LYS  40   7.284 -12.755 -17.026
  270   2HG   LYS  40          2HG       LYS  40   6.845 -12.830 -18.712
  271   1HD   LYS  40          1HD       LYS  40   7.851 -10.116 -17.804
  272   2HD   LYS  40          2HD       LYS  40   8.965 -11.442 -17.644
  273   1HE   LYS  40          1HE       LYS  40   9.118 -10.130 -19.836
  274   2HE   LYS  40          2HE       LYS  40   9.150 -11.883 -19.962
  275   1HZ   LYS  40          1HZ       LYS  40   7.403 -11.713 -21.329
  276   2HZ   LYS  40          2HZ       LYS  40   7.356 -10.072 -21.146
  277   3HZ   LYS  40          3HZ       LYS  40   6.464 -11.040 -20.148
  278    H    GLU  41           H        GLU  41   4.959  -8.659 -16.621
  279    HA   GLU  41           HA       GLU  41   7.647  -7.570 -16.432
  280   1HB   GLU  41          1HB       GLU  41   6.665  -5.338 -16.478
  281   2HB   GLU  41          2HB       GLU  41   5.088  -5.956 -16.038
  282   1HG   GLU  41          1HG       GLU  41   6.512  -6.652 -18.684
  283   2HG   GLU  41          2HG       GLU  41   4.898  -7.150 -18.224
  284    H    LEU  42           H        LEU  42   4.927  -7.358 -14.112
  285    HA   LEU  42           HA       LEU  42   6.329  -5.875 -12.012
  286   1HB   LEU  42          1HB       LEU  42   4.123  -7.818 -11.253
  287   2HB   LEU  42          2HB       LEU  42   3.712  -6.545 -12.381
  288    HG   LEU  42           HG       LEU  42   4.871  -4.956 -10.504
  289   1HD1  LEU  42          1HD1      LEU  42   3.795  -7.264  -8.768
  290   2HD1  LEU  42          2HD1      LEU  42   5.517  -6.974  -9.059
  291   3HD1  LEU  42          3HD1      LEU  42   4.545  -5.749  -8.205
  292   1HD2  LEU  42          1HD2      LEU  42   2.626  -4.461  -9.601
  293   2HD2  LEU  42          2HD2      LEU  42   2.452  -4.844 -11.332
  294   3HD2  LEU  42          3HD2      LEU  42   2.012  -6.054 -10.113
  295    H    GLY  43           H        GLY  43   6.021  -9.302 -12.782
  296   1HA   GLY  43          1HA       GLY  43   6.797 -10.639 -10.366
  297   2HA   GLY  43          2HA       GLY  43   7.181 -11.259 -11.977
  298    H    THR  44           H        THR  44   8.806  -9.089 -12.851
  299    HA   THR  44           HA       THR  44  11.416 -10.112 -12.030
  300    HB   THR  44           HB       THR  44  10.741  -7.578 -13.604
  301    HG1  THR  44           HG1      THR  44  11.899  -9.256 -15.104
  302   1HG2  THR  44          1HG2      THR  44  13.104  -7.604 -14.421
  303   2HG2  THR  44          2HG2      THR  44  13.032  -7.274 -12.678
  304   3HG2  THR  44          3HG2      THR  44  13.507  -8.891 -13.257
  305    H    VAL  45           H        VAL  45   9.827  -6.974 -11.402
  306    HA   VAL  45           HA       VAL  45  11.898  -5.781  -9.744
  307    HB   VAL  45           HB       VAL  45   9.075  -5.117 -10.374
  308   1HG1  VAL  45          1HG1      VAL  45   8.745  -3.491  -8.511
  309   2HG1  VAL  45          2HG1      VAL  45   8.824  -5.140  -7.880
  310   3HG1  VAL  45          3HG1      VAL  45  10.230  -4.065  -7.709
  311   1HG2  VAL  45          1HG2      VAL  45  11.549  -3.327  -9.900
  312   2HG2  VAL  45          2HG2      VAL  45  10.977  -3.913 -11.479
  313   3HG2  VAL  45          3HG2      VAL  45   9.977  -2.791 -10.547
  314    H    MET  46           H        MET  46   9.196  -7.944  -9.047
  315    HA   MET  46           HA       MET  46   9.205  -7.883  -6.128
  316   1HB   MET  46          1HB       MET  46   8.406 -10.477  -6.612
  317   2HB   MET  46          2HB       MET  46   8.129  -9.783  -8.199
  318   1HG   MET  46          1HG       MET  46   6.194  -8.791  -7.511
  319   2HG   MET  46          2HG       MET  46   7.018  -7.954  -6.185
  320   1HE   MET  46          1HE       MET  46   7.054  -8.681  -3.691
  321   2HE   MET  46          2HE       MET  46   6.742 -10.352  -3.136
  322   3HE   MET  46          3HE       MET  46   8.171 -10.003  -4.152
  323    NH1  ARG  47           NH1      ARG  47  13.147 -11.937 -13.242
  324    NH2  ARG  47           NH2      ARG  47  11.437 -13.262 -13.941
  325    H    ARG  47           H        ARG  47  10.942  -9.890  -8.495
  326    HA   ARG  47           HA       ARG  47  12.324 -11.792  -6.850
  327   1HB   ARG  47          1HB       ARG  47  13.616 -10.380  -9.254
  328   2HB   ARG  47          2HB       ARG  47  14.047 -11.941  -8.567
  329   1HG   ARG  47          1HG       ARG  47  11.366 -12.408  -9.107
  330   2HG   ARG  47          2HG       ARG  47  11.741 -11.236 -10.371
  331   1HD   ARG  47          1HD       ARG  47  13.899 -12.801 -10.816
  332   2HD   ARG  47          2HD       ARG  47  12.972 -14.002  -9.929
  333    HE   ARG  47           HE       ARG  47  11.317 -14.123 -11.705
  334   1HH1  ARG  47          1HH1      ARG  47  13.754 -11.644 -12.468
  335   2HH1  ARG  47          2HH1      ARG  47  13.171 -11.591 -14.208
  336   1HH2  ARG  47          1HH2      ARG  47  10.740 -13.977 -13.704
  337   2HH2  ARG  47          2HH2      ARG  47  11.581 -12.823 -14.857
  338    H    MET  48           H        MET  48  12.944  -8.363  -7.387
  339    HA   MET  48           HA       MET  48  15.429  -8.286  -5.661
  340   1HB   MET  48          1HB       MET  48  14.922  -5.648  -6.024
  341   2HB   MET  48          2HB       MET  48  13.954  -6.251  -7.357
  342   1HG   MET  48          1HG       MET  48  15.789  -6.773  -8.654
  343   2HG   MET  48          2HG       MET  48  16.697  -7.458  -7.296
  344   1HE   MET  48          1HE       MET  48  14.994  -3.819  -7.895
  345   2HE   MET  48          2HE       MET  48  16.455  -2.910  -8.377
  346   3HE   MET  48          3HE       MET  48  15.848  -4.236  -9.413
  347    H    LEU  49           H        LEU  49  14.139  -9.315  -3.923
  348    HA   LEU  49           HA       LEU  49  13.361  -7.275  -1.885
  349   1HB   LEU  49          1HB       LEU  49  11.138  -8.721  -1.410
  350   2HB   LEU  49          2HB       LEU  49  11.222  -9.055  -3.126
  351    HG   LEU  49           HG       LEU  49  11.089  -6.619  -3.667
  352   1HD1  LEU  49          1HD1      LEU  49  10.793  -6.102  -0.642
  353   2HD1  LEU  49          2HD1      LEU  49  12.268  -5.775  -1.570
  354   3HD1  LEU  49          3HD1      LEU  49  10.771  -4.885  -1.943
  355   1HD2  LEU  49          1HD2      LEU  49   8.733  -6.239  -3.068
  356   2HD2  LEU  49          2HD2      LEU  49   8.934  -7.989  -3.328
  357   3HD2  LEU  49          3HD2      LEU  49   8.843  -7.351  -1.680
  358    H    GLY  50           H        GLY  50  13.021 -10.741  -2.708
  359   1HA   GLY  50          1HA       GLY  50  13.648 -11.754   0.012
  360   2HA   GLY  50          2HA       GLY  50  15.094 -11.828  -1.005
  361    H    GLN  51           H        GLN  51  11.665 -12.306  -1.840
  362    HA   GLN  51           HA       GLN  51  11.957 -15.291  -2.192
  363   1HB   GLN  51          1HB       GLN  51   9.422 -14.647  -3.166
  364   2HB   GLN  51          2HB       GLN  51   9.694 -13.347  -2.021
  365   1HG   GLN  51          1HG       GLN  51  10.011 -16.316  -1.276
  366   2HG   GLN  51          2HG       GLN  51  10.077 -14.963  -0.169
  367   1HE2  GLN  51          1HE2      GLN  51   6.610 -15.733   0.441
  368   2HE2  GLN  51          2HE2      GLN  51   8.328 -15.657   1.082
  369    H    ASN  52           H        ASN  52  10.386 -15.778  -4.363
  370    HA   ASN  52           HA       ASN  52  11.370 -14.205  -6.732
  371   1HB   ASN  52          1HB       ASN  52  13.063 -16.097  -6.162
  372   2HB   ASN  52          2HB       ASN  52  11.862 -17.242  -6.719
  373   1HD2  ASN  52          1HD2      ASN  52  14.270 -16.183  -9.523
  374   2HD2  ASN  52          2HD2      ASN  52  14.430 -16.904  -7.843
  375    HA   PRO  53           HA       PRO  53   6.732 -15.366  -7.222
  376   1HB   PRO  53          1HB       PRO  53   5.841 -13.506  -8.414
  377   2HB   PRO  53          2HB       PRO  53   7.250 -13.414  -9.480
  378   1HG   PRO  53          1HG       PRO  53   7.815 -11.629  -8.093
  379   2HG   PRO  53          2HG       PRO  53   6.988 -12.279  -6.658
  380   1HD   PRO  53          1HD       PRO  53   9.170 -12.987  -6.035
  381   2HD   PRO  53          2HD       PRO  53   9.795 -12.843  -7.704
  382    H    THR  54           H        THR  54   5.643 -16.330  -9.084
  383    HA   THR  54           HA       THR  54   7.502 -17.668 -11.120
  384    HB   THR  54           HB       THR  54   5.905 -18.958  -9.119
  385    HG1  THR  54           HG1      THR  54   6.842 -20.776 -10.126
  386   1HG2  THR  54          1HG2      THR  54   4.577 -20.583 -10.427
  387   2HG2  THR  54          2HG2      THR  54   3.948 -18.941 -10.695
  388   3HG2  THR  54          3HG2      THR  54   4.944 -19.729 -11.945
  389    H    LYS  55           H        LYS  55   6.217 -18.505 -13.022
  390    HA   LYS  55           HA       LYS  55   5.117 -16.235 -14.456
  391   1HB   LYS  55          1HB       LYS  55   4.311 -18.834 -15.649
  392   2HB   LYS  55          2HB       LYS  55   5.985 -18.871 -15.134
  393   1HG   LYS  55          1HG       LYS  55   5.523 -18.192 -17.556
  394   2HG   LYS  55          2HG       LYS  55   4.856 -16.678 -16.972
  395   1HD   LYS  55          1HD       LYS  55   7.222 -16.339 -17.670
  396   2HD   LYS  55          2HD       LYS  55   7.060 -16.071 -15.941
  397   1HE   LYS  55          1HE       LYS  55   9.050 -17.329 -16.104
  398   2HE   LYS  55          2HE       LYS  55   7.872 -18.533 -15.589
  399   1HZ   LYS  55          1HZ       LYS  55   7.758 -18.680 -18.316
  400   2HZ   LYS  55          2HZ       LYS  55   8.651 -19.677 -17.348
  401   3HZ   LYS  55          3HZ       LYS  55   9.358 -18.363 -18.057
  402    H    GLU  56           H        GLU  56   3.530 -19.181 -13.197
  403    HA   GLU  56           HA       GLU  56   0.782 -18.309 -13.940
  404   1HB   GLU  56          1HB       GLU  56   0.134 -20.371 -12.461
  405   2HB   GLU  56          2HB       GLU  56   1.853 -20.705 -12.378
  406   1HG   GLU  56          1HG       GLU  56   1.183 -20.269 -15.190
  407   2HG   GLU  56          2HG       GLU  56  -0.043 -21.326 -14.511
  408    H    GLU  57           H        GLU  57   2.825 -18.292 -11.070
  409    HA   GLU  57           HA       GLU  57   0.811 -17.780  -9.006
  410   1HB   GLU  57          1HB       GLU  57   2.590 -17.149  -7.509
  411   2HB   GLU  57          2HB       GLU  57   3.699 -16.829  -8.825
  412   1HG   GLU  57          1HG       GLU  57   2.837 -19.630  -9.039
  413   2HG   GLU  57          2HG       GLU  57   4.460 -18.989  -8.815
  414    H    LEU  58           H        LEU  58   2.567 -15.712 -11.247
  415    HA   LEU  58           HA       LEU  58   2.131 -13.114 -10.056
  416   1HB   LEU  58          1HB       LEU  58   2.863 -14.137 -12.792
  417   2HB   LEU  58          2HB       LEU  58   2.195 -12.519 -12.747
  418    HG   LEU  58           HG       LEU  58   4.010 -11.660 -11.429
  419   1HD1  LEU  58          1HD1      LEU  58   5.771 -13.087 -10.314
  420   2HD1  LEU  58          2HD1      LEU  58   4.167 -13.396  -9.632
  421   3HD1  LEU  58          3HD1      LEU  58   4.880 -14.560 -10.774
  422   1HD2  LEU  58          1HD2      LEU  58   5.239 -13.767 -13.325
  423   2HD2  LEU  58          2HD2      LEU  58   4.659 -12.148 -13.792
  424   3HD2  LEU  58          3HD2      LEU  58   6.054 -12.307 -12.709
  425    H    ASP  59           H        ASP  59   0.128 -15.153 -12.115
  426    HA   ASP  59           HA       ASP  59  -1.919 -13.280 -12.948
  427   1HB   ASP  59          1HB       ASP  59  -1.642 -15.581 -13.930
  428   2HB   ASP  59          2HB       ASP  59  -2.292 -16.289 -12.470
  429    H    ALA  60           H        ALA  60  -1.463 -15.101  -9.972
  430    HA   ALA  60           HA       ALA  60  -4.117 -14.530  -8.770
  431   1HB   ALA  60          1HB       ALA  60  -3.152 -15.523  -6.701
  432   2HB   ALA  60          2HB       ALA  60  -2.833 -16.541  -8.118
  433   3HB   ALA  60          3HB       ALA  60  -1.528 -15.542  -7.429
  434    H    ILE  61           H        ILE  61  -0.868 -13.135  -8.567
  435    HA   ILE  61           HA       ILE  61  -1.228 -11.262  -6.344
  436    HB   ILE  61           HB       ILE  61   0.796 -11.658  -8.473
  437   1HG1  ILE  61          1HG1      ILE  61   0.666 -11.741  -5.599
  438   2HG1  ILE  61          2HG1      ILE  61   2.021 -12.145  -6.631
  439   1HG2  ILE  61          1HG2      ILE  61   1.840  -9.379  -8.325
  440   2HG2  ILE  61          2HG2      ILE  61   0.240  -9.281  -9.058
  441   3HG2  ILE  61          3HG2      ILE  61   0.462  -8.790  -7.362
  442   1HD1  ILE  61          1HD1      ILE  61   1.532  -9.351  -5.440
  443   2HD1  ILE  61          2HD1      ILE  61   2.781 -10.527  -4.980
  444   3HD1  ILE  61          3HD1      ILE  61   2.843  -9.758  -6.582
  445    H    ILE  62           H        ILE  62  -1.952 -11.163  -9.802
  446    HA   ILE  62           HA       ILE  62  -2.807  -8.286  -9.829
  447    HB   ILE  62           HB       ILE  62  -2.983 -10.437 -12.000
  448   1HG1  ILE  62          1HG1      ILE  62  -0.703 -10.002 -12.020
  449   2HG1  ILE  62          2HG1      ILE  62  -0.860  -8.459 -11.208
  450   1HG2  ILE  62          1HG2      ILE  62  -3.548  -8.599 -13.614
  451   2HG2  ILE  62          2HG2      ILE  62  -4.796  -8.732 -12.377
  452   3HG2  ILE  62          3HG2      ILE  62  -3.601  -7.418 -12.281
  453   1HD1  ILE  62          1HD1      ILE  62  -1.489  -7.284 -13.299
  454   2HD1  ILE  62          2HD1      ILE  62   0.026  -8.185 -13.517
  455   3HD1  ILE  62          3HD1      ILE  62  -1.487  -8.829 -14.195
  456    H    GLU  63           H        GLU  63  -4.229 -11.500  -9.590
  457    HA   GLU  63           HA       GLU  63  -6.996 -11.143  -9.998
  458   1HB   GLU  63          1HB       GLU  63  -6.086 -12.675  -7.529
  459   2HB   GLU  63          2HB       GLU  63  -5.639 -13.240  -9.127
  460   1HG   GLU  63          1HG       GLU  63  -8.351 -12.941  -9.536
  461   2HG   GLU  63          2HG       GLU  63  -7.601 -14.428  -8.982
  462    H    GLU  64           H        GLU  64  -5.320 -10.601  -6.875
  463    HA   GLU  64           HA       GLU  64  -7.570  -8.917  -5.789
  464   1HB   GLU  64          1HB       GLU  64  -6.786  -9.420  -3.761
  465   2HB   GLU  64          2HB       GLU  64  -5.745 -10.583  -4.559
  466   1HG   GLU  64          1HG       GLU  64  -3.893  -8.807  -4.637
  467   2HG   GLU  64          2HG       GLU  64  -4.950  -7.706  -3.770
  468    H    VAL  65           H        VAL  65  -6.806  -6.802  -4.709
  469    HA   VAL  65           HA       VAL  65  -6.336  -4.484  -5.126
  470    HB   VAL  65           HB       VAL  65  -4.182  -5.129  -4.252
  471   1HG1  VAL  65          1HG1      VAL  65  -3.625  -3.316  -6.688
  472   2HG1  VAL  65          2HG1      VAL  65  -4.485  -2.774  -5.234
  473   3HG1  VAL  65          3HG1      VAL  65  -2.791  -3.310  -5.114
  474   1HG2  VAL  65          1HG2      VAL  65  -2.260  -5.942  -5.526
  475   2HG2  VAL  65          2HG2      VAL  65  -3.626  -7.004  -5.946
  476   3HG2  VAL  65          3HG2      VAL  65  -3.108  -5.749  -7.080
  477    H    ASP  66           H        ASP  66  -7.833  -5.728  -7.080
  478    HA   ASP  66           HA       ASP  66  -7.355  -3.947  -9.441
  479   1HB   ASP  66          1HB       ASP  66  -7.556  -6.808 -10.351
  480   2HB   ASP  66          2HB       ASP  66  -6.025  -6.354  -9.638
  481    H    GLU  67           H        GLU  67  -9.327  -3.492  -8.037
  482    HA   GLU  67           HA       GLU  67 -11.770  -5.191  -8.508
  483   1HB   GLU  67          1HB       GLU  67 -11.948  -2.484  -7.169
  484   2HB   GLU  67          2HB       GLU  67 -11.017  -3.728  -6.354
  485   1HG   GLU  67          1HG       GLU  67 -13.401  -5.104  -7.010
  486   2HG   GLU  67          2HG       GLU  67 -12.980  -4.443  -5.439
  487    H    ASP  68           H        ASP  68 -10.384  -3.872 -10.786
  488    HA   ASP  68           HA       ASP  68 -12.607  -2.028 -11.804
  489   1HB   ASP  68          1HB       ASP  68 -10.046  -1.131 -11.399
  490   2HB   ASP  68          2HB       ASP  68 -11.188  -0.444 -12.531
  491    H    GLY  69           H        GLY  69 -10.152  -4.480 -12.571
  492   1HA   GLY  69          1HA       GLY  69 -11.991  -5.848 -14.546
  493   2HA   GLY  69          2HA       GLY  69 -10.421  -6.455 -14.002
  494    H    SER  70           H        SER  70  -8.834  -6.398 -15.373
  495    HA   SER  70           HA       SER  70  -8.935  -5.109 -18.049
  496   1HB   SER  70          1HB       SER  70  -6.934  -3.528 -17.581
  497   2HB   SER  70          2HB       SER  70  -8.540  -3.014 -17.056
  498    HG   SER  70           HG       SER  70  -6.529  -3.036 -15.592
  499    H    GLY  71           H        GLY  71  -6.617  -6.032 -15.469
  500   1HA   GLY  71          1HA       GLY  71  -5.307  -8.098 -17.308
  501   2HA   GLY  71          2HA       GLY  71  -5.164  -8.068 -15.545
  502    H    THR  72           H        THR  72  -4.729  -5.184 -15.417
  503    HA   THR  72           HA       THR  72  -1.757  -5.213 -15.667
  504    HB   THR  72           HB       THR  72  -1.469  -3.174 -17.003
  505    HG1  THR  72           HG1      THR  72  -3.522  -2.805 -18.350
  506   1HG2  THR  72          1HG2      THR  72  -1.947  -3.997 -19.273
  507   2HG2  THR  72          2HG2      THR  72  -1.342  -5.348 -18.288
  508   3HG2  THR  72          3HG2      THR  72  -3.081  -5.223 -18.664
  509    H    ILE  73           H        ILE  73  -1.163  -2.633 -15.171
  510    HA   ILE  73           HA       ILE  73  -2.931  -1.586 -12.923
  511    HB   ILE  73           HB       ILE  73  -0.016  -2.416 -12.504
  512   1HG1  ILE  73          1HG1      ILE  73  -2.066  -4.116 -12.215
  513   2HG1  ILE  73          2HG1      ILE  73  -0.743  -4.097 -11.069
  514   1HG2  ILE  73          1HG2      ILE  73  -0.105  -1.375 -10.242
  515   2HG2  ILE  73          2HG2      ILE  73  -0.419  -0.142 -11.472
  516   3HG2  ILE  73          3HG2      ILE  73  -1.767  -0.804 -10.517
  517   1HD1  ILE  73          1HD1      ILE  73  -3.471  -2.768 -10.572
  518   2HD1  ILE  73          2HD1      ILE  73  -2.833  -4.249  -9.827
  519   3HD1  ILE  73          3HD1      ILE  73  -2.075  -2.681  -9.462
  520    H    ASP  74           H        ASP  74  -3.233  -0.172 -14.837
  521    HA   ASP  74           HA       ASP  74  -1.208   1.543 -16.035
  522   1HB   ASP  74          1HB       ASP  74  -2.892   2.680 -17.079
  523   2HB   ASP  74          2HB       ASP  74  -3.839   2.885 -15.624
  524    H    PHE  75           H        PHE  75  -1.059   3.934 -15.615
  525    HA   PHE  75           HA       PHE  75  -0.006   4.483 -12.959
  526   1HB   PHE  75          1HB       PHE  75   0.561   5.697 -15.184
  527   2HB   PHE  75          2HB       PHE  75  -0.893   6.633 -14.971
  528    HD1  PHE  75           HD1      PHE  75   2.601   6.490 -14.229
  529    HD2  PHE  75           HD2      PHE  75  -1.114   7.890 -12.568
  530    HE1  PHE  75           HE1      PHE  75   3.825   8.074 -12.799
  531    HE2  PHE  75           HE2      PHE  75   0.130   9.473 -11.150
  532    HZ   PHE  75           HZ       PHE  75   2.595   9.571 -11.264
  533    H    GLU  76           H        GLU  76  -3.163   4.963 -14.429
  534    HA   GLU  76           HA       GLU  76  -4.409   6.866 -12.675
  535   1HB   GLU  76          1HB       GLU  76  -6.288   4.733 -13.481
  536   2HB   GLU  76          2HB       GLU  76  -6.340   6.465 -13.736
  537   1HG   GLU  76          1HG       GLU  76  -4.312   5.024 -15.442
  538   2HG   GLU  76          2HG       GLU  76  -5.977   4.555 -15.716
  539    H    GLU  77           H        GLU  77  -4.909   3.331 -12.500
  540    HA   GLU  77           HA       GLU  77  -6.008   3.368  -9.756
  541   1HB   GLU  77          1HB       GLU  77  -6.676   1.290 -10.173
  542   2HB   GLU  77          2HB       GLU  77  -6.130   1.556 -11.813
  543   1HG   GLU  77          1HG       GLU  77  -3.818   0.555 -11.061
  544   2HG   GLU  77          2HG       GLU  77  -4.632   0.048  -9.585
  545    H    PHE  78           H        PHE  78  -2.795   3.095 -11.075
  546    HA   PHE  78           HA       PHE  78  -1.355   1.780  -8.957
  547   1HB   PHE  78          1HB       PHE  78  -0.299   4.112 -10.676
  548   2HB   PHE  78          2HB       PHE  78  -0.404   2.462 -11.236
  549    HD1  PHE  78           HD1      PHE  78   1.404   0.900 -10.699
  550    HD2  PHE  78           HD2      PHE  78   1.209   4.668  -8.632
  551    HE1  PHE  78           HE1      PHE  78   3.645   0.512  -9.756
  552    HE2  PHE  78           HE2      PHE  78   3.447   4.260  -7.695
  553    HZ   PHE  78           HZ       PHE  78   4.670   2.187  -8.255
  554    H    LEU  79           H        LEU  79  -2.177   5.220  -9.375
  555    HA   LEU  79           HA       LEU  79  -0.827   6.242  -6.978
  556   1HB   LEU  79          1HB       LEU  79  -2.420   8.256  -7.264
  557   2HB   LEU  79          2HB       LEU  79  -3.143   7.419  -8.620
  558    HG   LEU  79           HG       LEU  79  -1.010   7.473  -9.891
  559   1HD1  LEU  79          1HD1      LEU  79   0.244   8.987  -7.516
  560   2HD1  LEU  79          2HD1      LEU  79   0.551   7.280  -7.886
  561   3HD1  LEU  79          3HD1      LEU  79   1.044   8.540  -9.044
  562   1HD2  LEU  79          1HD2      LEU  79  -0.882   9.882 -10.361
  563   2HD2  LEU  79          2HD2      LEU  79  -2.579   9.517  -9.960
  564   3HD2  LEU  79          3HD2      LEU  79  -1.539  10.294  -8.757
  565    H    VAL  80           H        VAL  80  -4.086   5.028  -7.621
  566    HA   VAL  80           HA       VAL  80  -5.338   5.744  -5.045
  567    HB   VAL  80           HB       VAL  80  -6.162   3.530  -6.994
  568   1HG1  VAL  80          1HG1      VAL  80  -8.422   3.682  -5.926
  569   2HG1  VAL  80          2HG1      VAL  80  -7.205   3.168  -4.750
  570   3HG1  VAL  80          3HG1      VAL  80  -7.798   4.844  -4.727
  571   1HG2  VAL  80          1HG2      VAL  80  -7.260   6.411  -6.791
  572   2HG2  VAL  80          2HG2      VAL  80  -6.241   5.793  -8.111
  573   3HG2  VAL  80          3HG2      VAL  80  -7.862   5.126  -7.866
  574    H    MET  81           H        MET  81  -3.323   3.113  -6.211
  575    HA   MET  81           HA       MET  81  -3.682   1.099  -4.151
  576   1HB   MET  81          1HB       MET  81  -2.180   1.113  -6.397
  577   2HB   MET  81          2HB       MET  81  -0.905   1.565  -5.281
  578   1HG   MET  81          1HG       MET  81  -2.639  -0.923  -4.758
  579   2HG   MET  81          2HG       MET  81  -1.077  -0.510  -4.031
  580   1HE   MET  81          1HE       MET  81   1.214  -0.901  -5.008
  581   2HE   MET  81          2HE       MET  81   1.571  -1.228  -6.730
  582   3HE   MET  81          3HE       MET  81   0.957   0.377  -6.238
  583    H    MET  82           H        MET  82  -1.190   3.658  -4.375
  584    HA   MET  82           HA       MET  82  -0.020   3.165  -1.719
  585   1HB   MET  82          1HB       MET  82   0.889   5.657  -2.173
  586   2HB   MET  82          2HB       MET  82   0.280   5.368  -3.792
  587   1HG   MET  82          1HG       MET  82   2.369   4.482  -4.171
  588   2HG   MET  82          2HG       MET  82   1.712   3.022  -3.421
  589   1HE   MET  82          1HE       MET  82   4.274   2.521  -3.225
  590   2HE   MET  82          2HE       MET  82   5.272   3.061  -1.842
  591   3HE   MET  82          3HE       MET  82   5.129   4.095  -3.294
  592    H    VAL  83           H        VAL  83  -2.589   5.233  -2.942
  593    HA   VAL  83           HA       VAL  83  -2.820   7.066  -0.655
  594    HB   VAL  83           HB       VAL  83  -4.502   6.518  -3.091
  595   1HG1  VAL  83          1HG1      VAL  83  -6.346   8.023  -2.323
  596   2HG1  VAL  83          2HG1      VAL  83  -6.274   6.566  -1.323
  597   3HG1  VAL  83          3HG1      VAL  83  -5.633   8.100  -0.691
  598   1HG2  VAL  83          1HG2      VAL  83  -3.471   9.152  -1.842
  599   2HG2  VAL  83          2HG2      VAL  83  -2.726   8.288  -3.207
  600   3HG2  VAL  83          3HG2      VAL  83  -4.336   8.997  -3.394
  601    NH1  ARG  84           NH1      ARG  84  -8.956  -1.186  -1.149
  602    NH2  ARG  84           NH2      ARG  84  -7.474  -2.780  -1.801
  603    H    ARG  84           H        ARG  84  -4.101   3.889  -1.417
  604    HA   ARG  84           HA       ARG  84  -6.338   3.753   0.495
  605   1HB   ARG  84          1HB       ARG  84  -4.877   1.820  -1.269
  606   2HB   ARG  84          2HB       ARG  84  -5.476   1.106   0.222
  607   1HG   ARG  84          1HG       ARG  84  -7.395   2.835  -1.397
  608   2HG   ARG  84          2HG       ARG  84  -7.762   1.516  -0.282
  609   1HD   ARG  84          1HD       ARG  84  -6.385   1.144  -3.020
  610   2HD   ARG  84          2HD       ARG  84  -8.108   0.889  -2.735
  611    HE   ARG  84           HE       ARG  84  -5.852  -0.865  -1.681
  612   1HH1  ARG  84          1HH1      ARG  84  -9.140  -0.191  -0.980
  613   2HH1  ARG  84          2HH1      ARG  84  -9.606  -1.966  -0.999
  614   1HH2  ARG  84          1HH2      ARG  84  -6.541  -2.998  -2.167
  615   2HH2  ARG  84          2HH2      ARG  84  -8.218  -3.450  -1.576
  616    H    GLN  85           H        GLN  85  -2.952   2.607   0.640
  617    HA   GLN  85           HA       GLN  85  -3.145   1.507   3.388
  618   1HB   GLN  85          1HB       GLN  85  -0.626   1.288   3.215
  619   2HB   GLN  85          2HB       GLN  85  -0.675   2.132   1.678
  620   1HG   GLN  85          1HG       GLN  85  -1.348   0.284   0.510
  621   2HG   GLN  85          2HG       GLN  85  -2.553  -0.175   1.693
  622   1HE2  GLN  85          1HE2      GLN  85   1.276  -1.516   2.646
  623   2HE2  GLN  85          2HE2      GLN  85   0.959   0.254   2.283
  624    H    MET  86           H        MET  86  -2.107   4.550   1.937
  625    HA   MET  86           HA       MET  86  -0.706   5.729   4.231
  626   1HB   MET  86          1HB       MET  86  -0.199   7.370   2.788
  627   2HB   MET  86          2HB       MET  86  -1.042   6.438   1.566
  628   1HG   MET  86          1HG       MET  86  -3.090   7.689   1.745
  629   2HG   MET  86          2HG       MET  86  -2.621   8.434   3.280
  630   1HE   MET  86          1HE       MET  86  -3.638   9.881   0.400
  631   2HE   MET  86          2HE       MET  86  -2.297  10.511  -0.602
  632   3HE   MET  86          3HE       MET  86  -2.650   8.759  -0.587
  633    H    LYS  87           H        LYS  87  -4.055   5.843   3.074
  634    HA   LYS  87           HA       LYS  87  -5.033   7.859   5.045
  635   1HB   LYS  87          1HB       LYS  87  -7.376   6.865   4.288
  636   2HB   LYS  87          2HB       LYS  87  -6.447   6.002   3.071
  637   1HG   LYS  87          1HG       LYS  87  -6.433   9.059   3.389
  638   2HG   LYS  87          2HG       LYS  87  -5.543   8.172   2.162
  639   1HD   LYS  87          1HD       LYS  87  -7.651   7.415   1.098
  640   2HD   LYS  87          2HD       LYS  87  -8.594   8.017   2.455
  641   1HE   LYS  87          1HE       LYS  87  -7.574  10.416   1.801
  642   2HE   LYS  87          2HE       LYS  87  -7.226   9.652   0.245
  643   1HZ   LYS  87          1HZ       LYS  87  -9.829  10.239   1.459
  644   2HZ   LYS  87          2HZ       LYS  87  -9.735   8.909   0.484
  645   3HZ   LYS  87          3HZ       LYS  87  -9.337  10.398  -0.110
  646    H    GLU  88           H        GLU  88  -5.255   7.460   7.104
  647    HA   GLU  88           HA       GLU  88  -5.476   6.327   9.215
  648   1HB   GLU  88          1HB       GLU  88  -7.639   4.594   7.992
  649   2HB   GLU  88          2HB       GLU  88  -7.570   5.347   9.574
  650   1HG   GLU  88          1HG       GLU  88  -9.253   6.566   8.397
  651   2HG   GLU  88          2HG       GLU  88  -8.351   6.587   6.891
  652    H    ASP  89           H        ASP  89  -3.381   5.413   7.751
  653    HA   ASP  89           HA       ASP  89  -1.840   3.583   7.465
  654   1HB   ASP  89          1HB       ASP  89  -1.364   2.504   9.419
  655   2HB   ASP  89          2HB       ASP  89  -3.004   1.951   9.669
  656    H    ALA  90           H        ALA  90  -2.279   0.840   8.091
  657    HA   ALA  90           HA       ALA  90  -4.408  -0.009   6.043
  658   1HB   ALA  90          1HB       ALA  90  -2.885  -1.879   5.354
  659   2HB   ALA  90          2HB       ALA  90  -2.109  -0.306   5.085
  660   3HB   ALA  90          3HB       ALA  90  -1.625  -1.306   6.476
   
  Start of MODEL          33
 Raw file had  660 H/Q atoms
  Start of MODEL   33
    1   1H    ALA   1          1H        ALA   1 -19.265  10.966 -22.180
    2   2H    ALA   1          2H        ALA   1 -19.016  11.396 -20.573
    3   3H    ALA   1          3H        ALA   1 -20.208  12.167 -21.475
    4    HA   ALA   1           HA       ALA   1 -18.198  12.703 -23.036
    5   1HB   ALA   1          1HB       ALA   1 -18.311  14.589 -20.703
    6   2HB   ALA   1          2HB       ALA   1 -19.898  14.164 -21.373
    7   3HB   ALA   1          3HB       ALA   1 -18.656  14.894 -22.422
    8    H    SER   2           H        SER   2 -17.744  12.931 -19.488
    9    HA   SER   2           HA       SER   2 -14.992  11.632 -19.679
   10   1HB   SER   2          1HB       SER   2 -14.833  14.213 -19.894
   11   2HB   SER   2          2HB       SER   2 -15.299  14.289 -18.193
   12    HG   SER   2           HG       SER   2 -12.944  13.690 -19.290
   13    H    MET   3           H        MET   3 -15.067  10.034 -18.286
   14    HA   MET   3           HA       MET   3 -17.004   9.721 -16.096
   15   1HB   MET   3          1HB       MET   3 -14.690   8.124 -17.176
   16   2HB   MET   3          2HB       MET   3 -15.115   7.808 -15.503
   17   1HG   MET   3          1HG       MET   3 -17.123   7.667 -17.846
   18   2HG   MET   3          2HG       MET   3 -16.256   6.281 -17.173
   19   1HE   MET   3          1HE       MET   3 -19.502   5.387 -16.333
   20   2HE   MET   3          2HE       MET   3 -19.103   6.508 -17.669
   21   3HE   MET   3          3HE       MET   3 -20.232   7.023 -16.382
   22    H    THR   4           H        THR   4 -16.101   9.081 -13.850
   23    HA   THR   4           HA       THR   4 -13.819  10.626 -12.750
   24    HB   THR   4           HB       THR   4 -15.640  12.354 -13.345
   25    HG1  THR   4           HG1      THR   4 -14.628  13.565 -11.995
   26   1HG2  THR   4          1HG2      THR   4 -17.479  11.129 -11.811
   27   2HG2  THR   4          2HG2      THR   4 -17.379  12.903 -11.869
   28   3HG2  THR   4          3HG2      THR   4 -16.672  12.012 -10.497
   29    H    ASP   5           H        ASP   5 -14.410   7.986 -12.587
   30    HA   ASP   5           HA       ASP   5 -15.962   7.314 -10.098
   31   1HB   ASP   5          1HB       ASP   5 -15.760   5.013 -10.679
   32   2HB   ASP   5          2HB       ASP   5 -14.346   5.268 -11.675
   33    H    GLN   6           H        GLN   6 -14.076   5.036  -9.559
   34    HA   GLN   6           HA       GLN   6 -12.572   5.946  -7.314
   35   1HB   GLN   6          1HB       GLN   6 -11.832   3.814  -7.118
   36   2HB   GLN   6          2HB       GLN   6 -12.986   3.493  -8.398
   37   1HG   GLN   6          1HG       GLN   6 -10.056   4.149  -9.039
   38   2HG   GLN   6          2HG       GLN   6 -11.250   3.459 -10.117
   39   1HE2  GLN   6          1HE2      GLN   6  -8.988   0.700  -8.776
   40   2HE2  GLN   6          2HE2      GLN   6  -8.829   2.213  -9.802
   41    H    GLN   7           H        GLN   7 -11.694   5.870 -10.739
   42    HA   GLN   7           HA       GLN   7  -8.829   6.535 -10.513
   43   1HB   GLN   7          1HB       GLN   7  -9.386   7.534 -12.990
   44   2HB   GLN   7          2HB       GLN   7 -10.863   6.609 -12.761
   45   1HG   GLN   7          1HG       GLN   7  -8.061   5.603 -13.193
   46   2HG   GLN   7          2HG       GLN   7  -9.017   4.663 -12.058
   47   1HE2  GLN   7          1HE2      GLN   7 -11.541   3.970 -14.789
   48   2HE2  GLN   7          2HE2      GLN   7 -11.538   4.638 -13.080
   49    H    ALA   8           H        ALA   8 -11.789   8.466 -10.992
   50    HA   ALA   8           HA       ALA   8 -10.757  11.103 -11.344
   51   1HB   ALA   8          1HB       ALA   8 -12.914  11.931 -10.417
   52   2HB   ALA   8          2HB       ALA   8 -13.169  10.563 -11.517
   53   3HB   ALA   8          3HB       ALA   8 -13.287  10.322  -9.755
   54    H    GLU   9           H        GLU   9 -10.903   9.143  -8.437
   55    HA   GLU   9           HA       GLU   9 -10.582  11.203  -6.389
   56   1HB   GLU   9          1HB       GLU   9  -9.875   8.209  -6.306
   57   2HB   GLU   9          2HB       GLU   9  -9.637   9.283  -4.935
   58   1HG   GLU   9          1HG       GLU   9 -12.371   8.726  -6.255
   59   2HG   GLU   9          2HG       GLU   9 -12.122   9.848  -4.922
   60    H    ALA  10           H        ALA  10  -8.202   9.172  -8.102
   61    HA   ALA  10           HA       ALA  10  -5.827  10.100  -6.627
   62   1HB   ALA  10          1HB       ALA  10  -4.528   8.899  -8.378
   63   2HB   ALA  10          2HB       ALA  10  -5.873   7.908  -7.782
   64   3HB   ALA  10          3HB       ALA  10  -5.989   8.701  -9.374
   65    NH1  ARG  11           NH1      ARG  11  -7.439  13.929 -14.858
   66    NH2  ARG  11           NH2      ARG  11  -9.594  13.998 -15.572
   67    H    ARG  11           H        ARG  11  -7.531  11.198  -9.493
   68    HA   ARG  11           HA       ARG  11  -5.386  12.929 -10.633
   69   1HB   ARG  11          1HB       ARG  11  -8.250  13.533 -11.352
   70   2HB   ARG  11          2HB       ARG  11  -6.823  13.378 -12.365
   71   1HG   ARG  11          1HG       ARG  11  -6.993  10.763 -11.683
   72   2HG   ARG  11          2HG       ARG  11  -8.686  11.178 -11.398
   73   1HD   ARG  11          1HD       ARG  11  -7.122  11.484 -14.032
   74   2HD   ARG  11          2HD       ARG  11  -8.485  10.405 -13.728
   75    HE   ARG  11           HE       ARG  11  -9.954  12.529 -13.560
   76   1HH1  ARG  11          1HH1      ARG  11 -10.545  13.618 -15.498
   77   2HH1  ARG  11          2HH1      ARG  11  -9.283  14.762 -16.182
   78   1HH2  ARG  11          1HH2      ARG  11  -6.729  13.452 -14.291
   79   2HH2  ARG  11          2HH2      ARG  11  -7.295  14.741 -15.468
   80    H    ALA  12           H        ALA  12  -8.293  13.424  -8.646
   81    HA   ALA  12           HA       ALA  12  -8.189  16.385  -8.611
   82   1HB   ALA  12          1HB       ALA  12  -9.968  16.234  -6.881
   83   2HB   ALA  12          2HB       ALA  12 -10.324  15.179  -8.263
   84   3HB   ALA  12          3HB       ALA  12  -9.725  14.476  -6.739
   85    H    PHE  13           H        PHE  13  -6.884  13.796  -6.613
   86    HA   PHE  13           HA       PHE  13  -6.083  15.496  -4.319
   87   1HB   PHE  13          1HB       PHE  13  -5.454  12.598  -5.084
   88   2HB   PHE  13          2HB       PHE  13  -6.626  13.162  -3.921
   89    HD1  PHE  13           HD1      PHE  13  -4.155  11.178  -3.615
   90    HD2  PHE  13           HD2      PHE  13  -4.714  15.319  -2.582
   91    HE1  PHE  13           HE1      PHE  13  -2.407  10.997  -1.892
   92    HE2  PHE  13           HE2      PHE  13  -2.962  15.118  -0.868
   93    HZ   PHE  13           HZ       PHE  13  -1.805  12.963  -0.520
   94    H    LEU  14           H        LEU  14  -4.463  14.026  -7.123
   95    HA   LEU  14           HA       LEU  14  -1.775  15.283  -6.407
   96   1HB   LEU  14          1HB       LEU  14  -0.741  13.783  -7.964
   97   2HB   LEU  14          2HB       LEU  14  -2.244  13.416  -8.781
   98    HG   LEU  14           HG       LEU  14  -2.937  12.369  -6.380
   99   1HD1  LEU  14          1HD1      LEU  14   0.128  12.041  -6.319
  100   2HD1  LEU  14          2HD1      LEU  14  -0.779  13.143  -5.267
  101   3HD1  LEU  14          3HD1      LEU  14  -1.043  11.386  -5.146
  102   1HD2  LEU  14          1HD2      LEU  14  -2.275  10.143  -7.193
  103   2HD2  LEU  14          2HD2      LEU  14  -2.717  11.116  -8.618
  104   3HD2  LEU  14          3HD2      LEU  14  -1.011  10.834  -8.241
  105    H    SER  15           H        SER  15  -0.563  15.999  -8.475
  106    HA   SER  15           HA       SER  15  -2.366  17.526 -10.423
  107   1HB   SER  15          1HB       SER  15  -1.531  19.049  -8.567
  108   2HB   SER  15          2HB       SER  15  -1.142  19.568 -10.209
  109    HG   SER  15           HG       SER  15   0.539  19.509  -8.463
  110    H    GLU  16           H        GLU  16  -0.179  18.748 -11.756
  111    HA   GLU  16           HA       GLU  16   0.815  16.488 -13.450
  112   1HB   GLU  16          1HB       GLU  16   1.665  19.368 -13.901
  113   2HB   GLU  16          2HB       GLU  16  -0.014  18.932 -14.156
  114   1HG   GLU  16          1HG       GLU  16   2.242  17.345 -15.520
  115   2HG   GLU  16          2HG       GLU  16   0.542  17.388 -15.955
  116    H    GLU  17           H        GLU  17   2.050  18.762 -11.079
  117    HA   GLU  17           HA       GLU  17   4.950  18.291 -11.597
  118   1HB   GLU  17          1HB       GLU  17   3.828  20.393 -10.499
  119   2HB   GLU  17          2HB       GLU  17   3.894  19.489  -8.999
  120   1HG   GLU  17          1HG       GLU  17   6.529  19.453 -10.387
  121   2HG   GLU  17          2HG       GLU  17   6.144  19.874  -8.727
  122    H    MET  18           H        MET  18   2.529  17.157  -9.260
  123    HA   MET  18           HA       MET  18   4.357  15.413  -7.664
  124   1HB   MET  18          1HB       MET  18   2.308  14.484  -6.624
  125   2HB   MET  18          2HB       MET  18   1.295  15.267  -7.822
  126   1HG   MET  18          1HG       MET  18   3.109  16.965  -6.017
  127   2HG   MET  18          2HG       MET  18   1.670  17.468  -6.920
  128   1HE   MET  18          1HE       MET  18  -0.731  17.419  -6.053
  129   2HE   MET  18          2HE       MET  18  -0.937  17.423  -4.276
  130   3HE   MET  18          3HE       MET  18   0.249  18.524  -5.039
  131    H    ILE  19           H        ILE  19   2.221  15.102 -10.457
  132    HA   ILE  19           HA       ILE  19   2.097  12.178 -10.642
  133    HB   ILE  19           HB       ILE  19   1.361  14.448 -12.441
  134   1HG1  ILE  19          1HG1      ILE  19  -0.175  11.817 -12.247
  135   2HG1  ILE  19          2HG1      ILE  19  -0.784  13.445 -12.463
  136   1HG2  ILE  19          1HG2      ILE  19   1.065  13.037 -14.492
  137   2HG2  ILE  19          2HG2      ILE  19   2.771  13.133 -14.060
  138   3HG2  ILE  19          3HG2      ILE  19   1.852  11.658 -13.684
  139   1HD1  ILE  19          1HD1      ILE  19  -0.400  14.031 -10.084
  140   2HD1  ILE  19          2HD1      ILE  19  -1.364  12.546 -10.216
  141   3HD1  ILE  19          3HD1      ILE  19   0.361  12.443  -9.790
  142    H    ALA  20           H        ALA  20   4.377  14.640 -11.737
  143    HA   ALA  20           HA       ALA  20   6.006  13.208 -13.611
  144   1HB   ALA  20          1HB       ALA  20   7.817  14.826 -13.052
  145   2HB   ALA  20          2HB       ALA  20   6.247  15.638 -13.210
  146   3HB   ALA  20          3HB       ALA  20   6.941  15.349 -11.594
  147    H    GLU  21           H        GLU  21   6.143  13.249 -10.060
  148    HA   GLU  21           HA       GLU  21   8.697  11.915  -9.648
  149   1HB   GLU  21          1HB       GLU  21   7.667  11.266  -7.350
  150   2HB   GLU  21          2HB       GLU  21   6.231  12.134  -7.853
  151   1HG   GLU  21          1HG       GLU  21   7.389  14.268  -7.891
  152   2HG   GLU  21          2HG       GLU  21   8.974  13.516  -7.916
  153    H    PHE  22           H        PHE  22   5.373  10.682  -9.918
  154    HA   PHE  22           HA       PHE  22   6.065   7.797  -9.596
  155   1HB   PHE  22          1HB       PHE  22   3.473   9.127 -10.596
  156   2HB   PHE  22          2HB       PHE  22   3.675   7.411 -10.375
  157    HD1  PHE  22           HD1      PHE  22   2.994   6.439  -8.328
  158    HD2  PHE  22           HD2      PHE  22   4.119  10.594  -8.347
  159    HE1  PHE  22           HE1      PHE  22   2.525   6.588  -5.919
  160    HE2  PHE  22           HE2      PHE  22   3.639  10.724  -5.937
  161    HZ   PHE  22           HZ       PHE  22   2.892   8.713  -4.709
  162    H    LYS  23           H        LYS  23   5.966  10.106 -12.201
  163    HA   LYS  23           HA       LYS  23   5.383   8.475 -14.541
  164   1HB   LYS  23          1HB       LYS  23   6.469  11.165 -14.058
  165   2HB   LYS  23          2HB       LYS  23   7.404  10.381 -15.312
  166   1HG   LYS  23          1HG       LYS  23   4.369  10.291 -15.556
  167   2HG   LYS  23          2HG       LYS  23   5.597  10.241 -16.809
  168   1HD   LYS  23          1HD       LYS  23   4.573  12.686 -15.281
  169   2HD   LYS  23          2HD       LYS  23   6.168  12.739 -16.042
  170   1HE   LYS  23          1HE       LYS  23   4.270  13.636 -17.519
  171   2HE   LYS  23          2HE       LYS  23   5.237  12.366 -18.282
  172   1HZ   LYS  23          1HZ       LYS  23   3.525  10.833 -18.036
  173   2HZ   LYS  23          2HZ       LYS  23   2.676  12.217 -18.342
  174   3HZ   LYS  23          3HZ       LYS  23   2.783  11.637 -16.799
  175    H    ALA  24           H        ALA  24   8.534   9.366 -13.092
  176    HA   ALA  24           HA       ALA  24  10.302   7.977 -14.897
  177   1HB   ALA  24          1HB       ALA  24  12.001   8.092 -13.084
  178   2HB   ALA  24          2HB       ALA  24  11.122   9.624 -13.240
  179   3HB   ALA  24          3HB       ALA  24  10.748   8.517 -11.894
  180    H    ALA  25           H        ALA  25   9.302   6.874 -11.636
  181    HA   ALA  25           HA       ALA  25  10.449   4.233 -11.661
  182   1HB   ALA  25          1HB       ALA  25   8.875   3.695  -9.811
  183   2HB   ALA  25          2HB       ALA  25   9.598   5.300  -9.594
  184   3HB   ALA  25          3HB       ALA  25   7.915   5.152 -10.161
  185    H    PHE  26           H        PHE  26   7.458   5.450 -13.039
  186    HA   PHE  26           HA       PHE  26   5.916   2.992 -13.345
  187   1HB   PHE  26          1HB       PHE  26   4.665   4.959 -13.708
  188   2HB   PHE  26          2HB       PHE  26   5.828   5.671 -14.794
  189    HD1  PHE  26           HD1      PHE  26   4.556   2.118 -15.057
  190    HD2  PHE  26           HD2      PHE  26   4.363   6.093 -16.692
  191    HE1  PHE  26           HE1      PHE  26   3.103   1.312 -16.874
  192    HE2  PHE  26           HE2      PHE  26   2.916   5.267 -18.505
  193    HZ   PHE  26           HZ       PHE  26   2.244   2.890 -18.571
  194    H    ASP  27           H        ASP  27   8.214   4.638 -15.519
  195    HA   ASP  27           HA       ASP  27   8.149   2.649 -17.704
  196   1HB   ASP  27          1HB       ASP  27   9.803   3.873 -18.797
  197   2HB   ASP  27          2HB       ASP  27  10.634   4.326 -17.327
  198    H    MET  28           H        MET  28  10.075   3.111 -14.782
  199    HA   MET  28           HA       MET  28  12.206   1.226 -15.072
  200   1HB   MET  28          1HB       MET  28  10.778   1.240 -12.391
  201   2HB   MET  28          2HB       MET  28  11.458   2.749 -12.973
  202   1HG   MET  28          1HG       MET  28  13.697   1.301 -13.345
  203   2HG   MET  28          2HG       MET  28  13.271   1.930 -11.745
  204   1HE   MET  28          1HE       MET  28  10.694   0.090 -10.978
  205   2HE   MET  28          2HE       MET  28  11.494  -1.219 -10.059
  206   3HE   MET  28          3HE       MET  28  12.005   0.478  -9.819
  207    H    PHE  29           H        PHE  29   8.808   0.673 -14.223
  208    HA   PHE  29           HA       PHE  29   9.097  -2.253 -13.715
  209   1HB   PHE  29          1HB       PHE  29   6.593  -0.491 -14.024
  210   2HB   PHE  29          2HB       PHE  29   6.515  -2.207 -13.730
  211    HD1  PHE  29           HD1      PHE  29   9.405  -0.730 -12.076
  212    HD2  PHE  29           HD2      PHE  29   5.166  -1.348 -11.649
  213    HE1  PHE  29           HE1      PHE  29   9.566  -0.253  -9.667
  214    HE2  PHE  29           HE2      PHE  29   5.352  -0.876  -9.241
  215    HZ   PHE  29           HZ       PHE  29   7.544  -0.326  -8.247
  216    H    ASP  30           H        ASP  30   7.884  -0.167 -16.328
  217    HA   ASP  30           HA       ASP  30   6.662  -2.066 -18.085
  218   1HB   ASP  30          1HB       ASP  30   8.185   0.487 -18.846
  219   2HB   ASP  30          2HB       ASP  30   6.473   0.332 -18.523
  220    H    ALA  31           H        ALA  31   9.968  -0.780 -18.563
  221    HA   ALA  31           HA       ALA  31  12.050  -1.936 -19.005
  222   1HB   ALA  31          1HB       ALA  31  12.129  -4.411 -19.240
  223   2HB   ALA  31          2HB       ALA  31  11.251  -3.923 -17.777
  224   3HB   ALA  31          3HB       ALA  31  10.352  -4.508 -19.201
  225    H    ASP  32           H        ASP  32   9.181  -2.717 -20.960
  226    HA   ASP  32           HA       ASP  32  10.805  -2.925 -23.509
  227   1HB   ASP  32          1HB       ASP  32   9.079  -4.108 -24.490
  228   2HB   ASP  32          2HB       ASP  32   8.913  -4.591 -22.818
  229    H    GLY  33           H        GLY  33  10.708  -0.406 -22.246
  230   1HA   GLY  33          1HA       GLY  33  10.800   1.806 -23.398
  231   2HA   GLY  33          2HA       GLY  33   9.575   1.237 -24.508
  232    H    GLY  34           H        GLY  34   7.382   1.334 -23.892
  233   1HA   GLY  34          1HA       GLY  34   6.511   3.617 -22.245
  234   2HA   GLY  34          2HA       GLY  34   6.324   2.136 -21.295
  235    H    GLY  35           H        GLY  35   4.176   1.940 -21.265
  236   1HA   GLY  35          1HA       GLY  35   1.998   2.317 -22.950
  237   2HA   GLY  35          2HA       GLY  35   2.818   1.013 -23.819
  238    H    ASP  36           H        ASP  36   2.095   1.740 -20.397
  239    HA   ASP  36           HA       ASP  36   0.820   0.535 -18.742
  240   1HB   ASP  36          1HB       ASP  36  -0.789  -1.091 -19.307
  241   2HB   ASP  36          2HB       ASP  36   0.104  -1.685 -20.687
  242    H    ILE  37           H        ILE  37   0.824  -1.821 -17.822
  243    HA   ILE  37           HA       ILE  37   3.475  -3.244 -18.283
  244    HB   ILE  37           HB       ILE  37   2.674  -2.928 -15.411
  245   1HG1  ILE  37          1HG1      ILE  37   4.369  -0.723 -16.735
  246   2HG1  ILE  37          2HG1      ILE  37   2.673  -0.527 -16.337
  247   1HG2  ILE  37          1HG2      ILE  37   5.081  -3.255 -14.992
  248   2HG2  ILE  37          2HG2      ILE  37   4.492  -4.502 -16.101
  249   3HG2  ILE  37          3HG2      ILE  37   5.446  -3.138 -16.731
  250   1HD1  ILE  37          1HD1      ILE  37   4.901  -1.021 -14.271
  251   2HD1  ILE  37          2HD1      ILE  37   4.002   0.484 -14.559
  252   3HD1  ILE  37          3HD1      ILE  37   3.161  -0.931 -13.886
  253    H    SER  38           H        SER  38   3.122  -5.273 -18.647
  254    HA   SER  38           HA       SER  38   0.419  -6.506 -18.134
  255   1HB   SER  38          1HB       SER  38   0.976  -8.151 -19.711
  256   2HB   SER  38          2HB       SER  38   2.714  -8.024 -19.428
  257    HG   SER  38           HG       SER  38   1.463  -6.928 -21.315
  258    H    THR  39           H        THR  39   1.251  -9.178 -17.886
  259    HA   THR  39           HA       THR  39   1.847  -9.333 -14.937
  260    HB   THR  39           HB       THR  39   1.593 -11.965 -15.642
  261    HG1  THR  39           HG1      THR  39   0.097 -12.155 -17.198
  262   1HG2  THR  39          1HG2      THR  39  -0.743 -11.887 -14.889
  263   2HG2  THR  39          2HG2      THR  39   0.216 -10.781 -13.879
  264   3HG2  THR  39          3HG2      THR  39  -0.838 -10.132 -15.162
  265    H    LYS  40           H        LYS  40   3.173 -10.672 -17.982
  266    HA   LYS  40           HA       LYS  40   5.513 -11.974 -16.896
  267   1HB   LYS  40          1HB       LYS  40   5.312 -10.709 -19.677
  268   2HB   LYS  40          2HB       LYS  40   4.524 -12.212 -19.275
  269   1HG   LYS  40          1HG       LYS  40   6.756 -13.273 -18.906
  270   2HG   LYS  40          2HG       LYS  40   6.653 -12.550 -20.489
  271   1HD   LYS  40          1HD       LYS  40   8.286 -10.865 -20.003
  272   2HD   LYS  40          2HD       LYS  40   7.905 -10.895 -18.306
  273   1HE   LYS  40          1HE       LYS  40   9.354 -12.564 -17.750
  274   2HE   LYS  40          2HE       LYS  40   9.143 -13.467 -19.244
  275   1HZ   LYS  40          1HZ       LYS  40  11.173 -12.628 -19.699
  276   2HZ   LYS  40          2HZ       LYS  40  11.073 -11.417 -18.579
  277   3HZ   LYS  40          3HZ       LYS  40  10.417 -11.210 -20.081
  278    H    GLU  41           H        GLU  41   4.853  -8.629 -17.784
  279    HA   GLU  41           HA       GLU  41   7.670  -7.666 -17.686
  280   1HB   GLU  41          1HB       GLU  41   6.751  -5.399 -17.971
  281   2HB   GLU  41          2HB       GLU  41   5.123  -5.981 -17.699
  282   1HG   GLU  41          1HG       GLU  41   6.791  -7.059 -20.044
  283   2HG   GLU  41          2HG       GLU  41   5.060  -7.166 -19.810
  284    H    LEU  42           H        LEU  42   4.804  -6.793 -15.721
  285    HA   LEU  42           HA       LEU  42   6.104  -5.273 -13.662
  286   1HB   LEU  42          1HB       LEU  42   3.785  -7.038 -12.823
  287   2HB   LEU  42          2HB       LEU  42   3.493  -5.927 -14.144
  288    HG   LEU  42           HG       LEU  42   4.535  -4.095 -12.457
  289   1HD1  LEU  42          1HD1      LEU  42   3.406  -6.135 -10.441
  290   2HD1  LEU  42          2HD1      LEU  42   5.136  -5.872 -10.708
  291   3HD1  LEU  42          3HD1      LEU  42   4.126  -4.545 -10.080
  292   1HD2  LEU  42          1HD2      LEU  42   2.255  -3.497 -11.720
  293   2HD2  LEU  42          2HD2      LEU  42   2.149  -4.133 -13.381
  294   3HD2  LEU  42          3HD2      LEU  42   1.669  -5.155 -12.014
  295    H    GLY  43           H        GLY  43   5.332  -8.758 -13.704
  296   1HA   GLY  43          1HA       GLY  43   6.147  -9.642 -11.140
  297   2HA   GLY  43          2HA       GLY  43   6.364 -10.640 -12.582
  298    H    THR  44           H        THR  44   8.211  -9.084 -13.988
  299    HA   THR  44           HA       THR  44  10.697 -10.196 -13.035
  300    HB   THR  44           HB       THR  44   9.922  -8.455 -15.279
  301    HG1  THR  44           HG1      THR  44  11.024  -9.905 -16.296
  302   1HG2  THR  44          1HG2      THR  44  12.212  -7.613 -15.827
  303   2HG2  THR  44          2HG2      THR  44  11.566  -6.818 -14.376
  304   3HG2  THR  44          3HG2      THR  44  12.792  -8.101 -14.215
  305    H    VAL  45           H        VAL  45   9.494  -6.844 -12.859
  306    HA   VAL  45           HA       VAL  45  11.796  -5.604 -11.594
  307    HB   VAL  45           HB       VAL  45   9.116  -4.755 -12.293
  308   1HG1  VAL  45          1HG1      VAL  45   8.660  -3.067 -10.515
  309   2HG1  VAL  45          2HG1      VAL  45   8.585  -4.700  -9.843
  310   3HG1  VAL  45          3HG1      VAL  45  10.014  -3.688  -9.536
  311   1HG2  VAL  45          1HG2      VAL  45  11.609  -3.072 -11.576
  312   2HG2  VAL  45          2HG2      VAL  45  11.191  -3.674 -13.198
  313   3HG2  VAL  45          3HG2      VAL  45  10.148  -2.481 -12.411
  314    H    MET  46           H        MET  46   8.996  -7.339 -10.302
  315    HA   MET  46           HA       MET  46   9.261  -6.710  -7.469
  316   1HB   MET  46          1HB       MET  46   8.035  -9.189  -8.810
  317   2HB   MET  46          2HB       MET  46   8.007  -8.916  -7.077
  318   1HG   MET  46          1HG       MET  46   6.955  -6.599  -8.700
  319   2HG   MET  46          2HG       MET  46   6.011  -8.095  -8.804
  320   1HE   MET  46          1HE       MET  46   6.892  -4.962  -6.726
  321   2HE   MET  46          2HE       MET  46   6.668  -5.463  -5.025
  322   3HE   MET  46          3HE       MET  46   8.083  -6.049  -5.946
  323    NH1  ARG  47           NH1      ARG  47   7.780 -14.523  -6.129
  324    NH2  ARG  47           NH2      ARG  47   8.661 -15.760  -4.438
  325    H    ARG  47           H        ARG  47  10.122  -9.805  -9.049
  326    HA   ARG  47           HA       ARG  47  12.023 -10.527  -6.817
  327   1HB   ARG  47          1HB       ARG  47  10.428 -11.999  -8.790
  328   2HB   ARG  47          2HB       ARG  47  12.105 -12.517  -8.889
  329   1HG   ARG  47          1HG       ARG  47  10.637 -12.363  -6.192
  330   2HG   ARG  47          2HG       ARG  47  12.190 -13.130  -6.527
  331   1HD   ARG  47          1HD       ARG  47   9.605 -14.087  -7.922
  332   2HD   ARG  47          2HD       ARG  47  11.160 -14.903  -7.859
  333    HE   ARG  47           HE       ARG  47  10.807 -15.464  -5.467
  334   1HH1  ARG  47          1HH1      ARG  47   7.947 -13.996  -6.993
  335   2HH1  ARG  47          2HH1      ARG  47   6.878 -14.670  -5.663
  336   1HH2  ARG  47          1HH2      ARG  47   9.495 -16.178  -4.011
  337   2HH2  ARG  47          2HH2      ARG  47   7.697 -15.820  -4.090
  338    H    MET  48           H        MET  48  12.653  -8.331  -8.762
  339    HA   MET  48           HA       MET  48  14.818  -9.022 -10.608
  340   1HB   MET  48          1HB       MET  48  13.632  -6.641 -10.036
  341   2HB   MET  48          2HB       MET  48  15.152  -6.809 -10.896
  342   1HG   MET  48          1HG       MET  48  15.574  -6.670  -7.940
  343   2HG   MET  48          2HG       MET  48  14.731  -5.252  -8.588
  344   1HE   MET  48          1HE       MET  48  15.740  -3.463 -10.237
  345   2HE   MET  48          2HE       MET  48  17.187  -3.765 -11.243
  346   3HE   MET  48          3HE       MET  48  15.703  -4.728 -11.505
  347    H    LEU  49           H        LEU  49  14.609  -8.853  -7.121
  348    HA   LEU  49           HA       LEU  49  17.221  -8.388  -6.165
  349   1HB   LEU  49          1HB       LEU  49  16.716  -9.671  -4.185
  350   2HB   LEU  49          2HB       LEU  49  15.592 -10.717  -5.024
  351    HG   LEU  49           HG       LEU  49  14.860  -8.591  -3.423
  352   1HD1  LEU  49          1HD1      LEU  49  13.162  -9.615  -5.783
  353   2HD1  LEU  49          2HD1      LEU  49  13.411 -10.508  -4.272
  354   3HD1  LEU  49          3HD1      LEU  49  12.564  -8.942  -4.246
  355   1HD2  LEU  49          1HD2      LEU  49  13.991  -6.716  -4.757
  356   2HD2  LEU  49          2HD2      LEU  49  15.712  -6.903  -5.173
  357   3HD2  LEU  49          3HD2      LEU  49  14.470  -7.499  -6.284
  358    H    GLY  50           H        GLY  50  16.026 -11.240  -7.842
  359   1HA   GLY  50          1HA       GLY  50  18.562 -11.989  -9.015
  360   2HA   GLY  50          2HA       GLY  50  18.462 -12.918  -7.516
  361    H    GLN  51           H        GLN  51  15.497 -13.056  -7.670
  362    HA   GLN  51           HA       GLN  51  15.355 -15.661  -9.157
  363   1HB   GLN  51          1HB       GLN  51  12.750 -15.134  -8.244
  364   2HB   GLN  51          2HB       GLN  51  13.741 -14.287  -7.071
  365   1HG   GLN  51          1HG       GLN  51  14.269 -17.224  -7.804
  366   2HG   GLN  51          2HG       GLN  51  13.099 -16.772  -6.585
  367   1HE2  GLN  51          1HE2      GLN  51  15.877 -17.127  -4.312
  368   2HE2  GLN  51          2HE2      GLN  51  14.358 -17.890  -5.002
  369    H    ASN  52           H        ASN  52  13.097 -15.958 -10.324
  370    HA   ASN  52           HA       ASN  52  12.213 -13.701 -12.063
  371   1HB   ASN  52          1HB       ASN  52  13.682 -15.949 -13.522
  372   2HB   ASN  52          2HB       ASN  52  14.583 -14.596 -12.874
  373   1HD2  ASN  52          1HD2      ASN  52  13.703 -13.777 -16.443
  374   2HD2  ASN  52          2HD2      ASN  52  14.648 -15.071 -15.549
  375    HA   PRO  53           HA       PRO  53   9.137 -17.263 -11.585
  376   1HB   PRO  53          1HB       PRO  53   7.860 -16.058 -10.042
  377   2HB   PRO  53          2HB       PRO  53   6.832 -15.747 -11.449
  378   1HG   PRO  53          1HG       PRO  53   7.664 -13.597 -11.852
  379   2HG   PRO  53          2HG       PRO  53   7.902 -13.630 -10.089
  380   1HD   PRO  53          1HD       PRO  53  10.273 -13.923 -10.331
  381   2HD   PRO  53          2HD       PRO  53   9.977 -13.224 -11.951
  382    H    THR  54           H        THR  54   7.013 -17.756 -12.817
  383    HA   THR  54           HA       THR  54   7.511 -17.302 -15.787
  384    HB   THR  54           HB       THR  54   7.168 -19.681 -14.581
  385    HG1  THR  54           HG1      THR  54   5.892 -19.428 -17.027
  386   1HG2  THR  54          1HG2      THR  54   4.923 -20.633 -14.995
  387   2HG2  THR  54          2HG2      THR  54   4.805 -19.305 -13.817
  388   3HG2  THR  54          3HG2      THR  54   4.297 -19.047 -15.506
  389    H    LYS  55           H        LYS  55   5.278 -17.459 -17.018
  390    HA   LYS  55           HA       LYS  55   3.852 -14.917 -16.268
  391   1HB   LYS  55          1HB       LYS  55   3.079 -14.800 -18.510
  392   2HB   LYS  55          2HB       LYS  55   3.126 -16.534 -18.751
  393   1HG   LYS  55          1HG       LYS  55   5.058 -14.590 -19.535
  394   2HG   LYS  55          2HG       LYS  55   5.855 -15.509 -18.271
  395   1HD   LYS  55          1HD       LYS  55   4.467 -17.347 -20.159
  396   2HD   LYS  55          2HD       LYS  55   5.490 -16.219 -21.035
  397   1HE   LYS  55          1HE       LYS  55   7.359 -16.888 -19.256
  398   2HE   LYS  55          2HE       LYS  55   6.350 -18.301 -18.961
  399   1HZ   LYS  55          1HZ       LYS  55   6.814 -19.129 -21.041
  400   2HZ   LYS  55          2HZ       LYS  55   8.199 -18.255 -20.831
  401   3HZ   LYS  55          3HZ       LYS  55   6.977 -17.653 -21.764
  402    H    GLU  56           H        GLU  56   3.269 -18.378 -16.544
  403    HA   GLU  56           HA       GLU  56   0.387 -18.488 -16.501
  404   1HB   GLU  56          1HB       GLU  56   0.877 -20.809 -15.252
  405   2HB   GLU  56          2HB       GLU  56   2.541 -20.461 -15.675
  406   1HG   GLU  56          1HG       GLU  56   0.471 -20.254 -17.904
  407   2HG   GLU  56          2HG       GLU  56   0.834 -21.857 -17.288
  408    H    GLU  57           H        GLU  57   2.758 -18.304 -13.864
  409    HA   GLU  57           HA       GLU  57   0.796 -18.599 -11.644
  410   1HB   GLU  57          1HB       GLU  57   2.553 -18.470 -10.138
  411   2HB   GLU  57          2HB       GLU  57   3.508 -17.391 -11.132
  412   1HG   GLU  57          1HG       GLU  57   3.668 -19.576 -12.766
  413   2HG   GLU  57          2HG       GLU  57   4.796 -19.291 -11.446
  414    H    LEU  58           H        LEU  58   2.572 -15.907 -13.151
  415    HA   LEU  58           HA       LEU  58   1.855 -13.781 -11.317
  416   1HB   LEU  58          1HB       LEU  58   3.032 -13.985 -14.054
  417   2HB   LEU  58          2HB       LEU  58   2.151 -12.495 -13.787
  418    HG   LEU  58           HG       LEU  58   4.293 -13.485 -11.809
  419   1HD1  LEU  58          1HD1      LEU  58   3.368 -10.593 -12.383
  420   2HD1  LEU  58          2HD1      LEU  58   2.716 -11.577 -11.065
  421   3HD1  LEU  58          3HD1      LEU  58   4.442 -11.141 -11.070
  422   1HD2  LEU  58          1HD2      LEU  58   5.997 -12.173 -13.015
  423   2HD2  LEU  58          2HD2      LEU  58   5.263 -13.327 -14.156
  424   3HD2  LEU  58          3HD2      LEU  58   4.797 -11.616 -14.208
  425    H    ASP  59           H        ASP  59   0.178 -15.243 -14.038
  426    HA   ASP  59           HA       ASP  59  -1.815 -13.338 -14.752
  427   1HB   ASP  59          1HB       ASP  59  -2.127 -16.391 -14.652
  428   2HB   ASP  59          2HB       ASP  59  -1.554 -15.436 -16.000
  429    H    ALA  60           H        ALA  60  -1.808 -15.640 -12.047
  430    HA   ALA  60           HA       ALA  60  -4.538 -15.111 -11.085
  431   1HB   ALA  60          1HB       ALA  60  -3.860 -16.407  -9.069
  432   2HB   ALA  60          2HB       ALA  60  -3.365 -17.226 -10.563
  433   3HB   ALA  60          3HB       ALA  60  -2.155 -16.366  -9.577
  434    H    ILE  61           H        ILE  61  -1.345 -13.802 -10.326
  435    HA   ILE  61           HA       ILE  61  -1.989 -12.346  -7.873
  436    HB   ILE  61           HB       ILE  61   0.312 -12.321  -9.797
  437   1HG1  ILE  61          1HG1      ILE  61   1.266 -13.471  -8.086
  438   2HG1  ILE  61          2HG1      ILE  61  -0.210 -13.323  -7.155
  439   1HG2  ILE  61          1HG2      ILE  61   1.391 -10.296  -8.777
  440   2HG2  ILE  61          2HG2      ILE  61  -0.092  -9.850  -9.618
  441   3HG2  ILE  61          3HG2      ILE  61  -0.086  -9.956  -7.843
  442   1HD1  ILE  61          1HD1      ILE  61   0.552 -11.235  -6.054
  443   2HD1  ILE  61          2HD1      ILE  61   1.761 -12.523  -5.864
  444   3HD1  ILE  61          3HD1      ILE  61   2.034 -11.224  -7.049
  445    H    ILE  62           H        ILE  62  -2.162 -11.556 -11.316
  446    HA   ILE  62           HA       ILE  62  -2.816  -8.673 -10.987
  447    HB   ILE  62           HB       ILE  62  -2.647 -10.560 -13.331
  448   1HG1  ILE  62          1HG1      ILE  62  -0.598  -9.390 -12.910
  449   2HG1  ILE  62          2HG1      ILE  62  -1.402  -7.882 -12.529
  450   1HG2  ILE  62          1HG2      ILE  62  -3.658  -8.902 -14.922
  451   2HG2  ILE  62          2HG2      ILE  62  -4.868  -9.458 -13.768
  452   3HG2  ILE  62          3HG2      ILE  62  -4.130  -7.854 -13.561
  453   1HD1  ILE  62          1HD1      ILE  62  -1.963  -7.441 -14.905
  454   2HD1  ILE  62          2HD1      ILE  62  -0.226  -7.759 -14.719
  455   3HD1  ILE  62          3HD1      ILE  62  -1.287  -9.023 -15.382
  456    H    GLU  63           H        GLU  63  -4.570 -11.715 -11.390
  457    HA   GLU  63           HA       GLU  63  -7.283 -10.745 -11.751
  458   1HB   GLU  63          1HB       GLU  63  -6.503 -13.149 -11.995
  459   2HB   GLU  63          2HB       GLU  63  -6.499 -13.300 -10.248
  460   1HG   GLU  63          1HG       GLU  63  -9.082 -12.338 -11.551
  461   2HG   GLU  63          2HG       GLU  63  -8.618 -14.009 -11.822
  462    H    GLU  64           H        GLU  64  -5.291 -11.241  -8.869
  463    HA   GLU  64           HA       GLU  64  -7.387 -10.232  -6.953
  464   1HB   GLU  64          1HB       GLU  64  -4.656 -10.502  -5.850
  465   2HB   GLU  64          2HB       GLU  64  -5.146 -11.949  -6.710
  466   1HG   GLU  64          1HG       GLU  64  -6.773 -12.515  -5.132
  467   2HG   GLU  64          2HG       GLU  64  -7.230 -10.849  -4.821
  468    H    VAL  65           H        VAL  65  -6.789  -8.391  -8.962
  469    HA   VAL  65           HA       VAL  65  -6.387  -5.922  -7.549
  470    HB   VAL  65           HB       VAL  65  -4.091  -6.456  -7.109
  471   1HG1  VAL  65          1HG1      VAL  65  -2.371  -6.941  -8.858
  472   2HG1  VAL  65          2HG1      VAL  65  -3.648  -8.172  -8.874
  473   3HG1  VAL  65          3HG1      VAL  65  -3.616  -6.914 -10.132
  474   1HG2  VAL  65          1HG2      VAL  65  -4.147  -4.357  -9.385
  475   2HG2  VAL  65          2HG2      VAL  65  -4.456  -4.048  -7.659
  476   3HG2  VAL  65          3HG2      VAL  65  -2.847  -4.561  -8.185
  477    H    ASP  66           H        ASP  66  -8.068  -7.077  -9.456
  478    HA   ASP  66           HA       ASP  66  -7.856  -5.098 -11.744
  479   1HB   ASP  66          1HB       ASP  66  -7.451  -8.001 -12.127
  480   2HB   ASP  66          2HB       ASP  66  -8.825  -7.430 -13.046
  481    H    GLU  67           H        GLU  67  -9.403  -4.386  -9.997
  482    HA   GLU  67           HA       GLU  67 -12.145  -5.581  -9.886
  483   1HB   GLU  67          1HB       GLU  67 -12.732  -3.316  -8.775
  484   2HB   GLU  67          2HB       GLU  67 -11.025  -2.924  -8.861
  485   1HG   GLU  67          1HG       GLU  67 -10.422  -4.525  -7.216
  486   2HG   GLU  67          2HG       GLU  67 -11.774  -5.584  -7.577
  487    H    ASP  68           H        ASP  68 -10.401  -3.200 -11.785
  488    HA   ASP  68           HA       ASP  68 -12.799  -2.174 -13.260
  489   1HB   ASP  68          1HB       ASP  68 -11.275  -0.468 -13.326
  490   2HB   ASP  68          2HB       ASP  68 -10.906  -1.222 -14.861
  491    H    GLY  69           H        GLY  69 -10.306  -4.624 -13.672
  492   1HA   GLY  69          1HA       GLY  69 -10.330  -6.644 -15.047
  493   2HA   GLY  69          2HA       GLY  69 -11.966  -6.212 -15.563
  494    H    SER  70           H        SER  70  -8.889  -4.434 -15.821
  495    HA   SER  70           HA       SER  70  -9.328  -3.823 -18.753
  496   1HB   SER  70          1HB       SER  70  -7.105  -2.546 -18.468
  497   2HB   SER  70          2HB       SER  70  -8.510  -1.939 -17.588
  498    HG   SER  70           HG       SER  70  -6.383  -2.263 -16.487
  499    H    GLY  71           H        GLY  71  -7.011  -5.541 -16.643
  500   1HA   GLY  71          1HA       GLY  71  -6.115  -7.276 -19.023
  501   2HA   GLY  71          2HA       GLY  71  -6.219  -7.869 -17.357
  502    H    THR  72           H        THR  72  -4.935  -4.758 -18.448
  503    HA   THR  72           HA       THR  72  -2.126  -5.555 -17.535
  504    HB   THR  72           HB       THR  72  -1.651  -3.229 -18.894
  505    HG1  THR  72           HG1      THR  72  -3.933  -3.308 -19.486
  506   1HG2  THR  72          1HG2      THR  72  -0.859  -4.542 -20.817
  507   2HG2  THR  72          2HG2      THR  72  -0.409  -5.390 -19.321
  508   3HG2  THR  72          3HG2      THR  72  -1.775  -5.976 -20.305
  509    H    ILE  73           H        ILE  73  -1.016  -3.128 -17.107
  510    HA   ILE  73           HA       ILE  73  -2.672  -1.751 -14.931
  511    HB   ILE  73           HB       ILE  73   0.218  -2.705 -14.606
  512   1HG1  ILE  73          1HG1      ILE  73  -1.036  -4.605 -14.008
  513   2HG1  ILE  73          2HG1      ILE  73  -0.871  -3.797 -12.463
  514   1HG2  ILE  73          1HG2      ILE  73   0.245  -1.592 -12.377
  515   2HG2  ILE  73          2HG2      ILE  73  -0.079  -0.389 -13.633
  516   3HG2  ILE  73          3HG2      ILE  73  -1.409  -0.980 -12.608
  517   1HD1  ILE  73          1HD1      ILE  73  -3.416  -3.716 -14.187
  518   2HD1  ILE  73          2HD1      ILE  73  -3.161  -4.602 -12.668
  519   3HD1  ILE  73          3HD1      ILE  73  -3.190  -2.822 -12.659
  520    H    ASP  74           H        ASP  74  -3.086  -0.224 -16.559
  521    HA   ASP  74           HA       ASP  74  -1.024   1.248 -18.052
  522   1HB   ASP  74          1HB       ASP  74  -3.638   2.650 -17.484
  523   2HB   ASP  74          2HB       ASP  74  -2.696   2.569 -18.955
  524    H    PHE  75           H        PHE  75  -1.050   3.780 -17.760
  525    HA   PHE  75           HA       PHE  75   0.331   4.403 -15.233
  526   1HB   PHE  75          1HB       PHE  75   0.793   5.483 -17.515
  527   2HB   PHE  75          2HB       PHE  75  -0.681   6.399 -17.347
  528    HD1  PHE  75           HD1      PHE  75   1.989   7.710 -17.699
  529    HD2  PHE  75           HD2      PHE  75   0.012   6.542 -14.059
  530    HE1  PHE  75           HE1      PHE  75   3.093   9.551 -16.496
  531    HE2  PHE  75           HE2      PHE  75   1.122   8.395 -12.876
  532    HZ   PHE  75           HZ       PHE  75   2.643   9.912 -14.092
  533    H    GLU  76           H        GLU  76  -2.882   5.059 -16.568
  534    HA   GLU  76           HA       GLU  76  -3.844   6.945 -14.555
  535   1HB   GLU  76          1HB       GLU  76  -4.822   6.457 -16.899
  536   2HB   GLU  76          2HB       GLU  76  -5.879   6.936 -15.589
  537   1HG   GLU  76          1HG       GLU  76  -5.539   3.956 -16.214
  538   2HG   GLU  76          2HG       GLU  76  -6.861   4.761 -15.395
  539    H    GLU  77           H        GLU  77  -3.743   3.441 -14.697
  540    HA   GLU  77           HA       GLU  77  -5.496   3.038 -12.274
  541   1HB   GLU  77          1HB       GLU  77  -5.791   1.409 -14.000
  542   2HB   GLU  77          2HB       GLU  77  -4.077   1.095 -14.139
  543   1HG   GLU  77          1HG       GLU  77  -5.609   0.442 -11.552
  544   2HG   GLU  77          2HG       GLU  77  -4.011  -0.131 -12.016
  545    H    PHE  78           H        PHE  78  -2.093   3.042 -13.138
  546    HA   PHE  78           HA       PHE  78  -0.979   1.805 -10.745
  547   1HB   PHE  78          1HB       PHE  78   0.325   3.905 -12.589
  548   2HB   PHE  78          2HB       PHE  78   0.319   2.185 -12.882
  549    HD1  PHE  78           HD1      PHE  78   1.856   0.693 -11.560
  550    HD2  PHE  78           HD2      PHE  78   1.651   4.898 -10.673
  551    HE1  PHE  78           HE1      PHE  78   3.918   0.523 -10.226
  552    HE2  PHE  78           HE2      PHE  78   3.697   4.703  -9.319
  553    HZ   PHE  78           HZ       PHE  78   4.834   2.521  -9.093
  554    H    LEU  79           H        LEU  79  -2.015   5.080 -11.507
  555    HA   LEU  79           HA       LEU  79  -0.817   6.463  -9.191
  556   1HB   LEU  79          1HB       LEU  79  -2.743   8.212  -9.767
  557   2HB   LEU  79          2HB       LEU  79  -3.016   7.214 -11.178
  558    HG   LEU  79           HG       LEU  79  -0.484   7.541 -11.749
  559   1HD1  LEU  79          1HD1      LEU  79  -0.928   9.726 -12.870
  560   2HD1  LEU  79          2HD1      LEU  79  -2.331   8.651 -13.020
  561   3HD1  LEU  79          3HD1      LEU  79  -2.363   9.991 -11.846
  562   1HD2  LEU  79          1HD2      LEU  79  -0.763   9.831  -9.688
  563   2HD2  LEU  79          2HD2      LEU  79   0.330   8.431  -9.559
  564   3HD2  LEU  79          3HD2      LEU  79   0.584   9.628 -10.837
  565    H    VAL  80           H        VAL  80  -4.027   5.087  -9.869
  566    HA   VAL  80           HA       VAL  80  -5.308   5.855  -7.315
  567    HB   VAL  80           HB       VAL  80  -6.089   4.212  -9.675
  568   1HG1  VAL  80          1HG1      VAL  80  -7.830   5.982  -7.847
  569   2HG1  VAL  80          2HG1      VAL  80  -6.859   6.630  -9.175
  570   3HG1  VAL  80          3HG1      VAL  80  -8.166   5.475  -9.523
  571   1HG2  VAL  80          1HG2      VAL  80  -7.943   2.995  -8.629
  572   2HG2  VAL  80          2HG2      VAL  80  -6.457   2.504  -7.784
  573   3HG2  VAL  80          3HG2      VAL  80  -7.562   3.656  -7.020
  574    H    MET  81           H        MET  81  -3.327   3.182  -8.449
  575    HA   MET  81           HA       MET  81  -3.721   1.242  -6.311
  576   1HB   MET  81          1HB       MET  81  -2.235   1.205  -8.628
  577   2HB   MET  81          2HB       MET  81  -0.947   1.454  -7.464
  578   1HG   MET  81          1HG       MET  81  -1.842  -0.615  -6.162
  579   2HG   MET  81          2HG       MET  81  -1.089  -0.924  -7.735
  580   1HE   MET  81          1HE       MET  81  -2.052  -2.451  -9.371
  581   2HE   MET  81          2HE       MET  81  -3.755  -2.423  -9.918
  582   3HE   MET  81          3HE       MET  81  -2.730  -0.975 -10.129
  583    H    MET  82           H        MET  82  -1.177   3.728  -6.716
  584    HA   MET  82           HA       MET  82   0.148   3.245  -4.137
  585   1HB   MET  82          1HB       MET  82   0.336   5.432  -6.237
  586   2HB   MET  82          2HB       MET  82   1.039   5.737  -4.660
  587   1HG   MET  82          1HG       MET  82   2.433   4.585  -6.692
  588   2HG   MET  82          2HG       MET  82   1.757   3.102  -6.006
  589   1HE   MET  82          1HE       MET  82   4.210   2.104  -5.288
  590   2HE   MET  82          2HE       MET  82   5.442   3.143  -4.513
  591   3HE   MET  82          3HE       MET  82   4.860   3.529  -6.159
  592    H    VAL  83           H        VAL  83  -2.466   5.353  -5.198
  593    HA   VAL  83           HA       VAL  83  -2.522   7.159  -2.867
  594    HB   VAL  83           HB       VAL  83  -4.062   6.877  -5.352
  595   1HG1  VAL  83          1HG1      VAL  83  -6.201   7.915  -4.578
  596   2HG1  VAL  83          2HG1      VAL  83  -5.997   6.307  -3.870
  597   3HG1  VAL  83          3HG1      VAL  83  -5.691   7.752  -2.878
  598   1HG2  VAL  83          1HG2      VAL  83  -3.622   9.313  -3.500
  599   2HG2  VAL  83          2HG2      VAL  83  -2.601   8.864  -4.886
  600   3HG2  VAL  83          3HG2      VAL  83  -4.277   9.363  -5.157
  601    NH1  ARG  84           NH1      ARG  84 -10.437   0.526  -3.158
  602    NH2  ARG  84           NH2      ARG  84  -9.690  -1.616  -3.041
  603    H    ARG  84           H        ARG  84  -4.057   4.103  -3.724
  604    HA   ARG  84           HA       ARG  84  -6.122   4.036  -1.575
  605   1HB   ARG  84          1HB       ARG  84  -5.183   2.193  -3.745
  606   2HB   ARG  84          2HB       ARG  84  -5.681   1.367  -2.275
  607   1HG   ARG  84          1HG       ARG  84  -7.909   2.480  -2.314
  608   2HG   ARG  84          2HG       ARG  84  -7.455   3.419  -3.738
  609   1HD   ARG  84          1HD       ARG  84  -6.954   1.036  -4.850
  610   2HD   ARG  84          2HD       ARG  84  -8.609   1.646  -4.781
  611    HE   ARG  84           HE       ARG  84  -7.451  -0.480  -2.907
  612   1HH1  ARG  84          1HH1      ARG  84  -8.895  -2.262  -3.100
  613   2HH1  ARG  84          2HH1      ARG  84 -10.671  -1.863  -2.868
  614   1HH2  ARG  84          1HH2      ARG  84 -10.218   1.510  -3.348
  615   2HH2  ARG  84          2HH2      ARG  84 -11.356   0.134  -2.927
  616    H    GLN  85           H        GLN  85  -2.794   2.916  -1.984
  617    HA   GLN  85           HA       GLN  85  -2.672   1.172   0.414
  618   1HB   GLN  85          1HB       GLN  85  -0.577   2.283  -1.506
  619   2HB   GLN  85          2HB       GLN  85  -0.074   1.532  -0.003
  620   1HG   GLN  85          1HG       GLN  85  -1.978  -0.293  -1.163
  621   2HG   GLN  85          2HG       GLN  85  -0.996   0.266  -2.499
  622   1HE2  GLN  85          1HE2      GLN  85   2.081  -1.031  -0.616
  623   2HE2  GLN  85          2HE2      GLN  85   1.457   0.669  -0.911
  624    H    MET  86           H        MET  86  -2.034   4.561  -0.303
  625    HA   MET  86           HA       MET  86  -0.449   5.388   1.966
  626   1HB   MET  86          1HB       MET  86  -0.610   7.447   1.081
  627   2HB   MET  86          2HB       MET  86  -1.490   6.685  -0.230
  628   1HG   MET  86          1HG       MET  86  -3.047   7.694   2.214
  629   2HG   MET  86          2HG       MET  86  -3.657   7.285   0.605
  630   1HE   MET  86          1HE       MET  86  -4.897   9.486  -0.025
  631   2HE   MET  86          2HE       MET  86  -3.936  10.677  -0.950
  632   3HE   MET  86          3HE       MET  86  -3.869   8.945  -1.388
  633    H    LYS  87           H        LYS  87  -3.990   5.276   1.548
  634    HA   LYS  87           HA       LYS  87  -4.731   6.331   4.201
  635   1HB   LYS  87          1HB       LYS  87  -6.996   5.096   3.711
  636   2HB   LYS  87          2HB       LYS  87  -6.300   4.680   2.152
  637   1HG   LYS  87          1HG       LYS  87  -6.410   6.831   1.305
  638   2HG   LYS  87          2HG       LYS  87  -6.141   7.614   2.853
  639   1HD   LYS  87          1HD       LYS  87  -8.739   6.171   2.820
  640   2HD   LYS  87          2HD       LYS  87  -8.367   7.834   3.261
  641   1HE   LYS  87          1HE       LYS  87  -8.126   8.150   0.557
  642   2HE   LYS  87          2HE       LYS  87  -9.191   6.738   0.533
  643   1HZ   LYS  87          1HZ       LYS  87 -10.104   9.204   0.740
  644   2HZ   LYS  87          2HZ       LYS  87  -9.952   8.897   2.356
  645   3HZ   LYS  87          3HZ       LYS  87 -10.900   7.924   1.416
  646    H    GLU  88           H        GLU  88  -5.344   5.267   6.042
  647    HA   GLU  88           HA       GLU  88  -4.122   2.530   6.494
  648   1HB   GLU  88          1HB       GLU  88  -4.019   4.798   8.027
  649   2HB   GLU  88          2HB       GLU  88  -5.386   4.010   8.791
  650   1HG   GLU  88          1HG       GLU  88  -2.780   3.586   9.524
  651   2HG   GLU  88          2HG       GLU  88  -2.902   2.310   8.325
  652    H    ASP  89           H        ASP  89  -7.205   4.243   6.509
  653    HA   ASP  89           HA       ASP  89  -8.718   1.607   6.907
  654   1HB   ASP  89          1HB       ASP  89  -9.110   2.690   8.971
  655   2HB   ASP  89          2HB       ASP  89  -9.221   4.283   8.259
  656    H    ALA  90           H        ALA  90  -9.958   4.857   6.285
  657    HA   ALA  90           HA       ALA  90 -10.339   4.863   3.413
  658   1HB   ALA  90          1HB       ALA  90 -12.684   4.012   3.154
  659   2HB   ALA  90          2HB       ALA  90 -11.603   2.716   3.701
  660   3HB   ALA  90          3HB       ALA  90 -12.715   3.490   4.857
   
  Start of MODEL          34
 Raw file had  660 H/Q atoms
  Start of MODEL   34
    1   1H    ALA   1          1H        ALA   1 -21.603  10.589 -15.522
    2   2H    ALA   1          2H        ALA   1 -22.303  10.816 -17.034
    3   3H    ALA   1          3H        ALA   1 -21.527   9.368 -16.676
    4    HA   ALA   1           HA       ALA   1 -20.396  11.209 -18.099
    5   1HB   ALA   1          1HB       ALA   1 -20.365  12.258 -15.276
    6   2HB   ALA   1          2HB       ALA   1 -20.279  13.137 -16.815
    7   3HB   ALA   1          3HB       ALA   1 -18.814  12.378 -16.140
    8    H    SER   2           H        SER   2 -18.957   9.862 -18.899
    9    HA   SER   2           HA       SER   2 -17.135   8.307 -19.138
   10   1HB   SER   2          1HB       SER   2 -16.583   9.742 -16.593
   11   2HB   SER   2          2HB       SER   2 -15.850   8.137 -16.661
   12    HG   SER   2           HG       SER   2 -14.830  10.149 -17.669
   13    H    MET   3           H        MET   3 -16.296   6.215 -18.172
   14    HA   MET   3           HA       MET   3 -18.610   4.597 -16.976
   15   1HB   MET   3          1HB       MET   3 -16.357   3.513 -18.757
   16   2HB   MET   3          2HB       MET   3 -17.752   2.625 -18.172
   17   1HG   MET   3          1HG       MET   3 -18.709   3.145 -20.188
   18   2HG   MET   3          2HG       MET   3 -18.991   4.755 -19.512
   19   1HE   MET   3          1HE       MET   3 -18.484   6.168 -22.389
   20   2HE   MET   3          2HE       MET   3 -17.253   7.110 -21.497
   21   3HE   MET   3          3HE       MET   3 -18.712   6.523 -20.647
   22    H    THR   4           H        THR   4 -18.194   4.501 -14.872
   23    HA   THR   4           HA       THR   4 -17.178   4.020 -12.784
   24    HB   THR   4           HB       THR   4 -16.838   1.875 -12.898
   25    HG1  THR   4           HG1      THR   4 -14.235   2.143 -13.823
   26   1HG2  THR   4          1HG2      THR   4 -17.074   1.921 -15.539
   27   2HG2  THR   4          2HG2      THR   4 -16.345   0.497 -14.762
   28   3HG2  THR   4          3HG2      THR   4 -15.309   1.718 -15.546
   29    H    ASP   5           H        ASP   5 -16.381   5.976 -12.238
   30    HA   ASP   5           HA       ASP   5 -13.652   6.927 -13.104
   31   1HB   ASP   5          1HB       ASP   5 -14.119   8.997 -12.188
   32   2HB   ASP   5          2HB       ASP   5 -15.052   8.355 -10.857
   33    H    GLN   6           H        GLN   6 -12.680   4.939 -12.319
   34    HA   GLN   6           HA       GLN   6 -12.314   4.532  -9.340
   35   1HB   GLN   6          1HB       GLN   6 -12.319   2.697 -11.295
   36   2HB   GLN   6          2HB       GLN   6 -11.405   2.508  -9.811
   37   1HG   GLN   6          1HG       GLN   6  -9.740   1.924 -11.279
   38   2HG   GLN   6          2HG       GLN   6  -9.406   3.641 -11.229
   39   1HE2  GLN   6          1HE2      GLN   6  -9.677   2.340 -14.847
   40   2HE2  GLN   6          2HE2      GLN   6  -8.698   1.892 -13.360
   41    H    GLN   7           H        GLN   7 -10.656   5.860 -12.159
   42    HA   GLN   7           HA       GLN   7  -8.151   6.591 -10.581
   43   1HB   GLN   7          1HB       GLN   7  -7.725   5.622 -12.792
   44   2HB   GLN   7          2HB       GLN   7  -7.206   7.305 -12.754
   45   1HG   GLN   7          1HG       GLN   7  -8.548   6.338 -14.855
   46   2HG   GLN   7          2HG       GLN   7  -9.976   6.661 -13.884
   47   1HE2  GLN   7          1HE2      GLN   7  -9.855  10.146 -14.720
   48   2HE2  GLN   7          2HE2      GLN   7 -10.797   8.688 -14.126
   49    H    ALA   8           H        ALA   8 -10.940   7.839 -10.335
   50    HA   ALA   8           HA       ALA   8 -10.568  10.689 -11.263
   51   1HB   ALA   8          1HB       ALA   8 -12.836  11.064 -10.305
   52   2HB   ALA   8          2HB       ALA   8 -12.823   9.680 -11.415
   53   3HB   ALA   8          3HB       ALA   8 -12.870   9.407  -9.655
   54    H    GLU   9           H        GLU   9 -10.546   8.766  -8.289
   55    HA   GLU   9           HA       GLU   9 -10.320  11.059  -6.402
   56   1HB   GLU   9          1HB       GLU   9 -10.408   9.543  -4.638
   57   2HB   GLU   9          2HB       GLU   9 -11.317   8.708  -5.889
   58   1HG   GLU   9          1HG       GLU   9  -9.475   7.170  -6.391
   59   2HG   GLU   9          2HG       GLU   9  -8.335   8.089  -5.414
   60    H    ALA  10           H        ALA  10  -8.105   8.827  -7.995
   61    HA   ALA  10           HA       ALA  10  -5.703   9.391  -6.381
   62   1HB   ALA  10          1HB       ALA  10  -4.468   8.172  -8.167
   63   2HB   ALA  10          2HB       ALA  10  -5.929   7.293  -7.677
   64   3HB   ALA  10          3HB       ALA  10  -5.905   8.190  -9.217
   65    NH1  ARG  11           NH1      ARG  11  -6.539  12.323 -16.314
   66    NH2  ARG  11           NH2      ARG  11  -7.941  13.927 -15.525
   67    H    ARG  11           H        ARG  11  -7.064  10.710  -9.366
   68    HA   ARG  11           HA       ARG  11  -4.702  12.382 -10.138
   69   1HB   ARG  11          1HB       ARG  11  -7.431  11.826 -11.270
   70   2HB   ARG  11          2HB       ARG  11  -6.846  13.461 -11.537
   71   1HG   ARG  11          1HG       ARG  11  -5.131  12.834 -12.957
   72   2HG   ARG  11          2HG       ARG  11  -4.821  11.303 -12.133
   73   1HD   ARG  11          1HD       ARG  11  -5.762  10.836 -14.364
   74   2HD   ARG  11          2HD       ARG  11  -6.915  10.302 -13.139
   75    HE   ARG  11           HE       ARG  11  -8.397  12.198 -13.756
   76   1HH1  ARG  11          1HH1      ARG  11  -8.528  14.262 -14.753
   77   2HH1  ARG  11          2HH1      ARG  11  -7.793  14.386 -16.430
   78   1HH2  ARG  11          1HH2      ARG  11  -6.046  11.440 -16.142
   79   2HH2  ARG  11          2HH2      ARG  11  -6.500  12.892 -17.168
   80    H    ALA  12           H        ALA  12  -7.782  12.821  -8.462
   81    HA   ALA  12           HA       ALA  12  -7.691  15.779  -8.189
   82   1HB   ALA  12          1HB       ALA  12  -9.538  15.481  -6.551
   83   2HB   ALA  12          2HB       ALA  12  -9.840  14.559  -8.037
   84   3HB   ALA  12          3HB       ALA  12  -9.304  13.716  -6.562
   85    H    PHE  13           H        PHE  13  -6.479  13.011  -6.383
   86    HA   PHE  13           HA       PHE  13  -5.839  14.315  -3.853
   87   1HB   PHE  13          1HB       PHE  13  -6.045  11.827  -4.246
   88   2HB   PHE  13          2HB       PHE  13  -4.514  11.824  -5.082
   89    HD1  PHE  13           HD1      PHE  13  -5.334  10.286  -2.481
   90    HD2  PHE  13           HD2      PHE  13  -3.240  14.004  -3.050
   91    HE1  PHE  13           HE1      PHE  13  -4.171   9.974  -0.334
   92    HE2  PHE  13           HE2      PHE  13  -2.087  13.672  -0.903
   93    HZ   PHE  13           HZ       PHE  13  -2.549  11.662   0.459
   94    H    LEU  14           H        LEU  14  -3.766  13.428  -6.635
   95    HA   LEU  14           HA       LEU  14  -1.711  15.567  -5.824
   96   1HB   LEU  14          1HB       LEU  14  -0.336  13.783  -5.519
   97   2HB   LEU  14          2HB       LEU  14  -0.145  13.891  -7.255
   98    HG   LEU  14           HG       LEU  14  -2.229  12.021  -5.985
   99   1HD1  LEU  14          1HD1      LEU  14  -2.106  10.825  -8.172
  100   2HD1  LEU  14          2HD1      LEU  14  -2.573  12.519  -8.410
  101   3HD1  LEU  14          3HD1      LEU  14  -0.910  11.999  -8.778
  102   1HD2  LEU  14          1HD2      LEU  14   0.690  11.308  -6.724
  103   2HD2  LEU  14          2HD2      LEU  14   0.000  11.332  -5.082
  104   3HD2  LEU  14          3HD2      LEU  14  -0.579  10.145  -6.261
  105    H    SER  15           H        SER  15  -1.288  17.039  -7.286
  106    HA   SER  15           HA       SER  15  -2.852  17.274  -9.788
  107   1HB   SER  15          1HB       SER  15  -0.491  19.098  -9.267
  108   2HB   SER  15          2HB       SER  15  -2.091  19.467  -9.917
  109    HG   SER  15           HG       SER  15  -2.941  19.418  -7.940
  110    H    GLU  16           H        GLU  16  -0.859  18.501 -11.426
  111    HA   GLU  16           HA       GLU  16   0.217  16.110 -12.843
  112   1HB   GLU  16          1HB       GLU  16  -0.714  17.802 -14.235
  113   2HB   GLU  16          2HB       GLU  16   0.204  19.092 -13.484
  114   1HG   GLU  16          1HG       GLU  16   2.328  17.695 -14.457
  115   2HG   GLU  16          2HG       GLU  16   1.116  17.026 -15.537
  116    H    GLU  17           H        GLU  17   1.446  18.753 -10.885
  117    HA   GLU  17           HA       GLU  17   4.262  18.714 -11.419
  118   1HB   GLU  17          1HB       GLU  17   4.610  19.396  -8.947
  119   2HB   GLU  17          2HB       GLU  17   2.872  19.271  -8.751
  120   1HG   GLU  17          1HG       GLU  17   4.062  21.048 -10.961
  121   2HG   GLU  17          2HG       GLU  17   2.449  21.117 -10.273
  122    H    MET  18           H        MET  18   2.365  16.632  -9.251
  123    HA   MET  18           HA       MET  18   4.727  15.065  -8.256
  124   1HB   MET  18          1HB       MET  18   1.799  14.260  -7.853
  125   2HB   MET  18          2HB       MET  18   3.199  13.802  -6.901
  126   1HG   MET  18          1HG       MET  18   2.119  16.690  -7.037
  127   2HG   MET  18          2HG       MET  18   1.712  15.519  -5.772
  128   1HE   MET  18          1HE       MET  18   2.819  15.741  -3.547
  129   2HE   MET  18          2HE       MET  18   4.157  16.898  -3.285
  130   3HE   MET  18          3HE       MET  18   2.631  17.455  -4.034
  131    H    ILE  19           H        ILE  19   2.142  14.765 -10.633
  132    HA   ILE  19           HA       ILE  19   2.253  11.945 -11.249
  133    HB   ILE  19           HB       ILE  19   1.315  14.358 -12.801
  134   1HG1  ILE  19          1HG1      ILE  19   0.039  12.651 -11.022
  135   2HG1  ILE  19          2HG1      ILE  19  -0.335  11.836 -12.526
  136   1HG2  ILE  19          1HG2      ILE  19   0.697  12.987 -14.807
  137   2HG2  ILE  19          2HG2      ILE  19   2.448  13.012 -14.604
  138   3HG2  ILE  19          3HG2      ILE  19   1.528  11.568 -14.122
  139   1HD1  ILE  19          1HD1      ILE  19  -1.462  13.832 -13.469
  140   2HD1  ILE  19          2HD1      ILE  19  -2.139  13.424 -11.879
  141   3HD1  ILE  19          3HD1      ILE  19  -1.014  14.793 -12.034
  142    H    ALA  20           H        ALA  20   4.300  14.649 -12.218
  143    HA   ALA  20           HA       ALA  20   5.755  13.424 -14.432
  144   1HB   ALA  20          1HB       ALA  20   7.414  15.254 -14.102
  145   2HB   ALA  20          2HB       ALA  20   5.750  15.869 -14.055
  146   3HB   ALA  20          3HB       ALA  20   6.673  15.684 -12.542
  147    H    GLU  21           H        GLU  21   6.351  13.541 -10.931
  148    HA   GLU  21           HA       GLU  21   9.008  12.371 -10.830
  149   1HB   GLU  21          1HB       GLU  21   6.787  12.762  -8.838
  150   2HB   GLU  21          2HB       GLU  21   8.435  13.357  -8.823
  151   1HG   GLU  21          1HG       GLU  21   7.713  10.401  -8.300
  152   2HG   GLU  21          2HG       GLU  21   9.292  11.138  -8.091
  153    H    PHE  22           H        PHE  22   5.779  10.976 -11.041
  154    HA   PHE  22           HA       PHE  22   6.605   8.146 -10.582
  155   1HB   PHE  22          1HB       PHE  22   3.942   9.333 -11.573
  156   2HB   PHE  22          2HB       PHE  22   4.213   7.627 -11.340
  157    HD1  PHE  22           HD1      PHE  22   2.938  10.490  -9.728
  158    HD2  PHE  22           HD2      PHE  22   5.306   6.996  -8.882
  159    HE1  PHE  22           HE1      PHE  22   2.410  10.698  -7.335
  160    HE2  PHE  22           HE2      PHE  22   4.763   7.221  -6.492
  161    HZ   PHE  22           HZ       PHE  22   3.327   9.075  -5.713
  162    H    LYS  23           H        LYS  23   6.068  10.283 -13.319
  163    HA   LYS  23           HA       LYS  23   5.725   8.533 -15.558
  164   1HB   LYS  23          1HB       LYS  23   7.139  11.228 -15.307
  165   2HB   LYS  23          2HB       LYS  23   7.277  10.336 -16.806
  166   1HG   LYS  23          1HG       LYS  23   4.612  11.215 -15.534
  167   2HG   LYS  23          2HG       LYS  23   4.769  10.306 -17.027
  168   1HD   LYS  23          1HD       LYS  23   5.436  13.230 -16.508
  169   2HD   LYS  23          2HD       LYS  23   4.498  12.517 -17.825
  170   1HE   LYS  23          1HE       LYS  23   7.534  12.732 -17.547
  171   2HE   LYS  23          2HE       LYS  23   6.882  11.377 -18.480
  172   1HZ   LYS  23          1HZ       LYS  23   6.966  12.951 -20.098
  173   2HZ   LYS  23          2HZ       LYS  23   6.790  14.237 -19.076
  174   3HZ   LYS  23          3HZ       LYS  23   5.468  13.360 -19.535
  175    H    ALA  24           H        ALA  24   8.705   9.454 -13.860
  176    HA   ALA  24           HA       ALA  24  10.686   8.312 -15.658
  177   1HB   ALA  24          1HB       ALA  24  12.246   8.409 -13.724
  178   2HB   ALA  24          2HB       ALA  24  11.297   9.901 -13.860
  179   3HB   ALA  24          3HB       ALA  24  10.892   8.702 -12.606
  180    H    ALA  25           H        ALA  25   9.259   6.968 -12.660
  181    HA   ALA  25           HA       ALA  25  10.603   4.327 -12.889
  182   1HB   ALA  25          1HB       ALA  25   9.292   3.734 -10.860
  183   2HB   ALA  25          2HB       ALA  25  10.072   5.316 -10.676
  184   3HB   ALA  25          3HB       ALA  25   8.324   5.220 -11.007
  185    H    PHE  26           H        PHE  26   7.792   5.679 -14.305
  186    HA   PHE  26           HA       PHE  26   5.938   3.384 -14.290
  187   1HB   PHE  26          1HB       PHE  26   4.894   5.466 -14.715
  188   2HB   PHE  26          2HB       PHE  26   6.058   5.965 -15.913
  189    HD1  PHE  26           HD1      PHE  26   3.057   3.840 -15.274
  190    HD2  PHE  26           HD2      PHE  26   5.836   5.146 -18.287
  191    HE1  PHE  26           HE1      PHE  26   1.520   3.076 -17.039
  192    HE2  PHE  26           HE2      PHE  26   4.286   4.376 -20.038
  193    HZ   PHE  26           HZ       PHE  26   2.144   3.312 -19.418
  194    H    ASP  27           H        ASP  27   8.286   4.656 -16.661
  195    HA   ASP  27           HA       ASP  27   7.900   2.516 -18.667
  196   1HB   ASP  27          1HB       ASP  27   8.733   4.624 -19.489
  197   2HB   ASP  27          2HB       ASP  27   9.937   3.393 -19.790
  198    H    MET  28           H        MET  28  10.023   3.036 -15.913
  199    HA   MET  28           HA       MET  28  12.008   0.941 -16.335
  200   1HB   MET  28          1HB       MET  28  11.924   2.807 -14.449
  201   2HB   MET  28          2HB       MET  28  11.027   1.613 -13.527
  202   1HG   MET  28          1HG       MET  28  13.044  -0.031 -13.997
  203   2HG   MET  28          2HG       MET  28  13.930   1.420 -14.497
  204   1HE   MET  28          1HE       MET  28  11.765   3.262 -12.376
  205   2HE   MET  28          2HE       MET  28  12.949   3.609 -11.081
  206   3HE   MET  28          3HE       MET  28  13.416   3.822 -12.794
  207    H    PHE  29           H        PHE  29   8.771   0.925 -14.903
  208    HA   PHE  29           HA       PHE  29   8.828  -1.890 -13.941
  209   1HB   PHE  29          1HB       PHE  29   6.267  -0.281 -14.452
  210   2HB   PHE  29          2HB       PHE  29   7.306   0.094 -13.104
  211    HD1  PHE  29           HD1      PHE  29   8.062  -3.125 -12.878
  212    HD2  PHE  29           HD2      PHE  29   4.442  -0.798 -12.772
  213    HE1  PHE  29           HE1      PHE  29   6.958  -4.881 -11.554
  214    HE2  PHE  29           HE2      PHE  29   3.356  -2.570 -11.455
  215    HZ   PHE  29           HZ       PHE  29   4.602  -4.615 -10.856
  216    H    ASP  30           H        ASP  30   7.798  -0.163 -16.839
  217    HA   ASP  30           HA       ASP  30   6.386  -2.477 -18.088
  218   1HB   ASP  30          1HB       ASP  30   5.501  -0.323 -18.660
  219   2HB   ASP  30          2HB       ASP  30   7.064   0.320 -19.107
  220    H    ALA  31           H        ALA  31   8.613  -0.705 -20.093
  221    HA   ALA  31           HA       ALA  31  11.021  -2.204 -20.133
  222   1HB   ALA  31          1HB       ALA  31  10.687  -4.051 -21.781
  223   2HB   ALA  31          2HB       ALA  31   9.713  -4.289 -20.317
  224   3HB   ALA  31          3HB       ALA  31   8.936  -3.736 -21.823
  225    H    ASP  32           H        ASP  32   8.375  -1.126 -22.238
  226    HA   ASP  32           HA       ASP  32  10.220  -0.344 -24.498
  227   1HB   ASP  32          1HB       ASP  32   7.331   0.449 -24.709
  228   2HB   ASP  32          2HB       ASP  32   8.417  -0.220 -25.906
  229    H    GLY  33           H        GLY  33   7.891   1.245 -22.296
  230   1HA   GLY  33          1HA       GLY  33   8.564   3.367 -21.035
  231   2HA   GLY  33          2HA       GLY  33   9.571   3.783 -22.403
  232    H    GLY  34           H        GLY  34   6.172   3.138 -21.521
  233   1HA   GLY  34          1HA       GLY  34   4.386   4.937 -21.744
  234   2HA   GLY  34          2HA       GLY  34   5.277   5.582 -23.128
  235    H    GLY  35           H        GLY  35   3.635   2.613 -22.047
  236   1HA   GLY  35          1HA       GLY  35   1.860   2.345 -24.395
  237   2HA   GLY  35          2HA       GLY  35   3.285   1.325 -24.631
  238    H    ASP  36           H        ASP  36   1.657   2.132 -21.586
  239    HA   ASP  36           HA       ASP  36   0.581   0.796 -19.898
  240   1HB   ASP  36          1HB       ASP  36  -0.918   0.255 -21.977
  241   2HB   ASP  36          2HB       ASP  36  -1.054  -0.704 -20.522
  242    H    ILE  37           H        ILE  37   0.616  -1.607 -19.073
  243    HA   ILE  37           HA       ILE  37   3.306  -2.954 -19.567
  244    HB   ILE  37           HB       ILE  37   2.357  -2.782 -16.710
  245   1HG1  ILE  37          1HG1      ILE  37   4.265  -0.646 -17.841
  246   2HG1  ILE  37          2HG1      ILE  37   2.560  -0.354 -17.558
  247   1HG2  ILE  37          1HG2      ILE  37   4.711  -3.271 -16.170
  248   2HG2  ILE  37          2HG2      ILE  37   4.115  -4.440 -17.356
  249   3HG2  ILE  37          3HG2      ILE  37   5.184  -3.117 -17.880
  250   1HD1  ILE  37          1HD1      ILE  37   4.595  -1.055 -15.357
  251   2HD1  ILE  37          2HD1      ILE  37   3.814   0.514 -15.654
  252   3HD1  ILE  37          3HD1      ILE  37   2.840  -0.865 -15.094
  253    H    SER  38           H        SER  38   2.997  -4.949 -20.111
  254    HA   SER  38           HA       SER  38   0.374  -6.367 -19.695
  255   1HB   SER  38          1HB       SER  38   2.878  -6.921 -21.304
  256   2HB   SER  38          2HB       SER  38   1.849  -8.289 -20.872
  257    HG   SER  38           HG       SER  38   0.537  -7.660 -22.319
  258    H    THR  39           H        THR  39   1.021  -8.917 -19.260
  259    HA   THR  39           HA       THR  39   1.749  -9.007 -16.350
  260    HB   THR  39           HB       THR  39   1.396 -11.669 -17.057
  261    HG1  THR  39           HG1      THR  39  -0.415 -11.664 -18.372
  262   1HG2  THR  39          1HG2      THR  39  -0.842 -11.531 -16.055
  263   2HG2  THR  39          2HG2      THR  39   0.263 -10.493 -15.124
  264   3HG2  THR  39          3HG2      THR  39  -0.897  -9.766 -16.268
  265    H    LYS  40           H        LYS  40   2.997 -10.280 -19.434
  266    HA   LYS  40           HA       LYS  40   5.267 -11.768 -18.473
  267   1HB   LYS  40          1HB       LYS  40   5.616 -12.192 -20.619
  268   2HB   LYS  40          2HB       LYS  40   6.015 -10.541 -21.013
  269   1HG   LYS  40          1HG       LYS  40   3.159 -11.724 -20.866
  270   2HG   LYS  40          2HG       LYS  40   3.536 -10.109 -21.404
  271   1HD   LYS  40          1HD       LYS  40   5.059 -11.733 -23.194
  272   2HD   LYS  40          2HD       LYS  40   3.638 -12.678 -22.857
  273   1HE   LYS  40          1HE       LYS  40   2.428 -10.239 -23.360
  274   2HE   LYS  40          2HE       LYS  40   3.797 -10.156 -24.461
  275   1HZ   LYS  40          1HZ       LYS  40   2.257 -12.662 -24.427
  276   2HZ   LYS  40          2HZ       LYS  40   2.954 -11.877 -25.702
  277   3HZ   LYS  40          3HZ       LYS  40   1.522 -11.336 -25.083
  278    H    GLU  41           H        GLU  41   4.782  -8.322 -19.048
  279    HA   GLU  41           HA       GLU  41   7.634  -7.510 -18.733
  280   1HB   GLU  41          1HB       GLU  41   7.038  -5.542 -19.577
  281   2HB   GLU  41          2HB       GLU  41   5.802  -5.278 -18.366
  282   1HG   GLU  41          1HG       GLU  41   5.015  -7.219 -20.540
  283   2HG   GLU  41          2HG       GLU  41   4.074  -5.980 -19.738
  284    H    LEU  42           H        LEU  42   4.674  -7.315 -16.761
  285    HA   LEU  42           HA       LEU  42   5.548  -5.892 -14.449
  286   1HB   LEU  42          1HB       LEU  42   3.822  -8.399 -14.141
  287   2HB   LEU  42          2HB       LEU  42   3.205  -7.010 -15.009
  288    HG   LEU  42           HG       LEU  42   4.326  -6.497 -12.230
  289   1HD1  LEU  42          1HD1      LEU  42   1.526  -7.728 -12.617
  290   2HD1  LEU  42          2HD1      LEU  42   2.928  -8.638 -12.033
  291   3HD1  LEU  42          3HD1      LEU  42   2.302  -7.271 -11.078
  292   1HD2  LEU  42          1HD2      LEU  42   2.545  -4.790 -12.117
  293   2HD2  LEU  42          2HD2      LEU  42   3.375  -4.617 -13.683
  294   3HD2  LEU  42          3HD2      LEU  42   1.788  -5.404 -13.609
  295    H    GLY  43           H        GLY  43   5.619  -9.448 -14.853
  296   1HA   GLY  43          1HA       GLY  43   6.906 -10.279 -12.458
  297   2HA   GLY  43          2HA       GLY  43   7.125 -11.134 -13.990
  298    H    THR  44           H        THR  44   8.354  -8.935 -15.394
  299    HA   THR  44           HA       THR  44  11.109  -9.608 -15.115
  300    HB   THR  44           HB       THR  44  10.074  -6.939 -16.205
  301    HG1  THR  44           HG1      THR  44  10.044  -8.000 -18.133
  302   1HG2  THR  44          1HG2      THR  44  12.116  -6.954 -17.648
  303   2HG2  THR  44          2HG2      THR  44  12.546  -6.843 -15.928
  304   3HG2  THR  44          3HG2      THR  44  12.728  -8.391 -16.792
  305    H    VAL  45           H        VAL  45   9.531  -6.621 -13.939
  306    HA   VAL  45           HA       VAL  45  11.882  -5.554 -12.532
  307    HB   VAL  45           HB       VAL  45   9.035  -4.735 -12.819
  308   1HG1  VAL  45          1HG1      VAL  45  11.575  -3.004 -12.576
  309   2HG1  VAL  45          2HG1      VAL  45  11.034  -3.727 -14.096
  310   3HG1  VAL  45          3HG1      VAL  45  10.000  -2.538 -13.272
  311   1HG2  VAL  45          1HG2      VAL  45   8.914  -3.192 -10.931
  312   2HG2  VAL  45          2HG2      VAL  45   9.266  -4.795 -10.245
  313   3HG2  VAL  45          3HG2      VAL  45  10.563  -3.600 -10.391
  314    H    MET  46           H        MET  46   9.182  -7.644 -11.651
  315    HA   MET  46           HA       MET  46   9.377  -7.628  -8.754
  316   1HB   MET  46          1HB       MET  46   8.214  -9.579 -10.757
  317   2HB   MET  46          2HB       MET  46   8.532 -10.187  -9.143
  318   1HG   MET  46          1HG       MET  46   6.363  -8.380 -10.058
  319   2HG   MET  46          2HG       MET  46   7.191  -7.733  -8.631
  320   1HE   MET  46          1HE       MET  46   6.607  -8.384  -6.266
  321   2HE   MET  46          2HE       MET  46   6.365 -10.079  -5.750
  322   3HE   MET  46          3HE       MET  46   7.916  -9.587  -6.490
  323    NH1  ARG  47           NH1      ARG  47  17.623 -12.984 -14.175
  324    NH2  ARG  47           NH2      ARG  47  18.503 -14.027 -12.358
  325    H    ARG  47           H        ARG  47  11.201  -9.326 -11.240
  326    HA   ARG  47           HA       ARG  47  12.530 -11.351  -9.585
  327   1HB   ARG  47          1HB       ARG  47  13.677 -10.168 -12.175
  328   2HB   ARG  47          2HB       ARG  47  12.320 -11.287 -12.154
  329   1HG   ARG  47          1HG       ARG  47  14.541 -12.347 -10.505
  330   2HG   ARG  47          2HG       ARG  47  13.630 -13.113 -11.807
  331   1HD   ARG  47          1HD       ARG  47  15.100 -12.267 -13.535
  332   2HD   ARG  47          2HD       ARG  47  15.719 -10.986 -12.503
  333    HE   ARG  47           HE       ARG  47  16.636 -13.202 -11.099
  334   1HH1  ARG  47          1HH1      ARG  47  16.865 -12.409 -14.560
  335   2HH1  ARG  47          2HH1      ARG  47  18.434 -13.353 -14.684
  336   1HH2  ARG  47          1HH2      ARG  47  18.422 -14.247 -11.359
  337   2HH2  ARG  47          2HH2      ARG  47  19.253 -14.322 -12.993
  338    H    MET  48           H        MET  48  13.281  -8.008 -10.419
  339    HA   MET  48           HA       MET  48  16.067  -7.776  -9.808
  340   1HB   MET  48          1HB       MET  48  15.118  -5.361  -8.767
  341   2HB   MET  48          2HB       MET  48  13.804  -5.826  -9.831
  342   1HG   MET  48          1HG       MET  48  15.030  -5.463 -11.770
  343   2HG   MET  48          2HG       MET  48  16.538  -6.083 -11.077
  344   1HE   MET  48          1HE       MET  48  15.133  -3.068 -12.604
  345   2HE   MET  48          2HE       MET  48  16.482  -1.982 -12.162
  346   3HE   MET  48          3HE       MET  48  16.826  -3.581 -12.884
  347    H    LEU  49           H        LEU  49  13.300  -8.006  -7.641
  348    HA   LEU  49           HA       LEU  49  14.341  -7.367  -5.065
  349   1HB   LEU  49          1HB       LEU  49  12.923  -9.691  -4.476
  350   2HB   LEU  49          2HB       LEU  49  12.258  -9.301  -6.047
  351    HG   LEU  49           HG       LEU  49  12.325  -7.289  -3.716
  352   1HD1  LEU  49          1HD1      LEU  49   9.937  -9.034  -4.584
  353   2HD1  LEU  49          2HD1      LEU  49  10.947  -9.360  -3.164
  354   3HD1  LEU  49          3HD1      LEU  49   9.978  -7.868  -3.238
  355   1HD2  LEU  49          1HD2      LEU  49  10.698  -5.970  -5.007
  356   2HD2  LEU  49          2HD2      LEU  49  12.073  -6.311  -6.086
  357   3HD2  LEU  49          3HD2      LEU  49  10.572  -7.234  -6.256
  358    H    GLY  50           H        GLY  50  14.205 -10.747  -6.211
  359   1HA   GLY  50          1HA       GLY  50  16.226 -11.870  -4.424
  360   2HA   GLY  50          2HA       GLY  50  17.071 -11.337  -5.884
  361    H    GLN  51           H        GLN  51  13.891 -12.857  -5.303
  362    HA   GLN  51           HA       GLN  51  14.675 -15.434  -6.657
  363   1HB   GLN  51          1HB       GLN  51  13.254 -15.483  -4.620
  364   2HB   GLN  51          2HB       GLN  51  12.521 -16.289  -5.994
  365   1HG   GLN  51          1HG       GLN  51  11.175 -14.073  -6.395
  366   2HG   GLN  51          2HG       GLN  51  11.736 -13.560  -4.819
  367   1HE2  GLN  51          1HE2      GLN  51   8.366 -15.335  -4.503
  368   2HE2  GLN  51          2HE2      GLN  51   9.033 -13.855  -5.358
  369    H    ASN  52           H        ASN  52  12.327 -16.091  -7.939
  370    HA   ASN  52           HA       ASN  52  11.745 -13.981 -10.013
  371   1HB   ASN  52          1HB       ASN  52  13.799 -15.371 -10.737
  372   2HB   ASN  52          2HB       ASN  52  12.737 -16.748 -10.933
  373   1HD2  ASN  52          1HD2      ASN  52  13.096 -14.974 -14.260
  374   2HD2  ASN  52          2HD2      ASN  52  14.217 -15.757 -13.036
  375    HA   PRO  53           HA       PRO  53   7.712 -16.256  -8.707
  376   1HB   PRO  53          1HB       PRO  53   6.054 -14.552  -8.935
  377   2HB   PRO  53          2HB       PRO  53   6.782 -13.934 -10.426
  378   1HG   PRO  53          1HG       PRO  53   7.596 -12.294  -8.975
  379   2HG   PRO  53          2HG       PRO  53   7.674 -13.365  -7.557
  380   1HD   PRO  53          1HD       PRO  53   9.985 -13.524  -8.139
  381   2HD   PRO  53          2HD       PRO  53   9.691 -12.972  -9.814
  382    H    THR  54           H        THR  54   6.038 -17.196 -10.097
  383    HA   THR  54           HA       THR  54   7.175 -18.202 -12.730
  384    HB   THR  54           HB       THR  54   6.079 -19.671 -10.738
  385    HG1  THR  54           HG1      THR  54   5.429 -20.691 -13.167
  386   1HG2  THR  54          1HG2      THR  54   3.846 -20.527 -11.366
  387   2HG2  THR  54          2HG2      THR  54   3.739 -18.792 -10.990
  388   3HG2  THR  54          3HG2      THR  54   3.712 -19.340 -12.685
  389    H    LYS  55           H        LYS  55   5.205 -18.737 -14.299
  390    HA   LYS  55           HA       LYS  55   4.211 -16.034 -15.176
  391   1HB   LYS  55          1HB       LYS  55   4.810 -16.971 -17.158
  392   2HB   LYS  55          2HB       LYS  55   3.231 -17.726 -17.114
  393   1HG   LYS  55          1HG       LYS  55   4.319 -19.778 -16.018
  394   2HG   LYS  55          2HG       LYS  55   4.683 -19.486 -17.709
  395   1HD   LYS  55          1HD       LYS  55   6.537 -19.727 -15.442
  396   2HD   LYS  55          2HD       LYS  55   6.886 -19.687 -17.163
  397   1HE   LYS  55          1HE       LYS  55   6.257 -16.971 -16.182
  398   2HE   LYS  55          2HE       LYS  55   7.569 -17.683 -15.245
  399   1HZ   LYS  55          1HZ       LYS  55   8.918 -17.257 -16.963
  400   2HZ   LYS  55          2HZ       LYS  55   7.674 -16.605 -17.832
  401   3HZ   LYS  55          3HZ       LYS  55   8.037 -18.209 -17.985
  402    H    GLU  56           H        GLU  56   3.005 -19.105 -13.934
  403    HA   GLU  56           HA       GLU  56   0.144 -18.743 -14.516
  404   1HB   GLU  56          1HB       GLU  56   0.176 -20.459 -12.325
  405   2HB   GLU  56          2HB       GLU  56   1.792 -20.691 -12.964
  406   1HG   GLU  56          1HG       GLU  56   0.774 -22.277 -14.283
  407   2HG   GLU  56          2HG       GLU  56   0.375 -20.918 -15.319
  408    H    GLU  57           H        GLU  57   2.274 -17.908 -11.824
  409    HA   GLU  57           HA       GLU  57   0.126 -16.964  -9.962
  410   1HB   GLU  57          1HB       GLU  57   1.757 -17.418  -8.524
  411   2HB   GLU  57          2HB       GLU  57   2.373 -15.828  -8.918
  412   1HG   GLU  57          1HG       GLU  57   3.369 -18.129 -10.652
  413   2HG   GLU  57          2HG       GLU  57   4.212 -16.665 -10.161
  414    H    LEU  58           H        LEU  58   2.291 -15.609 -12.384
  415    HA   LEU  58           HA       LEU  58   2.122 -12.796 -11.856
  416   1HB   LEU  58          1HB       LEU  58   2.909 -14.518 -14.123
  417   2HB   LEU  58          2HB       LEU  58   2.154 -13.043 -14.692
  418    HG   LEU  58           HG       LEU  58   4.775 -13.155 -14.311
  419   1HD1  LEU  58          1HD1      LEU  58   4.893 -10.700 -13.730
  420   2HD1  LEU  58          2HD1      LEU  58   3.652 -11.011 -14.952
  421   3HD1  LEU  58          3HD1      LEU  58   3.174 -10.719 -13.262
  422   1HD2  LEU  58          1HD2      LEU  58   3.879 -12.552 -11.417
  423   2HD2  LEU  58          2HD2      LEU  58   4.706 -14.029 -11.971
  424   3HD2  LEU  58          3HD2      LEU  58   5.547 -12.469 -12.037
  425    H    ASP  59           H        ASP  59   0.021 -14.865 -13.864
  426    HA   ASP  59           HA       ASP  59  -1.832 -12.819 -14.797
  427   1HB   ASP  59          1HB       ASP  59  -2.365 -15.831 -14.500
  428   2HB   ASP  59          2HB       ASP  59  -1.630 -15.055 -15.883
  429    H    ALA  60           H        ALA  60  -1.700 -14.786 -11.882
  430    HA   ALA  60           HA       ALA  60  -4.365 -14.171 -10.798
  431   1HB   ALA  60          1HB       ALA  60  -3.483 -15.091  -8.658
  432   2HB   ALA  60          2HB       ALA  60  -3.074 -16.137 -10.032
  433   3HB   ALA  60          3HB       ALA  60  -1.825 -15.093  -9.306
  434    H    ILE  61           H        ILE  61  -1.216 -12.608 -10.656
  435    HA   ILE  61           HA       ILE  61  -1.697 -10.809  -8.363
  436    HB   ILE  61           HB       ILE  61   0.470 -11.164 -10.372
  437   1HG1  ILE  61          1HG1      ILE  61   1.552 -11.795  -8.477
  438   2HG1  ILE  61          2HG1      ILE  61   0.135 -11.408  -7.525
  439   1HG2  ILE  61          1HG2      ILE  61   1.537  -8.920 -10.012
  440   2HG2  ILE  61          2HG2      ILE  61  -0.007  -8.745 -10.844
  441   3HG2  ILE  61          3HG2      ILE  61   0.106  -8.363  -9.110
  442   1HD1  ILE  61          1HD1      ILE  61   0.908  -9.090  -7.096
  443   2HD1  ILE  61          2HD1      ILE  61   2.160 -10.265  -6.642
  444   3HD1  ILE  61          3HD1      ILE  61   2.324  -9.343  -8.154
  445    H    ILE  62           H        ILE  62  -2.025 -10.555 -11.891
  446    HA   ILE  62           HA       ILE  62  -2.805  -7.698 -11.972
  447    HB   ILE  62           HB       ILE  62  -2.811  -9.934 -14.020
  448   1HG1  ILE  62          1HG1      ILE  62  -0.668  -8.919 -13.946
  449   2HG1  ILE  62          2HG1      ILE  62  -1.296  -7.324 -13.590
  450   1HG2  ILE  62          1HG2      ILE  62  -3.801  -8.425 -15.766
  451   2HG2  ILE  62          2HG2      ILE  62  -4.973  -8.730 -14.486
  452   3HG2  ILE  62          3HG2      ILE  62  -4.113  -7.175 -14.536
  453   1HD1  ILE  62          1HD1      ILE  62  -2.045  -6.965 -15.927
  454   2HD1  ILE  62          2HD1      ILE  62  -0.332  -7.433 -15.882
  455   3HD1  ILE  62          3HD1      ILE  62  -1.559  -8.627 -16.362
  456    H    GLU  63           H        GLU  63  -4.512 -10.817 -11.973
  457    HA   GLU  63           HA       GLU  63  -7.238 -10.067 -12.245
  458   1HB   GLU  63          1HB       GLU  63  -6.589 -12.098 -10.093
  459   2HB   GLU  63          2HB       GLU  63  -6.061 -12.432 -11.731
  460   1HG   GLU  63          1HG       GLU  63  -8.580 -11.971 -12.429
  461   2HG   GLU  63          2HG       GLU  63  -8.156 -13.498 -11.674
  462    H    GLU  64           H        GLU  64  -5.085  -9.698  -9.479
  463    HA   GLU  64           HA       GLU  64  -7.048  -8.890  -7.460
  464   1HB   GLU  64          1HB       GLU  64  -4.469  -9.612  -7.280
  465   2HB   GLU  64          2HB       GLU  64  -4.190  -7.882  -7.315
  466   1HG   GLU  64          1HG       GLU  64  -5.150  -9.585  -5.103
  467   2HG   GLU  64          2HG       GLU  64  -6.294  -8.282  -5.377
  468    H    VAL  65           H        VAL  65  -4.872  -7.030  -9.595
  469    HA   VAL  65           HA       VAL  65  -6.448  -4.469  -9.026
  470    HB   VAL  65           HB       VAL  65  -4.419  -3.291 -10.085
  471   1HG1  VAL  65          1HG1      VAL  65  -2.904  -5.899  -9.424
  472   2HG1  VAL  65          2HG1      VAL  65  -3.356  -5.413 -11.069
  473   3HG1  VAL  65          3HG1      VAL  65  -2.238  -4.402 -10.122
  474   1HG2  VAL  65          1HG2      VAL  65  -3.230  -3.097  -7.956
  475   2HG2  VAL  65          2HG2      VAL  65  -4.945  -3.352  -7.552
  476   3HG2  VAL  65          3HG2      VAL  65  -3.799  -4.691  -7.403
  477    H    ASP  66           H        ASP  66  -8.125  -5.136 -10.435
  478    HA   ASP  66           HA       ASP  66  -7.955  -4.110 -13.181
  479   1HB   ASP  66          1HB       ASP  66  -6.864  -6.684 -13.067
  480   2HB   ASP  66          2HB       ASP  66  -8.520  -7.021 -13.514
  481    H    GLU  67           H        GLU  67  -9.611  -3.201 -11.629
  482    HA   GLU  67           HA       GLU  67 -12.214  -4.659 -11.295
  483   1HB   GLU  67          1HB       GLU  67 -11.188  -2.760  -9.775
  484   2HB   GLU  67          2HB       GLU  67 -11.886  -1.649 -10.938
  485   1HG   GLU  67          1HG       GLU  67 -14.086  -2.081 -10.258
  486   2HG   GLU  67          2HG       GLU  67 -13.233  -2.368  -8.750
  487    H    ASP  68           H        ASP  68 -10.678  -2.435 -13.535
  488    HA   ASP  68           HA       ASP  68 -13.164  -1.799 -15.084
  489   1HB   ASP  68          1HB       ASP  68 -12.011  -0.158 -16.136
  490   2HB   ASP  68          2HB       ASP  68 -10.886  -0.366 -14.812
  491    H    GLY  69           H        GLY  69 -10.382  -3.964 -15.334
  492   1HA   GLY  69          1HA       GLY  69 -10.277  -6.156 -16.449
  493   2HA   GLY  69          2HA       GLY  69 -11.901  -5.870 -17.087
  494    H    SER  70           H        SER  70  -8.922  -3.932 -17.343
  495    HA   SER  70           HA       SER  70  -9.227  -3.566 -20.324
  496   1HB   SER  70          1HB       SER  70  -8.514  -1.602 -19.166
  497   2HB   SER  70          2HB       SER  70  -7.115  -2.171 -20.080
  498    HG   SER  70           HG       SER  70  -6.251  -3.015 -18.235
  499    H    GLY  71           H        GLY  71  -7.232  -5.323 -17.988
  500   1HA   GLY  71          1HA       GLY  71  -6.305  -7.618 -18.560
  501   2HA   GLY  71          2HA       GLY  71  -6.123  -7.077 -20.235
  502    H    THR  72           H        THR  72  -5.067  -4.462 -19.527
  503    HA   THR  72           HA       THR  72  -2.222  -5.239 -18.715
  504    HB   THR  72           HB       THR  72  -1.719  -2.915 -19.963
  505    HG1  THR  72           HG1      THR  72  -4.108  -2.910 -20.401
  506   1HG2  THR  72          1HG2      THR  72  -1.151  -4.098 -22.043
  507   2HG2  THR  72          2HG2      THR  72  -0.681  -5.113 -20.662
  508   3HG2  THR  72          3HG2      THR  72  -2.147  -5.502 -21.599
  509    H    ILE  73           H        ILE  73  -1.141  -2.844 -18.156
  510    HA   ILE  73           HA       ILE  73  -2.831  -1.522 -15.978
  511    HB   ILE  73           HB       ILE  73  -0.040  -2.699 -15.566
  512   1HG1  ILE  73          1HG1      ILE  73  -1.780  -4.376 -15.158
  513   2HG1  ILE  73          2HG1      ILE  73  -1.103  -3.882 -13.621
  514   1HG2  ILE  73          1HG2      ILE  73   0.049  -1.600 -13.331
  515   2HG2  ILE  73          2HG2      ILE  73  -0.114  -0.367 -14.589
  516   3HG2  ILE  73          3HG2      ILE  73  -1.525  -0.816 -13.601
  517   1HD1  ILE  73          1HD1      ILE  73  -3.836  -2.953 -14.679
  518   2HD1  ILE  73          2HD1      ILE  73  -3.516  -4.102 -13.363
  519   3HD1  ILE  73          3HD1      ILE  73  -3.083  -2.387 -13.163
  520    H    ASP  74           H        ASP  74  -3.100   0.144 -17.460
  521    HA   ASP  74           HA       ASP  74  -0.890   1.553 -18.846
  522   1HB   ASP  74          1HB       ASP  74  -3.435   3.082 -18.336
  523   2HB   ASP  74          2HB       ASP  74  -2.451   2.969 -19.777
  524    H    PHE  75           H        PHE  75  -0.807   4.063 -18.411
  525    HA   PHE  75           HA       PHE  75   0.557   4.494 -15.844
  526   1HB   PHE  75          1HB       PHE  75   1.054   5.775 -17.976
  527   2HB   PHE  75          2HB       PHE  75  -0.468   6.613 -17.828
  528    HD1  PHE  75           HD1      PHE  75   2.679   5.959 -15.798
  529    HD2  PHE  75           HD2      PHE  75  -0.523   8.700 -16.668
  530    HE1  PHE  75           HE1      PHE  75   3.728   7.658 -14.360
  531    HE2  PHE  75           HE2      PHE  75   0.548  10.389 -15.231
  532    HZ   PHE  75           HZ       PHE  75   2.667   9.873 -14.075
  533    H    GLU  76           H        GLU  76  -2.701   5.051 -17.053
  534    HA   GLU  76           HA       GLU  76  -3.712   6.824 -14.956
  535   1HB   GLU  76          1HB       GLU  76  -5.755   5.051 -16.187
  536   2HB   GLU  76          2HB       GLU  76  -5.715   6.790 -15.991
  537   1HG   GLU  76          1HG       GLU  76  -4.750   7.164 -18.086
  538   2HG   GLU  76          2HG       GLU  76  -3.787   5.703 -18.036
  539    H    GLU  77           H        GLU  77  -3.943   3.296 -15.412
  540    HA   GLU  77           HA       GLU  77  -5.393   2.734 -12.895
  541   1HB   GLU  77          1HB       GLU  77  -5.606   1.193 -14.758
  542   2HB   GLU  77          2HB       GLU  77  -3.886   0.881 -14.795
  543   1HG   GLU  77          1HG       GLU  77  -5.189   0.240 -12.154
  544   2HG   GLU  77          2HG       GLU  77  -3.964  -0.659 -13.041
  545    H    PHE  78           H        PHE  78  -2.024   3.012 -13.795
  546    HA   PHE  78           HA       PHE  78  -0.781   1.631 -11.522
  547   1HB   PHE  78          1HB       PHE  78   0.357   3.916 -13.251
  548   2HB   PHE  78          2HB       PHE  78   0.448   2.220 -13.651
  549    HD1  PHE  78           HD1      PHE  78   2.089   0.743 -12.435
  550    HD2  PHE  78           HD2      PHE  78   1.724   4.903 -11.399
  551    HE1  PHE  78           HE1      PHE  78   4.213   0.632 -11.195
  552    HE2  PHE  78           HE2      PHE  78   3.839   4.768 -10.148
  553    HZ   PHE  78           HZ       PHE  78   5.094   2.641 -10.055
  554    H    LEU  79           H        LEU  79  -1.854   4.956 -12.107
  555    HA   LEU  79           HA       LEU  79  -0.793   6.142  -9.614
  556   1HB   LEU  79          1HB       LEU  79  -2.377   8.068 -10.136
  557   2HB   LEU  79          2HB       LEU  79  -3.021   7.152 -11.481
  558    HG   LEU  79           HG       LEU  79  -0.620   7.104 -12.478
  559   1HD1  LEU  79          1HD1      LEU  79  -0.098   9.347 -10.427
  560   2HD1  LEU  79          2HD1      LEU  79   0.571   7.709 -10.307
  561   3HD1  LEU  79          3HD1      LEU  79   1.027   8.754 -11.676
  562   1HD2  LEU  79          1HD2      LEU  79  -0.845   9.316 -13.526
  563   2HD2  LEU  79          2HD2      LEU  79  -2.492   8.691 -13.267
  564   3HD2  LEU  79          3HD2      LEU  79  -1.839   9.924 -12.178
  565    H    VAL  80           H        VAL  80  -3.820   4.619 -10.585
  566    HA   VAL  80           HA       VAL  80  -5.399   5.241  -8.182
  567    HB   VAL  80           HB       VAL  80  -5.894   2.801  -9.946
  568   1HG1  VAL  80          1HG1      VAL  80  -8.298   3.219  -9.383
  569   2HG1  VAL  80          2HG1      VAL  80  -7.347   2.954  -7.916
  570   3HG1  VAL  80          3HG1      VAL  80  -7.837   4.605  -8.361
  571   1HG2  VAL  80          1HG2      VAL  80  -6.844   5.675 -10.568
  572   2HG2  VAL  80          2HG2      VAL  80  -5.639   4.767 -11.510
  573   3HG2  VAL  80          3HG2      VAL  80  -7.313   4.196 -11.442
  574    H    MET  81           H        MET  81  -3.119   2.714  -9.089
  575    HA   MET  81           HA       MET  81  -3.521   0.852  -6.858
  576   1HB   MET  81          1HB       MET  81  -1.395   1.235  -8.952
  577   2HB   MET  81          2HB       MET  81  -0.849   0.488  -7.462
  578   1HG   MET  81          1HG       MET  81  -3.359  -0.622  -8.822
  579   2HG   MET  81          2HG       MET  81  -2.227  -1.441  -7.733
  580   1HE   MET  81          1HE       MET  81  -3.337  -0.870 -11.272
  581   2HE   MET  81          2HE       MET  81  -2.225  -2.008 -12.091
  582   3HE   MET  81          3HE       MET  81  -3.232  -2.574 -10.728
  583    H    MET  82           H        MET  82  -1.083   3.414  -7.387
  584    HA   MET  82           HA       MET  82   0.278   3.160  -4.812
  585   1HB   MET  82          1HB       MET  82   0.250   5.279  -6.983
  586   2HB   MET  82          2HB       MET  82   0.909   5.723  -5.420
  587   1HG   MET  82          1HG       MET  82   2.482   4.711  -7.332
  588   2HG   MET  82          2HG       MET  82   1.884   3.149  -6.759
  589   1HE   MET  82          1HE       MET  82   2.473   1.946  -4.825
  590   2HE   MET  82          2HE       MET  82   1.864   2.989  -3.506
  591   3HE   MET  82          3HE       MET  82   3.566   2.442  -3.494
  592    H    VAL  83           H        VAL  83  -2.530   4.993  -5.893
  593    HA   VAL  83           HA       VAL  83  -2.707   6.849  -3.585
  594    HB   VAL  83           HB       VAL  83  -4.271   6.391  -6.058
  595   1HG1  VAL  83          1HG1      VAL  83  -3.940   8.969  -4.401
  596   2HG1  VAL  83          2HG1      VAL  83  -2.727   8.398  -5.555
  597   3HG1  VAL  83          3HG1      VAL  83  -4.355   8.826  -6.128
  598   1HG2  VAL  83          1HG2      VAL  83  -6.417   7.323  -5.358
  599   2HG2  VAL  83          2HG2      VAL  83  -6.107   5.929  -4.297
  600   3HG2  VAL  83          3HG2      VAL  83  -5.853   7.570  -3.685
  601    NH1  ARG  84           NH1      ARG  84  -5.306  -1.880  -4.272
  602    NH2  ARG  84           NH2      ARG  84  -7.115  -3.076  -4.947
  603    H    ARG  84           H        ARG  84  -4.111   3.729  -4.495
  604    HA   ARG  84           HA       ARG  84  -6.241   3.424  -2.539
  605   1HB   ARG  84          1HB       ARG  84  -4.509   1.429  -4.064
  606   2HB   ARG  84          2HB       ARG  84  -5.512   0.853  -2.742
  607   1HG   ARG  84          1HG       ARG  84  -6.791   2.600  -4.896
  608   2HG   ARG  84          2HG       ARG  84  -7.569   1.449  -3.807
  609   1HD   ARG  84          1HD       ARG  84  -5.482   0.314  -5.701
  610   2HD   ARG  84          2HD       ARG  84  -6.993   0.855  -6.436
  611    HE   ARG  84           HE       ARG  84  -8.206  -0.803  -4.883
  612   1HH1  ARG  84          1HH1      ARG  84  -8.074  -3.066  -5.311
  613   2HH1  ARG  84          2HH1      ARG  84  -6.557  -3.903  -4.709
  614   1HH2  ARG  84          1HH2      ARG  84  -4.853  -0.962  -4.197
  615   2HH2  ARG  84          2HH2      ARG  84  -4.910  -2.785  -3.996
  616    H    GLN  85           H        GLN  85  -2.795   2.479  -2.375
  617    HA   GLN  85           HA       GLN  85  -2.911   1.373   0.377
  618   1HB   GLN  85          1HB       GLN  85  -0.589   2.092  -1.484
  619   2HB   GLN  85          2HB       GLN  85  -0.311   1.605   0.178
  620   1HG   GLN  85          1HG       GLN  85  -2.062  -0.410  -0.801
  621   2HG   GLN  85          2HG       GLN  85  -1.048  -0.054  -2.182
  622   1HE2  GLN  85          1HE2      GLN  85   0.935  -2.646  -0.506
  623   2HE2  GLN  85          2HE2      GLN  85  -0.577  -2.444  -1.525
  624    H    MET  86           H        MET  86  -2.112   4.475  -1.098
  625    HA   MET  86           HA       MET  86  -0.824   5.853   1.097
  626   1HB   MET  86          1HB       MET  86  -1.953   6.640  -1.489
  627   2HB   MET  86          2HB       MET  86  -2.435   7.806  -0.270
  628   1HG   MET  86          1HG       MET  86   0.244   7.369  -1.485
  629   2HG   MET  86          2HG       MET  86   0.327   7.446   0.283
  630   1HE   MET  86          1HE       MET  86  -2.361   9.167  -2.183
  631   2HE   MET  86          2HE       MET  86  -1.624  10.784  -2.375
  632   3HE   MET  86          3HE       MET  86  -0.808   9.348  -3.058
  633    H    LYS  87           H        LYS  87  -4.221   5.282   0.341
  634    HA   LYS  87           HA       LYS  87  -5.649   7.008   2.116
  635   1HB   LYS  87          1HB       LYS  87  -6.261   4.120   1.286
  636   2HB   LYS  87          2HB       LYS  87  -7.275   4.956   2.453
  637   1HG   LYS  87          1HG       LYS  87  -7.142   6.874   0.436
  638   2HG   LYS  87          2HG       LYS  87  -7.062   5.397  -0.510
  639   1HD   LYS  87          1HD       LYS  87  -9.365   5.598  -0.428
  640   2HD   LYS  87          2HD       LYS  87  -9.141   4.686   1.061
  641   1HE   LYS  87          1HE       LYS  87 -10.405   6.361   2.039
  642   2HE   LYS  87          2HE       LYS  87  -8.891   7.274   2.069
  643   1HZ   LYS  87          1HZ       LYS  87 -10.065   8.746   0.873
  644   2HZ   LYS  87          2HZ       LYS  87 -11.216   7.661   0.396
  645   3HZ   LYS  87          3HZ       LYS  87  -9.790   7.770  -0.431
  646    H    GLU  88           H        GLU  88  -6.205   6.972   4.245
  647    HA   GLU  88           HA       GLU  88  -4.326   6.093   6.244
  648   1HB   GLU  88          1HB       GLU  88  -7.274   6.855   6.574
  649   2HB   GLU  88          2HB       GLU  88  -5.892   7.930   6.660
  650   1HG   GLU  88          1HG       GLU  88  -5.997   5.593   8.625
  651   2HG   GLU  88          2HG       GLU  88  -5.248   7.169   8.821
  652    H    ASP  89           H        ASP  89  -7.257   4.583   4.967
  653    HA   ASP  89           HA       ASP  89  -7.919   2.271   4.832
  654   1HB   ASP  89          1HB       ASP  89  -5.990   0.642   5.950
  655   2HB   ASP  89          2HB       ASP  89  -5.011   2.034   5.549
  656    H    ALA  90           H        ALA  90  -5.948   1.705   7.678
  657    HA   ALA  90           HA       ALA  90  -8.007   2.399   9.728
  658   1HB   ALA  90          1HB       ALA  90  -8.455   0.067  10.537
  659   2HB   ALA  90          2HB       ALA  90  -9.051   0.283   8.879
  660   3HB   ALA  90          3HB       ALA  90  -7.541  -0.615   9.168
   
  Start of MODEL          35
 Raw file had  660 H/Q atoms
  Start of MODEL   35
    1   1H    ALA   1          1H        ALA   1 -23.930   5.518 -13.197
    2   2H    ALA   1          2H        ALA   1 -24.458   5.823 -11.629
    3   3H    ALA   1          3H        ALA   1 -22.900   5.248 -11.895
    4    HA   ALA   1           HA       ALA   1 -24.869   3.715 -11.127
    5   1HB   ALA   1          1HB       ALA   1 -26.441   3.876 -12.853
    6   2HB   ALA   1          2HB       ALA   1 -25.514   2.485 -13.446
    7   3HB   ALA   1          3HB       ALA   1 -25.227   4.104 -14.134
    8    H    SER   2           H        SER   2 -23.134   3.180 -14.201
    9    HA   SER   2           HA       SER   2 -21.254   1.179 -12.843
   10   1HB   SER   2          1HB       SER   2 -22.828   0.845 -15.124
   11   2HB   SER   2          2HB       SER   2 -21.247   1.212 -15.819
   12    HG   SER   2           HG       SER   2 -20.390  -0.498 -14.865
   13    H    MET   3           H        MET   3 -20.751   3.843 -12.397
   14    HA   MET   3           HA       MET   3 -18.186   4.339 -14.002
   15   1HB   MET   3          1HB       MET   3 -19.864   6.005 -14.684
   16   2HB   MET   3          2HB       MET   3 -20.179   6.461 -13.020
   17   1HG   MET   3          1HG       MET   3 -18.656   8.136 -13.357
   18   2HG   MET   3          2HG       MET   3 -17.405   6.895 -13.202
   19   1HE   MET   3          1HE       MET   3 -15.737   8.030 -14.365
   20   2HE   MET   3          2HE       MET   3 -16.393   9.411 -15.293
   21   3HE   MET   3          3HE       MET   3 -15.546   8.087 -16.146
   22    H    THR   4           H        THR   4 -16.898   3.352 -12.505
   23    HA   THR   4           HA       THR   4 -17.012   3.984  -9.588
   24    HB   THR   4           HB       THR   4 -14.895   2.531  -9.485
   25    HG1  THR   4           HG1      THR   4 -14.142   2.222 -11.354
   26   1HG2  THR   4          1HG2      THR   4 -16.288   0.336 -10.131
   27   2HG2  THR   4          2HG2      THR   4 -17.666   1.458 -10.176
   28   3HG2  THR   4          3HG2      THR   4 -16.715   1.268  -8.680
   29    H    ASP   5           H        ASP   5 -16.576   6.113  -9.332
   30    HA   ASP   5           HA       ASP   5 -14.050   7.395 -10.377
   31   1HB   ASP   5          1HB       ASP   5 -14.825   9.481  -9.488
   32   2HB   ASP   5          2HB       ASP   5 -16.184   8.714 -10.277
   33    H    GLN   6           H        GLN   6 -13.078   5.417  -9.133
   34    HA   GLN   6           HA       GLN   6 -12.779   5.744  -6.137
   35   1HB   GLN   6          1HB       GLN   6 -13.006   3.483  -7.580
   36   2HB   GLN   6          2HB       GLN   6 -12.157   3.566  -6.048
   37   1HG   GLN   6          1HG       GLN   6  -9.985   4.016  -7.511
   38   2HG   GLN   6          2HG       GLN   6 -10.596   2.390  -7.301
   39   1HE2  GLN   6          1HE2      GLN   6  -9.991   2.609 -10.949
   40   2HE2  GLN   6          2HE2      GLN   6  -9.088   2.445  -9.359
   41    H    GLN   7           H        GLN   7 -10.959   6.080  -9.142
   42    HA   GLN   7           HA       GLN   7  -8.339   6.716  -7.765
   43   1HB   GLN   7          1HB       GLN   7  -8.521   5.334  -9.960
   44   2HB   GLN   7          2HB       GLN   7  -7.293   6.587  -9.859
   45   1HG   GLN   7          1HG       GLN   7  -9.296   8.076 -11.017
   46   2HG   GLN   7          2HG       GLN   7  -8.034   7.245 -11.913
   47   1HE2  GLN   7          1HE2      GLN   7 -10.365   4.554 -12.943
   48   2HE2  GLN   7          2HE2      GLN   7  -8.625   4.843 -12.438
   49    H    ALA   8           H        ALA   8 -10.963   8.310  -9.499
   50    HA   ALA   8           HA       ALA   8  -9.999  10.872 -10.184
   51   1HB   ALA   8          1HB       ALA   8 -12.298  11.747  -9.794
   52   2HB   ALA   8          2HB       ALA   8 -12.336  10.165 -10.596
   53   3HB   ALA   8          3HB       ALA   8 -12.729  10.293  -8.862
   54    H    GLU   9           H        GLU   9 -10.895   9.698  -6.955
   55    HA   GLU   9           HA       GLU   9 -10.524  12.293  -5.552
   56   1HB   GLU   9          1HB       GLU   9 -10.875  11.073  -3.442
   57   2HB   GLU   9          2HB       GLU   9 -12.119  10.698  -4.626
   58   1HG   GLU   9          1HG       GLU   9 -11.075   8.483  -5.139
   59   2HG   GLU   9          2HG       GLU   9  -9.736   8.821  -4.048
   60    H    ALA  10           H        ALA  10  -8.595   9.367  -6.054
   61    HA   ALA  10           HA       ALA  10  -6.436   9.835  -4.175
   62   1HB   ALA  10          1HB       ALA  10  -5.124   8.219  -5.540
   63   2HB   ALA  10          2HB       ALA  10  -6.781   7.645  -5.274
   64   3HB   ALA  10          3HB       ALA  10  -6.316   8.317  -6.858
   65    NH1  ARG  11           NH1      ARG  11  -5.889  13.073 -14.130
   66    NH2  ARG  11           NH2      ARG  11  -3.794  13.795 -13.630
   67    H    ARG  11           H        ARG  11  -7.032  11.023  -7.436
   68    HA   ARG  11           HA       ARG  11  -4.308  12.131  -7.975
   69   1HB   ARG  11          1HB       ARG  11  -5.134  12.039 -10.076
   70   2HB   ARG  11          2HB       ARG  11  -6.756  11.726  -9.475
   71   1HG   ARG  11          1HG       ARG  11  -7.292  14.112  -9.310
   72   2HG   ARG  11          2HG       ARG  11  -5.627  14.582  -9.661
   73   1HD   ARG  11          1HD       ARG  11  -6.965  12.807 -11.725
   74   2HD   ARG  11          2HD       ARG  11  -7.597  14.450 -11.597
   75    HE   ARG  11           HE       ARG  11  -5.032  15.158 -11.915
   76   1HH1  ARG  11          1HH1      ARG  11  -3.186  14.309 -12.983
   77   2HH1  ARG  11          2HH1      ARG  11  -3.514  13.334 -14.503
   78   1HH2  ARG  11          1HH2      ARG  11  -6.865  12.974 -13.832
   79   2HH2  ARG  11          2HH2      ARG  11  -5.475  12.729 -15.004
   80    H    ALA  12           H        ALA  12  -7.395  13.311  -6.733
   81    HA   ALA  12           HA       ALA  12  -6.787  16.212  -6.707
   82   1HB   ALA  12          1HB       ALA  12  -8.775  16.417  -5.228
   83   2HB   ALA  12          2HB       ALA  12  -9.124  15.401  -6.641
   84   3HB   ALA  12          3HB       ALA  12  -8.862  14.648  -5.048
   85    H    PHE  13           H        PHE  13  -6.244  13.497  -4.529
   86    HA   PHE  13           HA       PHE  13  -5.493  14.874  -2.095
   87   1HB   PHE  13          1HB       PHE  13  -5.942  12.355  -2.485
   88   2HB   PHE  13          2HB       PHE  13  -4.293  12.207  -3.035
   89    HD1  PHE  13           HD1      PHE  13  -5.318  10.671  -0.683
   90    HD2  PHE  13           HD2      PHE  13  -3.584  14.610  -0.779
   91    HE1  PHE  13           HE1      PHE  13  -4.595  10.422   1.657
   92    HE2  PHE  13           HE2      PHE  13  -2.870  14.341   1.560
   93    HZ   PHE  13           HZ       PHE  13  -3.375  12.254   2.782
   94    H    LEU  14           H        LEU  14  -3.325  13.410  -4.546
   95    HA   LEU  14           HA       LEU  14  -1.049  15.282  -3.696
   96   1HB   LEU  14          1HB       LEU  14   0.084  13.337  -3.503
   97   2HB   LEU  14          2HB       LEU  14   0.216  13.408  -5.247
   98    HG   LEU  14           HG       LEU  14  -1.977  11.842  -3.750
   99   1HD1  LEU  14          1HD1      LEU  14  -2.461  10.793  -5.963
  100   2HD1  LEU  14          2HD1      LEU  14  -2.702  12.548  -6.035
  101   3HD1  LEU  14          3HD1      LEU  14  -1.239  11.824  -6.750
  102   1HD2  LEU  14          1HD2      LEU  14   0.601  10.774  -5.087
  103   2HD2  LEU  14          2HD2      LEU  14   0.252  10.784  -3.341
  104   3HD2  LEU  14          3HD2      LEU  14  -0.716   9.774  -4.425
  105    H    SER  15           H        SER  15  -0.610  16.871  -4.995
  106    HA   SER  15           HA       SER  15  -1.968  17.347  -7.563
  107   1HB   SER  15          1HB       SER  15  -1.039  19.491  -7.523
  108   2HB   SER  15          2HB       SER  15   0.465  18.974  -6.756
  109    HG   SER  15           HG       SER  15  -1.998  19.583  -5.663
  110    H    GLU  16           H        GLU  16   0.171  18.556  -9.013
  111    HA   GLU  16           HA       GLU  16   1.160  16.233 -10.574
  112   1HB   GLU  16          1HB       GLU  16   1.837  19.199 -10.950
  113   2HB   GLU  16          2HB       GLU  16   0.402  18.421 -11.589
  114   1HG   GLU  16          1HG       GLU  16   2.153  16.758 -12.773
  115   2HG   GLU  16          2HG       GLU  16   3.323  18.018 -12.423
  116    H    GLU  17           H        GLU  17   2.470  18.505  -8.244
  117    HA   GLU  17           HA       GLU  17   5.352  17.915  -8.713
  118   1HB   GLU  17          1HB       GLU  17   5.544  19.032  -6.294
  119   2HB   GLU  17          2HB       GLU  17   3.880  19.501  -6.583
  120   1HG   GLU  17          1HG       GLU  17   4.475  20.881  -8.490
  121   2HG   GLU  17          2HG       GLU  17   5.625  21.250  -7.217
  122    H    MET  18           H        MET  18   2.882  16.894  -6.368
  123    HA   MET  18           HA       MET  18   4.614  15.051  -4.786
  124   1HB   MET  18          1HB       MET  18   2.372  14.108  -3.947
  125   2HB   MET  18          2HB       MET  18   1.561  15.280  -4.968
  126   1HG   MET  18          1HG       MET  18   3.104  17.068  -3.636
  127   2HG   MET  18          2HG       MET  18   1.571  16.477  -2.973
  128   1HE   MET  18          1HE       MET  18   1.408  14.298  -1.288
  129   2HE   MET  18          2HE       MET  18   2.430  14.585   0.151
  130   3HE   MET  18          3HE       MET  18   1.466  15.925  -0.539
  131    H    ILE  19           H        ILE  19   2.488  14.854  -7.597
  132    HA   ILE  19           HA       ILE  19   2.248  11.938  -7.809
  133    HB   ILE  19           HB       ILE  19   1.664  14.245  -9.644
  134   1HG1  ILE  19          1HG1      ILE  19  -0.057  11.741  -9.188
  135   2HG1  ILE  19          2HG1      ILE  19   0.041  12.975  -7.950
  136   1HG2  ILE  19          1HG2      ILE  19   1.209  12.784 -11.631
  137   2HG2  ILE  19          2HG2      ILE  19   2.923  12.737 -11.221
  138   3HG2  ILE  19          3HG2      ILE  19   1.875  11.372 -10.774
  139   1HD1  ILE  19          1HD1      ILE  19  -1.018  13.462 -10.797
  140   2HD1  ILE  19          2HD1      ILE  19  -1.948  13.400  -9.285
  141   3HD1  ILE  19          3HD1      ILE  19  -0.800  14.732  -9.561
  142    H    ALA  20           H        ALA  20   4.618  14.321  -8.889
  143    HA   ALA  20           HA       ALA  20   6.160  12.811 -10.793
  144   1HB   ALA  20          1HB       ALA  20   8.014  14.408 -10.321
  145   2HB   ALA  20          2HB       ALA  20   6.456  15.246 -10.465
  146   3HB   ALA  20          3HB       ALA  20   7.183  14.988  -8.859
  147    H    GLU  21           H        GLU  21   6.317  12.893  -7.252
  148    HA   GLU  21           HA       GLU  21   8.863  11.590  -6.780
  149   1HB   GLU  21          1HB       GLU  21   6.450  11.232  -4.941
  150   2HB   GLU  21          2HB       GLU  21   8.150  11.181  -4.515
  151   1HG   GLU  21          1HG       GLU  21   7.492  13.305  -3.724
  152   2HG   GLU  21          2HG       GLU  21   6.363  13.584  -5.038
  153    H    PHE  22           H        PHE  22   5.647  10.345  -7.496
  154    HA   PHE  22           HA       PHE  22   6.400   7.450  -7.155
  155   1HB   PHE  22          1HB       PHE  22   3.764   8.561  -8.289
  156   2HB   PHE  22          2HB       PHE  22   4.074   6.940  -7.728
  157    HD1  PHE  22           HD1      PHE  22   5.094   6.855  -5.138
  158    HD2  PHE  22           HD2      PHE  22   2.542   9.922  -6.753
  159    HE1  PHE  22           HE1      PHE  22   4.482   7.558  -2.862
  160    HE2  PHE  22           HE2      PHE  22   1.938  10.607  -4.467
  161    HZ   PHE  22           HZ       PHE  22   2.916   9.440  -2.520
  162    H    LYS  23           H        LYS  23   6.081   9.835  -9.700
  163    HA   LYS  23           HA       LYS  23   5.791   8.199 -12.081
  164   1HB   LYS  23          1HB       LYS  23   6.894  10.975 -11.562
  165   2HB   LYS  23          2HB       LYS  23   7.353  10.219 -13.072
  166   1HG   LYS  23          1HG       LYS  23   4.393  10.214 -12.380
  167   2HG   LYS  23          2HG       LYS  23   5.184  10.247 -13.946
  168   1HD   LYS  23          1HD       LYS  23   4.507  12.547 -12.112
  169   2HD   LYS  23          2HD       LYS  23   6.050  12.691 -12.961
  170   1HE   LYS  23          1HE       LYS  23   4.474  13.724 -14.454
  171   2HE   LYS  23          2HE       LYS  23   4.740  12.127 -15.169
  172   1HZ   LYS  23          1HZ       LYS  23   2.684  11.566 -13.589
  173   2HZ   LYS  23          2HZ       LYS  23   2.483  12.154 -15.120
  174   3HZ   LYS  23          3HZ       LYS  23   2.364  13.170 -13.822
  175    H    ALA  24           H        ALA  24   8.660   9.166 -10.226
  176    HA   ALA  24           HA       ALA  24  10.732   8.236 -12.065
  177   1HB   ALA  24          1HB       ALA  24  12.273   8.397 -10.120
  178   2HB   ALA  24          2HB       ALA  24  11.223   9.822 -10.227
  179   3HB   ALA  24          3HB       ALA  24  10.897   8.568  -9.004
  180    H    ALA  25           H        ALA  25   9.782   6.759  -8.943
  181    HA   ALA  25           HA       ALA  25  11.187   4.231  -9.279
  182   1HB   ALA  25          1HB       ALA  25   9.848   3.440  -7.339
  183   2HB   ALA  25          2HB       ALA  25  10.474   5.076  -7.061
  184   3HB   ALA  25          3HB       ALA  25   8.757   4.840  -7.477
  185    H    PHE  26           H        PHE  26   8.096   5.354 -10.436
  186    HA   PHE  26           HA       PHE  26   6.655   2.810 -10.734
  187   1HB   PHE  26          1HB       PHE  26   5.334   4.818 -10.826
  188   2HB   PHE  26          2HB       PHE  26   6.275   5.519 -12.116
  189    HD1  PHE  26           HD1      PHE  26   3.424   3.407 -11.276
  190    HD2  PHE  26           HD2      PHE  26   6.143   4.326 -14.481
  191    HE1  PHE  26           HE1      PHE  26   1.796   2.556 -12.915
  192    HE2  PHE  26           HE2      PHE  26   4.502   3.470 -16.106
  193    HZ   PHE  26           HZ       PHE  26   2.337   2.570 -15.327
  194    H    ASP  27           H        ASP  27   8.855   4.654 -12.815
  195    HA   ASP  27           HA       ASP  27   8.741   2.956 -15.200
  196   1HB   ASP  27          1HB       ASP  27  11.232   3.964 -15.499
  197   2HB   ASP  27          2HB       ASP  27  10.714   5.040 -14.223
  198    H    MET  28           H        MET  28  10.590   2.842 -12.206
  199    HA   MET  28           HA       MET  28  12.615   0.889 -12.713
  200   1HB   MET  28          1HB       MET  28  10.982   0.778 -10.122
  201   2HB   MET  28          2HB       MET  28  12.077   2.105 -10.466
  202   1HG   MET  28          1HG       MET  28  14.031   0.753 -10.299
  203   2HG   MET  28          2HG       MET  28  13.161  -0.748 -10.659
  204   1HE   MET  28          1HE       MET  28  11.884   2.144  -8.212
  205   2HE   MET  28          2HE       MET  28  12.568   1.602  -6.650
  206   3HE   MET  28          3HE       MET  28  13.657   2.164  -7.953
  207    H    PHE  29           H        PHE  29   9.161   0.412 -12.031
  208    HA   PHE  29           HA       PHE  29   9.240  -2.564 -12.026
  209   1HB   PHE  29          1HB       PHE  29   6.765  -0.767 -12.369
  210   2HB   PHE  29          2HB       PHE  29   6.760  -2.468 -11.989
  211    HD1  PHE  29           HD1      PHE  29   9.492  -1.641 -10.107
  212    HD2  PHE  29           HD2      PHE  29   5.296  -0.683 -10.207
  213    HE1  PHE  29           HE1      PHE  29   9.537  -1.138  -7.698
  214    HE2  PHE  29           HE2      PHE  29   5.363  -0.193  -7.797
  215    HZ   PHE  29           HZ       PHE  29   7.477  -0.413  -6.541
  216    H    ASP  30           H        ASP  30   8.149  -0.040 -14.306
  217    HA   ASP  30           HA       ASP  30   7.250  -1.621 -16.531
  218   1HB   ASP  30          1HB       ASP  30   7.331   1.030 -16.207
  219   2HB   ASP  30          2HB       ASP  30   8.844   0.913 -17.075
  220    H    ALA  31           H        ALA  31   8.198  -2.904 -17.939
  221    HA   ALA  31           HA       ALA  31  11.264  -3.060 -18.082
  222   1HB   ALA  31          1HB       ALA  31  11.019  -5.523 -18.410
  223   2HB   ALA  31          2HB       ALA  31  10.328  -4.994 -16.863
  224   3HB   ALA  31          3HB       ALA  31   9.253  -5.402 -18.226
  225    H    ASP  32           H        ASP  32   8.183  -3.325 -19.791
  226    HA   ASP  32           HA       ASP  32   9.444  -3.851 -22.483
  227   1HB   ASP  32          1HB       ASP  32   7.128  -4.809 -21.634
  228   2HB   ASP  32          2HB       ASP  32   7.389  -4.417 -23.318
  229    H    GLY  33           H        GLY  33   7.986  -1.227 -20.645
  230   1HA   GLY  33          1HA       GLY  33   8.472   1.171 -20.849
  231   2HA   GLY  33          2HA       GLY  33   9.436   0.803 -22.261
  232    H    GLY  34           H        GLY  34   6.060   0.933 -21.116
  233   1HA   GLY  34          1HA       GLY  34   4.174   0.773 -23.010
  234   2HA   GLY  34          2HA       GLY  34   5.155   1.982 -23.851
  235    H    GLY  35           H        GLY  35   3.623   1.423 -20.681
  236   1HA   GLY  35          1HA       GLY  35   3.691   4.187 -19.707
  237   2HA   GLY  35          2HA       GLY  35   2.142   3.952 -20.528
  238    H    ASP  36           H        ASP  36   1.595   1.312 -19.974
  239    HA   ASP  36           HA       ASP  36   1.053   1.335 -16.972
  240   1HB   ASP  36          1HB       ASP  36  -0.433  -0.767 -18.354
  241   2HB   ASP  36          2HB       ASP  36  -1.009   0.552 -17.362
  242    H    ILE  37           H        ILE  37   1.058  -0.799 -15.912
  243    HA   ILE  37           HA       ILE  37   3.574  -2.357 -16.653
  244    HB   ILE  37           HB       ILE  37   2.377  -3.050 -14.047
  245   1HG1  ILE  37          1HG1      ILE  37   2.843  -0.145 -14.565
  246   2HG1  ILE  37          2HG1      ILE  37   1.919  -0.938 -13.304
  247   1HG2  ILE  37          1HG2      ILE  37   4.729  -3.075 -13.312
  248   2HG2  ILE  37          2HG2      ILE  37   4.580  -3.905 -14.867
  249   3HG2  ILE  37          3HG2      ILE  37   5.252  -2.259 -14.805
  250   1HD1  ILE  37          1HD1      ILE  37   4.968  -0.523 -13.230
  251   2HD1  ILE  37          2HD1      ILE  37   3.736   0.309 -12.258
  252   3HD1  ILE  37          3HD1      ILE  37   4.036  -1.426 -12.005
  253    H    SER  38           H        SER  38   3.129  -4.714 -15.361
  254    HA   SER  38           HA       SER  38   0.497  -5.936 -16.181
  255   1HB   SER  38          1HB       SER  38   2.018  -5.806 -18.293
  256   2HB   SER  38          2HB       SER  38   1.199  -7.326 -17.930
  257    HG   SER  38           HG       SER  38   3.028  -8.237 -17.558
  258    H    THR  39           H        THR  39   1.372  -8.584 -16.215
  259    HA   THR  39           HA       THR  39   1.860  -9.101 -13.288
  260    HB   THR  39           HB       THR  39   1.721 -11.621 -14.532
  261    HG1  THR  39           HG1      THR  39   0.307 -11.517 -16.054
  262   1HG2  THR  39          1HG2      THR  39  -0.509 -11.833 -13.527
  263   2HG2  THR  39          2HG2      THR  39   0.547 -10.966 -12.389
  264   3HG2  THR  39          3HG2      THR  39  -0.664 -10.071 -13.345
  265    H    LYS  40           H        LYS  40   3.165 -10.698 -16.220
  266    HA   LYS  40           HA       LYS  40   5.564 -11.765 -15.163
  267   1HB   LYS  40          1HB       LYS  40   5.008 -10.705 -17.976
  268   2HB   LYS  40          2HB       LYS  40   4.775 -12.343 -17.423
  269   1HG   LYS  40          1HG       LYS  40   7.281 -10.813 -18.210
  270   2HG   LYS  40          2HG       LYS  40   7.503 -12.007 -16.959
  271   1HD   LYS  40          1HD       LYS  40   7.054 -12.421 -19.911
  272   2HD   LYS  40          2HD       LYS  40   8.062 -13.256 -18.765
  273   1HE   LYS  40          1HE       LYS  40   6.648 -14.986 -19.038
  274   2HE   LYS  40          2HE       LYS  40   5.685 -14.190 -17.801
  275   1HZ   LYS  40          1HZ       LYS  40   5.150 -14.533 -20.630
  276   2HZ   LYS  40          2HZ       LYS  40   4.777 -13.022 -20.076
  277   3HZ   LYS  40          3HZ       LYS  40   4.091 -14.351 -19.375
  278    H    GLU  41           H        GLU  41   4.898  -8.490 -16.338
  279    HA   GLU  41           HA       GLU  41   7.580  -7.387 -16.477
  280   1HB   GLU  41          1HB       GLU  41   6.465  -5.120 -16.136
  281   2HB   GLU  41          2HB       GLU  41   4.942  -5.956 -15.921
  282   1HG   GLU  41          1HG       GLU  41   6.516  -6.496 -18.483
  283   2HG   GLU  41          2HG       GLU  41   4.792  -6.600 -18.196
  284    H    LEU  42           H        LEU  42   5.188  -7.308 -13.822
  285    HA   LEU  42           HA       LEU  42   6.811  -5.798 -11.893
  286   1HB   LEU  42          1HB       LEU  42   4.595  -7.796 -11.167
  287   2HB   LEU  42          2HB       LEU  42   4.242  -6.224 -11.850
  288    HG   LEU  42           HG       LEU  42   6.010  -6.252  -9.382
  289   1HD1  LEU  42          1HD1      LEU  42   2.968  -6.690  -9.144
  290   2HD1  LEU  42          2HD1      LEU  42   4.167  -7.972  -8.912
  291   3HD1  LEU  42          3HD1      LEU  42   4.149  -6.569  -7.814
  292   1HD2  LEU  42          1HD2      LEU  42   4.818  -4.160  -8.834
  293   2HD2  LEU  42          2HD2      LEU  42   5.307  -4.083 -10.544
  294   3HD2  LEU  42          3HD2      LEU  42   3.622  -4.441 -10.126
  295    H    GLY  43           H        GLY  43   6.448  -9.217 -12.669
  296   1HA   GLY  43          1HA       GLY  43   7.570 -10.580 -10.429
  297   2HA   GLY  43          2HA       GLY  43   7.760 -11.159 -12.088
  298    H    THR  44           H        THR  44   9.196  -8.723 -12.941
  299    HA   THR  44           HA       THR  44  11.924  -9.749 -12.531
  300    HB   THR  44           HB       THR  44  10.897  -7.262 -13.968
  301    HG1  THR  44           HG1      THR  44  12.354  -9.251 -15.192
  302   1HG2  THR  44          1HG2      THR  44  13.177  -6.962 -14.950
  303   2HG2  THR  44          2HG2      THR  44  13.185  -6.648 -13.202
  304   3HG2  THR  44          3HG2      THR  44  13.834  -8.184 -13.833
  305    H    VAL  45           H        VAL  45  10.244  -6.784 -11.484
  306    HA   VAL  45           HA       VAL  45  12.502  -5.560 -10.062
  307    HB   VAL  45           HB       VAL  45   9.604  -4.945 -10.353
  308   1HG1  VAL  45          1HG1      VAL  45   9.491  -3.342  -8.443
  309   2HG1  VAL  45          2HG1      VAL  45   9.677  -4.996  -7.847
  310   3HG1  VAL  45          3HG1      VAL  45  11.076  -3.899  -7.846
  311   1HG2  VAL  45          1HG2      VAL  45  12.090  -3.115 -10.179
  312   2HG2  VAL  45          2HG2      VAL  45  11.328  -3.695 -11.679
  313   3HG2  VAL  45          3HG2      VAL  45  10.438  -2.600 -10.612
  314    H    MET  46           H        MET  46   9.934  -7.813  -9.174
  315    HA   MET  46           HA       MET  46  10.321  -7.697  -6.225
  316   1HB   MET  46          1HB       MET  46   8.170  -8.458  -7.508
  317   2HB   MET  46          2HB       MET  46   8.618  -9.253  -6.010
  318   1HG   MET  46          1HG       MET  46   9.883 -10.947  -7.812
  319   2HG   MET  46          2HG       MET  46   8.525 -10.382  -8.799
  320   1HE   MET  46          1HE       MET  46   5.901 -10.327  -7.813
  321   2HE   MET  46          2HE       MET  46   5.442 -11.145  -6.291
  322   3HE   MET  46          3HE       MET  46   6.419  -9.649  -6.237
  323    NH1  ARG  47           NH1      ARG  47  14.574 -12.137 -14.000
  324    NH2  ARG  47           NH2      ARG  47  14.314 -14.384 -13.778
  325    H    ARG  47           H        ARG  47  11.523  -9.640  -8.908
  326    HA   ARG  47           HA       ARG  47  12.775 -11.861  -7.533
  327   1HB   ARG  47          1HB       ARG  47  13.352 -10.494 -10.195
  328   2HB   ARG  47          2HB       ARG  47  12.648 -12.072  -9.870
  329   1HG   ARG  47          1HG       ARG  47  14.747 -13.096  -9.356
  330   2HG   ARG  47          2HG       ARG  47  15.541 -11.554  -9.034
  331   1HD   ARG  47          1HD       ARG  47  14.966 -11.077 -11.659
  332   2HD   ARG  47          2HD       ARG  47  16.423 -11.912 -11.145
  333    HE   ARG  47           HE       ARG  47  14.931 -14.132 -11.474
  334   1HH1  ARG  47          1HH1      ARG  47  14.813 -11.245 -13.552
  335   2HH1  ARG  47          2HH1      ARG  47  14.305 -12.280 -14.980
  336   1HH2  ARG  47          1HH2      ARG  47  14.354 -15.206 -13.166
  337   2HH2  ARG  47          2HH2      ARG  47  14.064 -14.370 -14.773
  338    H    MET  48           H        MET  48  14.095  -8.677  -8.454
  339    HA   MET  48           HA       MET  48  16.783  -8.828  -7.490
  340   1HB   MET  48          1HB       MET  48  14.888  -6.551  -7.922
  341   2HB   MET  48          2HB       MET  48  16.118  -6.235  -6.711
  342   1HG   MET  48          1HG       MET  48  17.579  -7.405  -8.882
  343   2HG   MET  48          2HG       MET  48  16.397  -6.328  -9.645
  344   1HE   MET  48          1HE       MET  48  15.863  -4.070  -7.364
  345   2HE   MET  48          2HE       MET  48  17.085  -2.853  -7.835
  346   3HE   MET  48          3HE       MET  48  16.127  -3.686  -9.094
  347    H    LEU  49           H        LEU  49  13.769  -8.341  -5.710
  348    HA   LEU  49           HA       LEU  49  14.618  -7.683  -3.068
  349   1HB   LEU  49          1HB       LEU  49  12.475  -9.824  -3.508
  350   2HB   LEU  49          2HB       LEU  49  12.193  -8.175  -4.021
  351    HG   LEU  49           HG       LEU  49  13.048  -8.694  -1.131
  352   1HD1  LEU  49          1HD1      LEU  49  11.731  -6.619  -0.691
  353   2HD1  LEU  49          2HD1      LEU  49  12.969  -6.324  -1.926
  354   3HD1  LEU  49          3HD1      LEU  49  11.265  -6.518  -2.408
  355   1HD2  LEU  49          1HD2      LEU  49  10.144  -8.954  -2.166
  356   2HD2  LEU  49          2HD2      LEU  49  11.128 -10.262  -1.465
  357   3HD2  LEU  49          3HD2      LEU  49  10.635  -8.896  -0.455
  358    H    GLY  50           H        GLY  50  13.868 -11.045  -4.023
  359   1HA   GLY  50          1HA       GLY  50  14.877 -12.557  -1.910
  360   2HA   GLY  50          2HA       GLY  50  16.388 -12.121  -2.720
  361    H    GLN  51           H        GLN  51  13.238 -13.648  -3.259
  362    HA   GLN  51           HA       GLN  51  14.543 -15.770  -5.015
  363   1HB   GLN  51          1HB       GLN  51  12.904 -17.272  -4.329
  364   2HB   GLN  51          2HB       GLN  51  13.137 -16.293  -2.892
  365   1HG   GLN  51          1HG       GLN  51  11.065 -14.872  -3.912
  366   2HG   GLN  51          2HG       GLN  51  10.747 -16.355  -4.783
  367   1HE2  GLN  51          1HE2      GLN  51   9.528 -18.101  -1.866
  368   2HE2  GLN  51          2HE2      GLN  51   9.940 -18.153  -3.653
  369    H    ASN  52           H        ASN  52  13.500 -16.449  -6.960
  370    HA   ASN  52           HA       ASN  52  12.070 -14.261  -8.454
  371   1HB   ASN  52          1HB       ASN  52  13.802 -14.658  -9.882
  372   2HB   ASN  52          2HB       ASN  52  13.086 -16.244 -10.261
  373   1HD2  ASN  52          1HD2      ASN  52  16.090 -17.780  -9.048
  374   2HD2  ASN  52          2HD2      ASN  52  14.753 -17.668 -10.303
  375    HA   PRO  53           HA       PRO  53   8.603 -17.543  -7.721
  376   1HB   PRO  53          1HB       PRO  53   7.022 -15.077  -8.586
  377   2HB   PRO  53          2HB       PRO  53   6.726 -16.263  -7.306
  378   1HG   PRO  53          1HG       PRO  53   7.760 -13.801  -6.733
  379   2HG   PRO  53          2HG       PRO  53   8.160 -15.223  -5.742
  380   1HD   PRO  53          1HD       PRO  53  10.433 -14.767  -6.440
  381   2HD   PRO  53          2HD       PRO  53   9.893 -13.768  -7.820
  382    H    THR  54           H        THR  54   6.973 -18.345  -9.255
  383    HA   THR  54           HA       THR  54   8.070 -18.563 -12.042
  384    HB   THR  54           HB       THR  54   6.827 -20.415 -10.466
  385    HG1  THR  54           HG1      THR  54   6.751 -21.617 -12.354
  386   1HG2  THR  54          1HG2      THR  54   4.656 -21.066 -11.456
  387   2HG2  THR  54          2HG2      THR  54   4.521 -19.451 -10.722
  388   3HG2  THR  54          3HG2      THR  54   4.644 -19.619 -12.492
  389    H    LYS  55           H        LYS  55   6.162 -18.657 -13.762
  390    HA   LYS  55           HA       LYS  55   5.322 -15.799 -14.059
  391   1HB   LYS  55          1HB       LYS  55   4.906 -18.185 -15.972
  392   2HB   LYS  55          2HB       LYS  55   4.538 -16.516 -16.359
  393   1HG   LYS  55          1HG       LYS  55   6.575 -16.634 -17.367
  394   2HG   LYS  55          2HG       LYS  55   7.135 -16.101 -15.792
  395   1HD   LYS  55          1HD       LYS  55   7.992 -18.296 -15.213
  396   2HD   LYS  55          2HD       LYS  55   8.434 -18.043 -16.895
  397   1HE   LYS  55          1HE       LYS  55   6.471 -20.006 -15.723
  398   2HE   LYS  55          2HE       LYS  55   6.013 -19.328 -17.283
  399   1HZ   LYS  55          1HZ       LYS  55   7.463 -21.440 -17.203
  400   2HZ   LYS  55          2HZ       LYS  55   8.738 -20.438 -16.885
  401   3HZ   LYS  55          3HZ       LYS  55   7.889 -20.273 -18.293
  402    H    GLU  56           H        GLU  56   3.847 -18.974 -13.575
  403    HA   GLU  56           HA       GLU  56   1.026 -18.183 -13.973
  404   1HB   GLU  56          1HB       GLU  56   2.476 -20.650 -13.170
  405   2HB   GLU  56          2HB       GLU  56   0.933 -20.474 -12.358
  406   1HG   GLU  56          1HG       GLU  56   0.628 -21.793 -14.405
  407   2HG   GLU  56          2HG       GLU  56  -0.238 -20.276 -14.582
  408    H    GLU  57           H        GLU  57   3.260 -18.341 -11.252
  409    HA   GLU  57           HA       GLU  57   1.389 -18.120  -9.013
  410   1HB   GLU  57          1HB       GLU  57   4.165 -16.911  -8.837
  411   2HB   GLU  57          2HB       GLU  57   3.984 -18.640  -9.044
  412   1HG   GLU  57          1HG       GLU  57   4.182 -18.417  -6.697
  413   2HG   GLU  57          2HG       GLU  57   3.268 -16.916  -6.629
  414    H    LEU  58           H        LEU  58   2.930 -15.749 -11.129
  415    HA   LEU  58           HA       LEU  58   2.263 -13.333  -9.613
  416   1HB   LEU  58          1HB       LEU  58   3.210 -13.881 -12.455
  417   2HB   LEU  58          2HB       LEU  58   2.643 -12.275 -12.044
  418    HG   LEU  58           HG       LEU  58   4.783 -13.660 -10.328
  419   1HD1  LEU  58          1HD1      LEU  58   4.405 -10.654 -10.940
  420   2HD1  LEU  58          2HD1      LEU  58   3.721 -11.448  -9.515
  421   3HD1  LEU  58          3HD1      LEU  58   5.487 -11.379  -9.724
  422   1HD2  LEU  58          1HD2      LEU  58   6.571 -12.760 -11.770
  423   2HD2  LEU  58          2HD2      LEU  58   5.493 -13.766 -12.769
  424   3HD2  LEU  58          3HD2      LEU  58   5.380 -11.998 -12.855
  425    H    ASP  59           H        ASP  59   0.654 -15.204 -12.131
  426    HA   ASP  59           HA       ASP  59  -1.409 -13.393 -13.006
  427   1HB   ASP  59          1HB       ASP  59  -1.499 -16.457 -12.851
  428   2HB   ASP  59          2HB       ASP  59  -1.002 -15.479 -14.213
  429    H    ALA  60           H        ALA  60  -1.189 -15.449 -10.153
  430    HA   ALA  60           HA       ALA  60  -4.015 -15.129  -9.268
  431   1HB   ALA  60          1HB       ALA  60  -3.280 -16.338  -7.220
  432   2HB   ALA  60          2HB       ALA  60  -2.739 -17.168  -8.692
  433   3HB   ALA  60          3HB       ALA  60  -1.577 -16.223  -7.725
  434    H    ILE  61           H        ILE  61  -0.923 -13.570  -8.639
  435    HA   ILE  61           HA       ILE  61  -1.622 -12.106  -6.190
  436    HB   ILE  61           HB       ILE  61   0.657 -11.978  -8.150
  437   1HG1  ILE  61          1HG1      ILE  61   1.407 -13.322  -6.438
  438   2HG1  ILE  61          2HG1      ILE  61   0.209 -12.741  -5.302
  439   1HG2  ILE  61          1HG2      ILE  61   1.639  -9.910  -7.118
  440   2HG2  ILE  61          2HG2      ILE  61   0.122  -9.535  -7.933
  441   3HG2  ILE  61          3HG2      ILE  61   0.158  -9.663  -6.159
  442   1HD1  ILE  61          1HD1      ILE  61   1.566 -10.753  -4.703
  443   2HD1  ILE  61          2HD1      ILE  61   2.517 -12.242  -4.520
  444   3HD1  ILE  61          3HD1      ILE  61   2.788 -11.190  -5.929
  445    H    ILE  62           H        ILE  62  -1.853 -11.432  -9.653
  446    HA   ILE  62           HA       ILE  62  -2.701  -8.582  -9.371
  447    HB   ILE  62           HB       ILE  62  -2.384 -10.469 -11.719
  448   1HG1  ILE  62          1HG1      ILE  62  -0.354  -9.281 -11.146
  449   2HG1  ILE  62          2HG1      ILE  62  -1.191  -7.765 -10.889
  450   1HG2  ILE  62          1HG2      ILE  62  -3.343  -8.782 -13.313
  451   2HG2  ILE  62          2HG2      ILE  62  -4.589  -9.355 -12.206
  452   3HG2  ILE  62          3HG2      ILE  62  -3.855  -7.756 -11.950
  453   1HD1  ILE  62          1HD1      ILE  62  -1.596  -7.438 -13.314
  454   2HD1  ILE  62          2HD1      ILE  62   0.128  -7.730 -13.000
  455   3HD1  ILE  62          3HD1      ILE  62  -0.879  -9.033 -13.672
  456    H    GLU  63           H        GLU  63  -4.265 -11.685 -10.205
  457    HA   GLU  63           HA       GLU  63  -6.993 -10.917 -10.497
  458   1HB   GLU  63          1HB       GLU  63  -5.756 -13.328 -10.507
  459   2HB   GLU  63          2HB       GLU  63  -6.486 -13.445  -8.918
  460   1HG   GLU  63          1HG       GLU  63  -8.302 -12.577 -11.204
  461   2HG   GLU  63          2HG       GLU  63  -7.728 -14.236 -11.226
  462    H    GLU  64           H        GLU  64  -5.057 -11.296  -7.576
  463    HA   GLU  64           HA       GLU  64  -7.259 -11.053  -5.616
  464   1HB   GLU  64          1HB       GLU  64  -5.054 -10.410  -4.121
  465   2HB   GLU  64          2HB       GLU  64  -4.257 -11.204  -5.464
  466   1HG   GLU  64          1HG       GLU  64  -6.617 -12.731  -4.381
  467   2HG   GLU  64          2HG       GLU  64  -5.034 -13.311  -4.868
  468    H    VAL  65           H        VAL  65  -4.790  -8.846  -6.929
  469    HA   VAL  65           HA       VAL  65  -6.126  -6.448  -5.594
  470    HB   VAL  65           HB       VAL  65  -3.834  -6.476  -5.017
  471   1HG1  VAL  65          1HG1      VAL  65  -1.916  -6.617  -6.616
  472   2HG1  VAL  65          2HG1      VAL  65  -2.936  -8.063  -6.727
  473   3HG1  VAL  65          3HG1      VAL  65  -3.035  -6.810  -7.988
  474   1HG2  VAL  65          1HG2      VAL  65  -4.091  -4.403  -7.303
  475   2HG2  VAL  65          2HG2      VAL  65  -4.591  -4.170  -5.611
  476   3HG2  VAL  65          3HG2      VAL  65  -2.878  -4.372  -6.000
  477    H    ASP  66           H        ASP  66  -7.896  -6.626  -7.092
  478    HA   ASP  66           HA       ASP  66  -7.669  -4.888  -9.456
  479   1HB   ASP  66          1HB       ASP  66  -7.362  -7.796  -9.990
  480   2HB   ASP  66          2HB       ASP  66  -8.695  -7.093 -10.877
  481    H    GLU  67           H        GLU  67  -9.192  -4.062  -7.893
  482    HA   GLU  67           HA       GLU  67 -11.835  -5.240  -7.320
  483   1HB   GLU  67          1HB       GLU  67 -12.531  -3.148  -6.470
  484   2HB   GLU  67          2HB       GLU  67 -10.840  -3.313  -6.038
  485   1HG   GLU  67          1HG       GLU  67 -11.410  -1.797  -8.607
  486   2HG   GLU  67          2HG       GLU  67 -11.962  -1.039  -7.124
  487    H    ASP  68           H        ASP  68 -10.464  -3.357  -9.964
  488    HA   ASP  68           HA       ASP  68 -13.063  -3.046 -11.452
  489   1HB   ASP  68          1HB       ASP  68 -11.385  -2.226 -13.348
  490   2HB   ASP  68          2HB       ASP  68 -11.845  -1.198 -12.010
  491    H    GLY  69           H        GLY  69  -9.954  -4.761 -11.935
  492   1HA   GLY  69          1HA       GLY  69  -9.798  -7.193 -12.580
  493   2HA   GLY  69          2HA       GLY  69 -11.434  -7.084 -13.246
  494    H    SER  70           H        SER  70  -8.856  -4.730 -13.768
  495    HA   SER  70           HA       SER  70  -9.110  -4.763 -16.737
  496   1HB   SER  70          1HB       SER  70  -7.044  -3.206 -16.582
  497   2HB   SER  70          2HB       SER  70  -8.562  -2.644 -15.876
  498    HG   SER  70           HG       SER  70  -6.762  -4.103 -14.289
  499    H    GLY  71           H        GLY  71  -6.836  -6.025 -14.314
  500   1HA   GLY  71          1HA       GLY  71  -5.612  -7.909 -16.404
  501   2HA   GLY  71          2HA       GLY  71  -5.670  -8.234 -14.667
  502    H    THR  72           H        THR  72  -4.825  -5.107 -16.026
  503    HA   THR  72           HA       THR  72  -1.867  -5.500 -15.411
  504    HB   THR  72           HB       THR  72  -1.711  -3.136 -16.571
  505    HG1  THR  72           HG1      THR  72  -3.294  -2.683 -17.934
  506   1HG2  THR  72          1HG2      THR  72  -1.447  -4.115 -18.814
  507   2HG2  THR  72          2HG2      THR  72  -0.728  -5.217 -17.620
  508   3HG2  THR  72          3HG2      THR  72  -2.312  -5.595 -18.346
  509    H    ILE  73           H        ILE  73  -1.005  -3.056 -14.810
  510    HA   ILE  73           HA       ILE  73  -2.649  -1.944 -12.483
  511    HB   ILE  73           HB       ILE  73   0.242  -2.917 -12.304
  512   1HG1  ILE  73          1HG1      ILE  73  -2.127  -3.575 -10.441
  513   2HG1  ILE  73          2HG1      ILE  73  -1.750  -4.542 -11.851
  514   1HG2  ILE  73          1HG2      ILE  73   0.429  -1.865 -10.054
  515   2HG2  ILE  73          2HG2      ILE  73   0.093  -0.617 -11.262
  516   3HG2  ILE  73          3HG2      ILE  73  -1.207  -1.180 -10.185
  517   1HD1  ILE  73          1HD1      ILE  73   0.150  -4.162  -9.463
  518   2HD1  ILE  73          2HD1      ILE  73  -0.771  -5.618  -9.897
  519   3HD1  ILE  73          3HD1      ILE  73   0.550  -5.062 -10.953
  520    H    ASP  74           H        ASP  74  -3.160  -0.237 -13.825
  521    HA   ASP  74           HA       ASP  74  -1.174   1.370 -15.355
  522   1HB   ASP  74          1HB       ASP  74  -2.934   2.806 -16.015
  523   2HB   ASP  74          2HB       ASP  74  -3.894   2.492 -14.588
  524    H    PHE  75           H        PHE  75  -0.978   3.757 -14.886
  525    HA   PHE  75           HA       PHE  75   0.426   4.112 -12.331
  526   1HB   PHE  75          1HB       PHE  75  -0.412   6.178 -14.453
  527   2HB   PHE  75          2HB       PHE  75   1.115   5.342 -14.362
  528    HD1  PHE  75           HD1      PHE  75  -0.852   8.165 -13.071
  529    HD2  PHE  75           HD2      PHE  75   2.751   5.894 -12.454
  530    HE1  PHE  75           HE1      PHE  75   0.084   9.996 -11.720
  531    HE2  PHE  75           HE2      PHE  75   3.666   7.736 -11.098
  532    HZ   PHE  75           HZ       PHE  75   2.339   9.785 -10.731
  533    H    GLU  76           H        GLU  76  -2.788   4.912 -13.528
  534    HA   GLU  76           HA       GLU  76  -3.623   6.755 -11.398
  535   1HB   GLU  76          1HB       GLU  76  -6.031   5.874 -12.282
  536   2HB   GLU  76          2HB       GLU  76  -5.083   7.144 -13.026
  537   1HG   GLU  76          1HG       GLU  76  -4.431   4.412 -14.089
  538   2HG   GLU  76          2HG       GLU  76  -6.105   4.875 -14.306
  539    H    GLU  77           H        GLU  77  -3.730   3.266 -11.811
  540    HA   GLU  77           HA       GLU  77  -5.503   2.678  -9.488
  541   1HB   GLU  77          1HB       GLU  77  -5.192   1.193 -11.559
  542   2HB   GLU  77          2HB       GLU  77  -3.654   0.697 -10.891
  543   1HG   GLU  77          1HG       GLU  77  -4.664  -0.482  -9.048
  544   2HG   GLU  77          2HG       GLU  77  -6.190   0.380  -9.197
  545    H    PHE  78           H        PHE  78  -2.022   2.746 -10.104
  546    HA   PHE  78           HA       PHE  78  -1.111   1.565  -7.564
  547   1HB   PHE  78          1HB       PHE  78   0.275   1.853  -9.729
  548   2HB   PHE  78          2HB       PHE  78   0.460   3.543  -9.336
  549    HD1  PHE  78           HD1      PHE  78   0.408   1.051  -6.548
  550    HD2  PHE  78           HD2      PHE  78   2.949   3.228  -9.253
  551    HE1  PHE  78           HE1      PHE  78   2.389   0.357  -5.263
  552    HE2  PHE  78           HE2      PHE  78   4.917   2.531  -7.951
  553    HZ   PHE  78           HZ       PHE  78   4.645   1.088  -5.964
  554    H    LEU  79           H        LEU  79  -2.006   4.788  -8.644
  555    HA   LEU  79           HA       LEU  79  -0.960   6.273  -6.287
  556   1HB   LEU  79          1HB       LEU  79  -2.610   8.117  -7.260
  557   2HB   LEU  79          2HB       LEU  79  -2.781   7.034  -8.624
  558    HG   LEU  79           HG       LEU  79  -0.211   7.108  -8.914
  559   1HD1  LEU  79          1HD1      LEU  79  -0.384   9.515  -6.995
  560   2HD1  LEU  79          2HD1      LEU  79   0.298   7.937  -6.559
  561   3HD1  LEU  79          3HD1      LEU  79   1.070   8.914  -7.831
  562   1HD2  LEU  79          1HD2      LEU  79  -0.234   9.223 -10.166
  563   2HD2  LEU  79          2HD2      LEU  79  -1.858   8.509 -10.317
  564   3HD2  LEU  79          3HD2      LEU  79  -1.591   9.854  -9.199
  565    H    VAL  80           H        VAL  80  -4.025   4.827  -7.254
  566    HA   VAL  80           HA       VAL  80  -5.749   5.941  -5.158
  567    HB   VAL  80           HB       VAL  80  -6.279   4.472  -7.387
  568   1HG1  VAL  80          1HG1      VAL  80  -8.249   4.564  -5.018
  569   2HG1  VAL  80          2HG1      VAL  80  -7.866   5.978  -6.009
  570   3HG1  VAL  80          3HG1      VAL  80  -8.629   4.558  -6.760
  571   1HG2  VAL  80          1HG2      VAL  80  -7.269   2.291  -6.867
  572   2HG2  VAL  80          2HG2      VAL  80  -5.592   2.253  -6.277
  573   3HG2  VAL  80          3HG2      VAL  80  -6.922   2.469  -5.130
  574    H    MET  81           H        MET  81  -3.675   3.076  -5.398
  575    HA   MET  81           HA       MET  81  -4.308   1.720  -2.905
  576   1HB   MET  81          1HB       MET  81  -1.680   1.067  -3.099
  577   2HB   MET  81          2HB       MET  81  -1.875   1.733  -4.710
  578   1HG   MET  81          1HG       MET  81  -4.094   0.046  -4.624
  579   2HG   MET  81          2HG       MET  81  -2.962  -0.828  -3.579
  580   1HE   MET  81          1HE       MET  81  -4.254  -0.646  -6.960
  581   2HE   MET  81          2HE       MET  81  -3.055  -1.686  -7.785
  582   3HE   MET  81          3HE       MET  81  -3.846  -2.257  -6.289
  583    H    MET  82           H        MET  82  -1.399   3.710  -3.500
  584    HA   MET  82           HA       MET  82  -0.535   3.974  -0.767
  585   1HB   MET  82          1HB       MET  82   0.040   5.529  -3.295
  586   2HB   MET  82          2HB       MET  82   0.476   6.299  -1.782
  587   1HG   MET  82          1HG       MET  82   1.366   3.417  -2.053
  588   2HG   MET  82          2HG       MET  82   2.107   4.567  -3.173
  589   1HE   MET  82          1HE       MET  82   2.021   2.900  -0.028
  590   2HE   MET  82          2HE       MET  82   1.639   4.218   1.120
  591   3HE   MET  82          3HE       MET  82   3.323   3.638   0.959
  592    H    VAL  83           H        VAL  83  -2.924   5.788  -2.601
  593    HA   VAL  83           HA       VAL  83  -3.169   8.178  -0.966
  594    HB   VAL  83           HB       VAL  83  -4.703   6.989  -3.178
  595   1HG1  VAL  83          1HG1      VAL  83  -6.870   8.171  -2.774
  596   2HG1  VAL  83          2HG1      VAL  83  -6.605   6.920  -1.552
  597   3HG1  VAL  83          3HG1      VAL  83  -6.340   8.629  -1.135
  598   1HG2  VAL  83          1HG2      VAL  83  -4.332   9.932  -2.306
  599   2HG2  VAL  83          2HG2      VAL  83  -3.308   9.056  -3.467
  600   3HG2  VAL  83          3HG2      VAL  83  -5.002   9.379  -3.863
  601    NH1  ARG  84           NH1      ARG  84  -7.266   0.294  -2.251
  602    NH2  ARG  84           NH2      ARG  84  -8.711   1.185  -3.761
  603    H    ARG  84           H        ARG  84  -5.058   5.137  -0.952
  604    HA   ARG  84           HA       ARG  84  -6.995   5.676   1.113
  605   1HB   ARG  84          1HB       ARG  84  -5.975   3.278  -0.250
  606   2HB   ARG  84          2HB       ARG  84  -6.184   2.943   1.463
  607   1HG   ARG  84          1HG       ARG  84  -8.536   3.499   1.445
  608   2HG   ARG  84          2HG       ARG  84  -8.439   4.278  -0.136
  609   1HD   ARG  84          1HD       ARG  84  -9.378   1.762   0.121
  610   2HD   ARG  84          2HD       ARG  84  -7.671   1.317   0.068
  611    HE   ARG  84           HE       ARG  84  -8.657   3.136  -2.154
  612   1HH1  ARG  84          1HH1      ARG  84  -6.805   0.379  -1.339
  613   2HH1  ARG  84          2HH1      ARG  84  -7.131  -0.453  -2.941
  614   1HH2  ARG  84          1HH2      ARG  84  -9.402   1.913  -3.973
  615   2HH2  ARG  84          2HH2      ARG  84  -8.425   0.411  -4.371
  616    H    GLN  85           H        GLN  85  -3.762   4.170   1.448
  617    HA   GLN  85           HA       GLN  85  -3.805   3.797   4.345
  618   1HB   GLN  85          1HB       GLN  85  -1.097   4.012   3.810
  619   2HB   GLN  85          2HB       GLN  85  -1.711   3.684   2.200
  620   1HG   GLN  85          1HG       GLN  85  -1.885   1.481   2.657
  621   2HG   GLN  85          2HG       GLN  85  -3.031   1.791   3.941
  622   1HE2  GLN  85          1HE2      GLN  85  -0.068   2.000   6.365
  623   2HE2  GLN  85          2HE2      GLN  85  -1.414   3.126   5.829
  624    H    MET  86           H        MET  86  -2.765   6.463   2.268
  625    HA   MET  86           HA       MET  86  -1.341   8.102   4.209
  626   1HB   MET  86          1HB       MET  86  -2.619   9.900   2.350
  627   2HB   MET  86          2HB       MET  86  -2.258   8.435   1.455
  628   1HG   MET  86          1HG       MET  86   0.064   9.275   3.129
  629   2HG   MET  86          2HG       MET  86  -0.005   8.861   1.408
  630   1HE   MET  86          1HE       MET  86  -2.069  10.747   0.012
  631   2HE   MET  86          2HE       MET  86  -1.088  12.197  -0.352
  632   3HE   MET  86          3HE       MET  86  -0.392  10.568  -0.591
  633    H    LYS  87           H        LYS  87  -4.760   7.851   3.336
  634    HA   LYS  87           HA       LYS  87  -5.882  10.205   4.601
  635   1HB   LYS  87          1HB       LYS  87  -7.045   7.461   3.963
  636   2HB   LYS  87          2HB       LYS  87  -7.936   8.517   5.049
  637   1HG   LYS  87          1HG       LYS  87  -8.346   8.560   2.395
  638   2HG   LYS  87          2HG       LYS  87  -6.996   9.682   2.389
  639   1HD   LYS  87          1HD       LYS  87  -9.419  10.091   4.243
  640   2HD   LYS  87          2HD       LYS  87  -8.173  11.257   3.814
  641   1HE   LYS  87          1HE       LYS  87 -10.108  11.908   2.509
  642   2HE   LYS  87          2HE       LYS  87  -9.018  11.137   1.350
  643   1HZ   LYS  87          1HZ       LYS  87 -11.543  10.455   1.549
  644   2HZ   LYS  87          2HZ       LYS  87 -10.970   9.403   2.686
  645   3HZ   LYS  87          3HZ       LYS  87 -10.391   9.344   1.140
  646    H    GLU  88           H        GLU  88  -7.000  10.397   6.613
  647    HA   GLU  88           HA       GLU  88  -5.976   8.618   8.883
  648   1HB   GLU  88          1HB       GLU  88  -5.935  10.893  10.252
  649   2HB   GLU  88          2HB       GLU  88  -5.755  11.647   8.680
  650   1HG   GLU  88          1HG       GLU  88  -3.595  10.681   8.308
  651   2HG   GLU  88          2HG       GLU  88  -3.871   9.353   9.423
  652    H    ASP  89           H        ASP  89  -8.262   7.953   7.960
  653    HA   ASP  89           HA       ASP  89 -10.290   8.661  10.012
  654   1HB   ASP  89          1HB       ASP  89 -11.022  10.531   8.864
  655   2HB   ASP  89          2HB       ASP  89 -10.543   9.929   7.294
  656    H    ALA  90           H        ALA  90 -12.058   7.238   9.976
  657    HA   ALA  90           HA       ALA  90 -12.559   5.167   7.909
  658   1HB   ALA  90          1HB       ALA  90 -11.781   3.158   9.194
  659   2HB   ALA  90          2HB       ALA  90 -10.411   4.207   8.780
  660   3HB   ALA  90          3HB       ALA  90 -11.052   4.200  10.441
   
  Start of MODEL          36
 Raw file had  660 H/Q atoms
  Start of MODEL   36
    1   1H    ALA   1          1H        ALA   1 -20.326   2.496 -16.388
    2   2H    ALA   1          2H        ALA   1 -19.893   3.988 -15.746
    3   3H    ALA   1          3H        ALA   1 -20.762   2.892 -14.813
    4    HA   ALA   1           HA       ALA   1 -22.451   3.030 -16.763
    5   1HB   ALA   1          1HB       ALA   1 -23.475   3.564 -14.768
    6   2HB   ALA   1          2HB       ALA   1 -23.317   5.238 -15.333
    7   3HB   ALA   1          3HB       ALA   1 -22.128   4.571 -14.186
    8    H    SER   2           H        SER   2 -20.933   6.100 -15.725
    9    HA   SER   2           HA       SER   2 -21.016   7.131 -18.614
   10   1HB   SER   2          1HB       SER   2 -21.450   9.347 -17.800
   11   2HB   SER   2          2HB       SER   2 -22.580   8.266 -16.981
   12    HG   SER   2           HG       SER   2 -21.752   9.488 -15.428
   13    H    MET   3           H        MET   3 -19.207   7.091 -15.555
   14    HA   MET   3           HA       MET   3 -16.562   7.344 -16.974
   15   1HB   MET   3          1HB       MET   3 -17.454   9.739 -16.615
   16   2HB   MET   3          2HB       MET   3 -17.253   9.489 -14.890
   17   1HG   MET   3          1HG       MET   3 -14.777   8.793 -16.417
   18   2HG   MET   3          2HG       MET   3 -15.305  10.460 -16.680
   19   1HE   MET   3          1HE       MET   3 -15.497  11.922 -12.987
   20   2HE   MET   3          2HE       MET   3 -16.742  11.416 -14.167
   21   3HE   MET   3          3HE       MET   3 -15.351  12.401 -14.708
   22    H    THR   4           H        THR   4 -14.832   6.733 -15.654
   23    HA   THR   4           HA       THR   4 -15.510   4.894 -13.398
   24    HB   THR   4           HB       THR   4 -12.648   5.390 -14.160
   25    HG1  THR   4           HG1      THR   4 -14.209   3.661 -15.675
   26   1HG2  THR   4          1HG2      THR   4 -12.566   3.576 -12.705
   27   2HG2  THR   4          2HG2      THR   4 -12.869   2.688 -14.215
   28   3HG2  THR   4          3HG2      THR   4 -14.208   3.015 -13.085
   29    H    ASP   5           H        ASP   5 -15.464   5.389 -11.331
   30    HA   ASP   5           HA       ASP   5 -14.789   8.186 -10.453
   31   1HB   ASP   5          1HB       ASP   5 -16.864   6.578  -9.725
   32   2HB   ASP   5          2HB       ASP   5 -15.756   6.143  -8.444
   33    H    GLN   6           H        GLN   6 -13.580   4.915 -10.101
   34    HA   GLN   6           HA       GLN   6 -11.845   5.151  -7.792
   35   1HB   GLN   6          1HB       GLN   6 -11.804   3.315 -10.223
   36   2HB   GLN   6          2HB       GLN   6 -12.239   2.957  -8.562
   37   1HG   GLN   6          1HG       GLN   6  -9.357   3.723  -9.271
   38   2HG   GLN   6          2HG       GLN   6  -9.928   2.924  -7.823
   39   1HE2  GLN   6          1HE2      GLN   6  -8.920   0.677 -11.090
   40   2HE2  GLN   6          2HE2      GLN   6  -8.894   2.512 -11.108
   41    H    GLN   7           H        GLN   7 -11.049   5.504 -11.266
   42    HA   GLN   7           HA       GLN   7  -8.230   6.291 -10.887
   43   1HB   GLN   7          1HB       GLN   7  -8.597   5.465 -13.061
   44   2HB   GLN   7          2HB       GLN   7  -8.482   7.201 -13.312
   45   1HG   GLN   7          1HG       GLN   7 -11.243   5.940 -12.975
   46   2HG   GLN   7          2HG       GLN   7 -10.832   7.476 -13.723
   47   1HE2  GLN   7          1HE2      GLN   7 -10.037   3.981 -15.892
   48   2HE2  GLN   7          2HE2      GLN   7  -9.877   4.001 -14.064
   49    H    ALA   8           H        ALA   8 -11.179   8.151 -11.711
   50    HA   ALA   8           HA       ALA   8 -10.143  10.814 -11.820
   51   1HB   ALA   8          1HB       ALA   8 -12.451  11.589 -11.300
   52   2HB   ALA   8          2HB       ALA   8 -12.468  10.246 -12.459
   53   3HB   ALA   8          3HB       ALA   8 -12.913   9.958 -10.757
   54    H    GLU   9           H        GLU   9 -10.803   8.781  -9.037
   55    HA   GLU   9           HA       GLU   9 -10.768  10.910  -6.963
   56   1HB   GLU   9          1HB       GLU   9 -10.807   7.859  -6.848
   57   2HB   GLU   9          2HB       GLU   9 -10.341   8.761  -5.413
   58   1HG   GLU   9          1HG       GLU   9 -13.061   8.756  -6.811
   59   2HG   GLU   9          2HG       GLU   9 -12.613  10.140  -5.821
   60    H    ALA  10           H        ALA  10  -8.494   8.248  -7.733
   61    HA   ALA  10           HA       ALA  10  -6.371   8.972  -5.894
   62   1HB   ALA  10          1HB       ALA  10  -4.913   7.491  -7.264
   63   2HB   ALA  10          2HB       ALA  10  -6.495   6.745  -6.972
   64   3HB   ALA  10          3HB       ALA  10  -6.125   7.449  -8.567
   65    NH1  ARG  11           NH1      ARG  11  -6.888  15.737 -14.450
   66    NH2  ARG  11           NH2      ARG  11  -4.792  15.914 -15.308
   67    H    ARG  11           H        ARG  11  -7.200  10.140  -9.096
   68    HA   ARG  11           HA       ARG  11  -4.644  11.422  -9.850
   69   1HB   ARG  11          1HB       ARG  11  -6.867  10.822 -11.291
   70   2HB   ARG  11          2HB       ARG  11  -7.290  12.480 -10.892
   71   1HG   ARG  11          1HG       ARG  11  -4.480  12.208 -11.890
   72   2HG   ARG  11          2HG       ARG  11  -5.703  11.714 -13.064
   73   1HD   ARG  11          1HD       ARG  11  -6.932  13.971 -12.516
   74   2HD   ARG  11          2HD       ARG  11  -5.452  14.468 -11.693
   75    HE   ARG  11           HE       ARG  11  -4.514  13.650 -14.241
   76   1HH1  ARG  11          1HH1      ARG  11  -7.536  15.222 -13.843
   77   2HH1  ARG  11          2HH1      ARG  11  -7.102  16.568 -15.013
   78   1HH2  ARG  11          1HH2      ARG  11  -3.831  15.554 -15.329
   79   2HH2  ARG  11          2HH2      ARG  11  -5.162  16.712 -15.836
   80    H    ALA  12           H        ALA  12  -7.585  12.486  -8.186
   81    HA   ALA  12           HA       ALA  12  -6.854  15.357  -7.931
   82   1HB   ALA  12          1HB       ALA  12  -8.788  15.500  -6.375
   83   2HB   ALA  12          2HB       ALA  12  -9.225  14.646  -7.869
   84   3HB   ALA  12          3HB       ALA  12  -8.952  13.727  -6.367
   85    H    PHE  13           H        PHE  13  -6.382  12.418  -6.047
   86    HA   PHE  13           HA       PHE  13  -5.558  13.596  -3.508
   87   1HB   PHE  13          1HB       PHE  13  -4.717  10.852  -4.599
   88   2HB   PHE  13          2HB       PHE  13  -6.310  11.177  -3.968
   89    HD1  PHE  13           HD1      PHE  13  -3.605  13.031  -2.283
   90    HD2  PHE  13           HD2      PHE  13  -5.712   9.278  -2.318
   91    HE1  PHE  13           HE1      PHE  13  -2.737  12.510  -0.040
   92    HE2  PHE  13           HE2      PHE  13  -4.838   8.778  -0.074
   93    HZ   PHE  13           HZ       PHE  13  -3.343  10.383   1.065
   94    H    LEU  14           H        LEU  14  -3.774  12.514  -6.387
   95    HA   LEU  14           HA       LEU  14  -1.137  13.636  -5.285
   96   1HB   LEU  14          1HB       LEU  14  -1.154  11.885  -7.751
   97   2HB   LEU  14          2HB       LEU  14   0.079  12.077  -6.524
   98    HG   LEU  14           HG       LEU  14  -2.538  10.491  -6.160
   99   1HD1  LEU  14          1HD1      LEU  14  -0.149  10.664  -4.219
  100   2HD1  LEU  14          2HD1      LEU  14  -1.671  11.549  -4.010
  101   3HD1  LEU  14          3HD1      LEU  14  -1.669   9.768  -3.970
  102   1HD2  LEU  14          1HD2      LEU  14  -1.173   8.447  -6.264
  103   2HD2  LEU  14          2HD2      LEU  14  -0.799   9.406  -7.717
  104   3HD2  LEU  14          3HD2      LEU  14   0.337   9.387  -6.360
  105    H    SER  15           H        SER  15  -0.886  15.627  -5.933
  106    HA   SER  15           HA       SER  15  -2.170  17.025  -8.130
  107   1HB   SER  15          1HB       SER  15  -0.765  17.883  -6.004
  108   2HB   SER  15          2HB       SER  15   0.549  17.965  -7.180
  109    HG   SER  15           HG       SER  15  -0.930  19.822  -6.907
  110    H    GLU  16           H        GLU  16  -0.554  18.214  -9.766
  111    HA   GLU  16           HA       GLU  16   0.404  16.150 -11.688
  112   1HB   GLU  16          1HB       GLU  16   0.777  19.168 -11.998
  113   2HB   GLU  16          2HB       GLU  16  -0.781  18.400 -12.237
  114   1HG   GLU  16          1HG       GLU  16   1.672  17.389 -13.784
  115   2HG   GLU  16          2HG       GLU  16  -0.025  17.185 -14.185
  116    H    GLU  17           H        GLU  17   1.801  18.448  -9.432
  117    HA   GLU  17           HA       GLU  17   4.627  18.273 -10.349
  118   1HB   GLU  17          1HB       GLU  17   4.194  20.237  -9.152
  119   2HB   GLU  17          2HB       GLU  17   3.316  19.428  -7.869
  120   1HG   GLU  17          1HG       GLU  17   6.357  19.550  -8.292
  121   2HG   GLU  17          2HG       GLU  17   5.657  18.324  -7.249
  122    H    MET  18           H        MET  18   2.570  16.557  -8.059
  123    HA   MET  18           HA       MET  18   4.690  14.772  -6.950
  124   1HB   MET  18          1HB       MET  18   2.776  13.460  -5.962
  125   2HB   MET  18          2HB       MET  18   1.636  14.474  -6.827
  126   1HG   MET  18          1HG       MET  18   1.608  15.519  -4.732
  127   2HG   MET  18          2HG       MET  18   2.845  16.500  -5.537
  128   1HE   MET  18          1HE       MET  18   3.336  17.066  -2.785
  129   2HE   MET  18          2HE       MET  18   4.983  16.474  -2.414
  130   3HE   MET  18          3HE       MET  18   4.654  17.271  -3.981
  131    H    ILE  19           H        ILE  19   2.340  14.706  -9.574
  132    HA   ILE  19           HA       ILE  19   2.289  11.867 -10.205
  133    HB   ILE  19           HB       ILE  19   1.752  14.322 -11.928
  134   1HG1  ILE  19          1HG1      ILE  19   0.153  12.984 -10.031
  135   2HG1  ILE  19          2HG1      ILE  19  -0.406  14.108 -11.251
  136   1HG2  ILE  19          1HG2      ILE  19   0.942  12.845 -13.785
  137   2HG2  ILE  19          2HG2      ILE  19   2.663  12.585 -13.508
  138   3HG2  ILE  19          3HG2      ILE  19   1.487  11.397 -12.902
  139   1HD1  ILE  19          1HD1      ILE  19  -0.400  11.050 -11.591
  140   2HD1  ILE  19          2HD1      ILE  19  -1.801  12.117 -11.362
  141   3HD1  ILE  19          3HD1      ILE  19  -0.855  12.215 -12.865
  142    H    ALA  20           H        ALA  20   4.520  14.485 -11.013
  143    HA   ALA  20           HA       ALA  20   6.136  13.231 -13.060
  144   1HB   ALA  20          1HB       ALA  20   7.878  14.915 -12.476
  145   2HB   ALA  20          2HB       ALA  20   6.266  15.651 -12.562
  146   3HB   ALA  20          3HB       ALA  20   7.015  15.332 -10.977
  147    H    GLU  21           H        GLU  21   6.451  13.218  -9.510
  148    HA   GLU  21           HA       GLU  21   9.039  11.953  -9.235
  149   1HB   GLU  21          1HB       GLU  21   7.582  11.058  -6.992
  150   2HB   GLU  21          2HB       GLU  21   6.755  12.537  -7.441
  151   1HG   GLU  21          1HG       GLU  21   9.638  12.157  -6.502
  152   2HG   GLU  21          2HG       GLU  21   8.404  13.234  -5.871
  153    H    PHE  22           H        PHE  22   5.785  10.622  -9.615
  154    HA   PHE  22           HA       PHE  22   6.621   7.758  -9.266
  155   1HB   PHE  22          1HB       PHE  22   3.892   8.932 -10.085
  156   2HB   PHE  22          2HB       PHE  22   4.209   7.244  -9.791
  157    HD1  PHE  22           HD1      PHE  22   5.856   7.131  -7.347
  158    HD2  PHE  22           HD2      PHE  22   2.544   9.722  -8.266
  159    HE1  PHE  22           HE1      PHE  22   5.506   7.551  -4.950
  160    HE2  PHE  22           HE2      PHE  22   2.207  10.125  -5.862
  161    HZ   PHE  22           HZ       PHE  22   3.704   9.070  -4.203
  162    H    LYS  23           H        LYS  23   6.197  10.047 -11.858
  163    HA   LYS  23           HA       LYS  23   5.598   8.327 -14.134
  164   1HB   LYS  23          1HB       LYS  23   6.642  11.112 -13.785
  165   2HB   LYS  23          2HB       LYS  23   7.230  10.330 -15.235
  166   1HG   LYS  23          1HG       LYS  23   4.229  10.390 -14.595
  167   2HG   LYS  23          2HG       LYS  23   5.008  10.022 -16.125
  168   1HD   LYS  23          1HD       LYS  23   3.921  12.451 -15.633
  169   2HD   LYS  23          2HD       LYS  23   5.508  12.784 -14.929
  170   1HE   LYS  23          1HE       LYS  23   6.175  13.313 -17.070
  171   2HE   LYS  23          2HE       LYS  23   6.238  11.568 -17.361
  172   1HZ   LYS  23          1HZ       LYS  23   4.735  13.224 -18.787
  173   2HZ   LYS  23          2HZ       LYS  23   3.608  12.814 -17.650
  174   3HZ   LYS  23          3HZ       LYS  23   4.327  11.639 -18.563
  175    H    ALA  24           H        ALA  24   8.676   9.344 -12.667
  176    HA   ALA  24           HA       ALA  24  10.514   8.243 -14.649
  177   1HB   ALA  24          1HB       ALA  24  12.261   8.480 -12.895
  178   2HB   ALA  24          2HB       ALA  24  11.234   9.923 -12.978
  179   3HB   ALA  24          3HB       ALA  24  11.019   8.754 -11.650
  180    H    ALA  25           H        ALA  25   9.741   6.974 -11.386
  181    HA   ALA  25           HA       ALA  25  11.062   4.383 -11.636
  182   1HB   ALA  25          1HB       ALA  25   9.783   3.749  -9.600
  183   2HB   ALA  25          2HB       ALA  25  10.479   5.373  -9.439
  184   3HB   ALA  25          3HB       ALA  25   8.738   5.180  -9.769
  185    H    PHE  26           H        PHE  26   7.953   5.557 -12.699
  186    HA   PHE  26           HA       PHE  26   6.396   3.077 -12.791
  187   1HB   PHE  26          1HB       PHE  26   5.172   5.138 -13.002
  188   2HB   PHE  26          2HB       PHE  26   6.103   5.688 -14.369
  189    HD1  PHE  26           HD1      PHE  26   5.399   5.077 -16.641
  190    HD2  PHE  26           HD2      PHE  26   3.611   3.075 -13.279
  191    HE1  PHE  26           HE1      PHE  26   3.649   4.153 -18.107
  192    HE2  PHE  26           HE2      PHE  26   1.865   2.167 -14.759
  193    HZ   PHE  26           HZ       PHE  26   1.903   2.671 -17.177
  194    H    ASP  27           H        ASP  27   8.591   4.660 -15.084
  195    HA   ASP  27           HA       ASP  27   8.262   2.805 -17.358
  196   1HB   ASP  27          1HB       ASP  27   9.434   5.211 -17.257
  197   2HB   ASP  27          2HB       ASP  27  10.877   4.289 -16.905
  198    H    MET  28           H        MET  28  10.273   2.895 -14.466
  199    HA   MET  28           HA       MET  28  12.245   0.873 -14.991
  200   1HB   MET  28          1HB       MET  28  11.014   0.822 -12.225
  201   2HB   MET  28          2HB       MET  28  11.712   2.339 -12.762
  202   1HG   MET  28          1HG       MET  28  13.929   1.224 -13.173
  203   2HG   MET  28          2HG       MET  28  13.243  -0.337 -12.692
  204   1HE   MET  28          1HE       MET  28  12.685   3.383 -11.243
  205   2HE   MET  28          2HE       MET  28  13.809   3.336  -9.852
  206   3HE   MET  28          3HE       MET  28  14.450   3.236 -11.519
  207    H    PHE  29           H        PHE  29   8.904   0.530 -13.814
  208    HA   PHE  29           HA       PHE  29   8.918  -2.445 -13.644
  209   1HB   PHE  29          1HB       PHE  29   6.436  -0.637 -13.820
  210   2HB   PHE  29          2HB       PHE  29   6.489  -2.291 -13.273
  211    HD1  PHE  29           HD1      PHE  29   5.343  -0.010 -11.643
  212    HD2  PHE  29           HD2      PHE  29   9.324  -1.648 -11.696
  213    HE1  PHE  29           HE1      PHE  29   5.705   0.762  -9.334
  214    HE2  PHE  29           HE2      PHE  29   9.667  -0.859  -9.390
  215    HZ   PHE  29           HZ       PHE  29   7.872   0.363  -8.215
  216    H    ASP  30           H        ASP  30   8.053   0.025 -16.012
  217    HA   ASP  30           HA       ASP  30   6.724  -1.592 -18.029
  218   1HB   ASP  30          1HB       ASP  30   7.168   1.074 -17.871
  219   2HB   ASP  30          2HB       ASP  30   8.494   0.691 -18.944
  220    H    ALA  31           H        ALA  31   7.630  -2.249 -20.114
  221    HA   ALA  31           HA       ALA  31  10.546  -3.199 -20.002
  222   1HB   ALA  31          1HB       ALA  31   9.833  -5.414 -20.912
  223   2HB   ALA  31          2HB       ALA  31   9.092  -5.082 -19.334
  224   3HB   ALA  31          3HB       ALA  31   8.122  -4.933 -20.822
  225    H    ASP  32           H        ASP  32   7.669  -2.560 -21.988
  226    HA   ASP  32           HA       ASP  32   9.198  -2.692 -24.588
  227   1HB   ASP  32          1HB       ASP  32   7.130  -3.616 -25.022
  228   2HB   ASP  32          2HB       ASP  32   6.876  -1.979 -25.581
  229    H    GLY  33           H        GLY  33   7.637  -0.314 -22.479
  230   1HA   GLY  33          1HA       GLY  33   8.595   1.999 -22.140
  231   2HA   GLY  33          2HA       GLY  33   9.306   1.888 -23.734
  232    H    GLY  34           H        GLY  34   6.006   0.857 -23.163
  233   1HA   GLY  34          1HA       GLY  34   3.981   1.653 -24.339
  234   2HA   GLY  34          2HA       GLY  34   4.860   3.101 -24.849
  235    H    GLY  35           H        GLY  35   2.254   2.798 -23.493
  236   1HA   GLY  35          1HA       GLY  35   2.741   4.458 -20.944
  237   2HA   GLY  35          2HA       GLY  35   1.389   4.784 -22.038
  238    H    ASP  36           H        ASP  36   2.585   1.589 -21.117
  239    HA   ASP  36           HA       ASP  36   0.422   1.032 -19.113
  240   1HB   ASP  36          1HB       ASP  36  -1.164   0.445 -20.613
  241   2HB   ASP  36          2HB       ASP  36  -0.275  -1.058 -20.708
  242    H    ILE  37           H        ILE  37   0.612  -1.136 -18.250
  243    HA   ILE  37           HA       ILE  37   3.282  -2.552 -18.741
  244    HB   ILE  37           HB       ILE  37   2.087  -2.356 -15.953
  245   1HG1  ILE  37          1HG1      ILE  37   4.460  -0.619 -16.861
  246   2HG1  ILE  37          2HG1      ILE  37   2.814  -0.017 -16.811
  247   1HG2  ILE  37          1HG2      ILE  37   4.256  -3.238 -15.184
  248   2HG2  ILE  37          2HG2      ILE  37   3.582  -4.307 -16.423
  249   3HG2  ILE  37          3HG2      ILE  37   4.912  -3.199 -16.839
  250   1HD1  ILE  37          1HD1      ILE  37   4.383  -1.001 -14.353
  251   2HD1  ILE  37          2HD1      ILE  37   3.946   0.671 -14.763
  252   3HD1  ILE  37          3HD1      ILE  37   2.673  -0.492 -14.329
  253    H    SER  38           H        SER  38   3.283  -4.793 -17.985
  254    HA   SER  38           HA       SER  38   0.538  -6.157 -18.202
  255   1HB   SER  38          1HB       SER  38   2.256  -6.135 -20.287
  256   2HB   SER  38          2HB       SER  38   1.181  -7.491 -19.938
  257    HG   SER  38           HG       SER  38   3.405  -8.019 -20.281
  258    H    THR  39           H        THR  39   1.313  -8.719 -17.894
  259    HA   THR  39           HA       THR  39   2.017  -8.892 -14.974
  260    HB   THR  39           HB       THR  39   1.724 -11.540 -15.882
  261    HG1  THR  39           HG1      THR  39  -0.542 -10.385 -16.844
  262   1HG2  THR  39          1HG2      THR  39  -0.428 -11.551 -14.699
  263   2HG2  THR  39          2HG2      THR  39   0.733 -10.588 -13.757
  264   3HG2  THR  39          3HG2      THR  39  -0.523  -9.775 -14.727
  265    H    LYS  40           H        LYS  40   3.235 -10.203 -18.073
  266    HA   LYS  40           HA       LYS  40   5.566 -11.616 -17.082
  267   1HB   LYS  40          1HB       LYS  40   4.488 -11.719 -19.406
  268   2HB   LYS  40          2HB       LYS  40   5.359 -10.274 -19.849
  269   1HG   LYS  40          1HG       LYS  40   6.204 -12.817 -20.309
  270   2HG   LYS  40          2HG       LYS  40   6.858 -12.691 -18.698
  271   1HD   LYS  40          1HD       LYS  40   7.645 -10.615 -20.835
  272   2HD   LYS  40          2HD       LYS  40   8.385 -10.952 -19.297
  273   1HE   LYS  40          1HE       LYS  40   9.311 -11.957 -21.693
  274   2HE   LYS  40          2HE       LYS  40   9.772 -12.550 -20.103
  275   1HZ   LYS  40          1HZ       LYS  40   9.079 -14.426 -21.285
  276   2HZ   LYS  40          2HZ       LYS  40   7.782 -13.682 -21.987
  277   3HZ   LYS  40          3HZ       LYS  40   7.732 -14.093 -20.388
  278    H    GLU  41           H        GLU  41   5.102  -8.268 -18.215
  279    HA   GLU  41           HA       GLU  41   7.870  -7.350 -18.074
  280   1HB   GLU  41          1HB       GLU  41   7.136  -5.187 -18.498
  281   2HB   GLU  41          2HB       GLU  41   5.644  -5.372 -17.603
  282   1HG   GLU  41          1HG       GLU  41   6.067  -6.894 -20.237
  283   2HG   GLU  41          2HG       GLU  41   4.563  -6.573 -19.400
  284    H    LEU  42           H        LEU  42   5.156  -7.018 -15.774
  285    HA   LEU  42           HA       LEU  42   6.498  -5.485 -13.701
  286   1HB   LEU  42          1HB       LEU  42   3.939  -6.156 -13.983
  287   2HB   LEU  42          2HB       LEU  42   4.358  -7.566 -13.034
  288    HG   LEU  42           HG       LEU  42   5.153  -4.861 -11.896
  289   1HD1  LEU  42          1HD1      LEU  42   3.973  -7.353 -10.519
  290   2HD1  LEU  42          2HD1      LEU  42   5.708  -7.086 -10.748
  291   3HD1  LEU  42          3HD1      LEU  42   4.766  -5.961  -9.737
  292   1HD2  LEU  42          1HD2      LEU  42   2.914  -4.419 -10.954
  293   2HD2  LEU  42          2HD2      LEU  42   2.752  -4.545 -12.723
  294   3HD2  LEU  42          3HD2      LEU  42   2.252  -5.899 -11.694
  295    H    GLY  43           H        GLY  43   6.365  -8.938 -14.400
  296   1HA   GLY  43          1HA       GLY  43   7.610 -10.839 -13.549
  297   2HA   GLY  43          2HA       GLY  43   7.355 -10.096 -11.964
  298    H    THR  44           H        THR  44   9.165  -8.816 -14.741
  299    HA   THR  44           HA       THR  44  11.833  -9.667 -14.047
  300    HB   THR  44           HB       THR  44  10.760  -7.472 -15.800
  301    HG1  THR  44           HG1      THR  44  11.151  -9.645 -16.418
  302   1HG2  THR  44          1HG2      THR  44  13.050  -6.673 -16.409
  303   2HG2  THR  44          2HG2      THR  44  12.638  -6.227 -14.740
  304   3HG2  THR  44          3HG2      THR  44  13.746  -7.589 -15.049
  305    H    VAL  45           H        VAL  45   9.986  -6.805 -13.078
  306    HA   VAL  45           HA       VAL  45  12.177  -5.476 -11.585
  307    HB   VAL  45           HB       VAL  45   9.312  -4.873 -12.131
  308   1HG1  VAL  45          1HG1      VAL  45  11.700  -2.958 -11.771
  309   2HG1  VAL  45          2HG1      VAL  45  11.332  -3.775 -13.295
  310   3HG1  VAL  45          3HG1      VAL  45  10.157  -2.632 -12.604
  311   1HG2  VAL  45          1HG2      VAL  45   8.937  -3.273 -10.326
  312   2HG2  VAL  45          2HG2      VAL  45   9.343  -4.819  -9.546
  313   3HG2  VAL  45          3HG2      VAL  45  10.563  -3.542  -9.646
  314    H    MET  46           H        MET  46   9.532  -7.692 -10.846
  315    HA   MET  46           HA       MET  46   9.507  -7.563  -7.940
  316   1HB   MET  46          1HB       MET  46   8.458  -9.846  -7.981
  317   2HB   MET  46          2HB       MET  46   8.843 -10.000  -9.686
  318   1HG   MET  46          1HG       MET  46   7.319  -7.501  -9.225
  319   2HG   MET  46          2HG       MET  46   6.977  -8.849 -10.322
  320   1HE   MET  46          1HE       MET  46   7.010  -7.917  -6.388
  321   2HE   MET  46          2HE       MET  46   6.032  -9.271  -5.751
  322   3HE   MET  46          3HE       MET  46   7.639  -9.592  -6.463
  323    NH1  ARG  47           NH1      ARG  47  15.798 -14.609 -13.524
  324    NH2  ARG  47           NH2      ARG  47  17.000 -14.947 -11.625
  325    H    ARG  47           H        ARG  47  11.499  -9.341 -10.243
  326    HA   ARG  47           HA       ARG  47  12.887 -11.217  -8.533
  327   1HB   ARG  47          1HB       ARG  47  14.877 -10.682 -10.304
  328   2HB   ARG  47          2HB       ARG  47  13.564  -9.886 -11.161
  329   1HG   ARG  47          1HG       ARG  47  13.218 -12.767 -10.168
  330   2HG   ARG  47          2HG       ARG  47  12.273 -11.909 -11.385
  331   1HD   ARG  47          1HD       ARG  47  13.631 -13.150 -12.838
  332   2HD   ARG  47          2HD       ARG  47  14.642 -11.723 -12.669
  333    HE   ARG  47           HE       ARG  47  15.646 -13.264 -10.583
  334   1HH1  ARG  47          1HH1      ARG  47  15.040 -14.097 -13.989
  335   2HH1  ARG  47          2HH1      ARG  47  16.395 -15.333 -13.939
  336   1HH2  ARG  47          1HH2      ARG  47  17.162 -14.695 -10.644
  337   2HH2  ARG  47          2HH2      ARG  47  17.512 -15.648 -12.173
  338    H    MET  48           H        MET  48  13.796  -7.895  -9.479
  339    HA   MET  48           HA       MET  48  16.244  -7.524  -8.045
  340   1HB   MET  48          1HB       MET  48  15.058  -5.021  -7.671
  341   2HB   MET  48          2HB       MET  48  14.137  -5.646  -9.026
  342   1HG   MET  48          1HG       MET  48  15.929  -5.532 -10.511
  343   2HG   MET  48          2HG       MET  48  17.131  -5.972  -9.286
  344   1HE   MET  48          1HE       MET  48  15.799  -3.177 -11.472
  345   2HE   MET  48          2HE       MET  48  17.021  -1.971 -10.975
  346   3HE   MET  48          3HE       MET  48  17.539  -3.601 -11.496
  347    H    LEU  49           H        LEU  49  12.914  -7.482  -6.883
  348    HA   LEU  49           HA       LEU  49  13.110  -6.426  -4.239
  349   1HB   LEU  49          1HB       LEU  49  11.484  -8.967  -4.737
  350   2HB   LEU  49          2HB       LEU  49  11.041  -7.480  -5.547
  351    HG   LEU  49           HG       LEU  49  11.178  -7.864  -2.492
  352   1HD1  LEU  49          1HD1      LEU  49   8.694  -7.505  -4.283
  353   2HD1  LEU  49          2HD1      LEU  49   9.261  -9.067  -3.664
  354   3HD1  LEU  49          3HD1      LEU  49   8.714  -7.810  -2.528
  355   1HD2  LEU  49          1HD2      LEU  49  10.235  -5.606  -2.242
  356   2HD2  LEU  49          2HD2      LEU  49  11.692  -5.458  -3.255
  357   3HD2  LEU  49          3HD2      LEU  49  10.090  -5.404  -4.006
  358    H    GLY  50           H        GLY  50  13.114  -9.947  -4.852
  359   1HA   GLY  50          1HA       GLY  50  15.623 -10.680  -3.593
  360   2HA   GLY  50          2HA       GLY  50  14.429 -10.640  -2.288
  361    H    GLN  51           H        GLN  51  12.186 -11.397  -3.971
  362    HA   GLN  51           HA       GLN  51  12.487 -14.388  -3.745
  363   1HB   GLN  51          1HB       GLN  51   9.888 -13.355  -4.778
  364   2HB   GLN  51          2HB       GLN  51  10.236 -14.498  -3.495
  365   1HG   GLN  51          1HG       GLN  51  10.958 -12.431  -2.046
  366   2HG   GLN  51          2HG       GLN  51  10.238 -11.432  -3.290
  367   1HE2  GLN  51          1HE2      GLN  51   7.783 -13.542  -0.706
  368   2HE2  GLN  51          2HE2      GLN  51   9.601 -13.791  -0.749
  369    H    ASN  52           H        ASN  52  10.746 -15.255  -5.690
  370    HA   ASN  52           HA       ASN  52  11.522 -14.199  -8.378
  371   1HB   ASN  52          1HB       ASN  52  12.206 -17.138  -7.892
  372   2HB   ASN  52          2HB       ASN  52  13.369 -15.893  -7.489
  373   1HD2  ASN  52          1HD2      ASN  52  13.690 -17.221 -11.121
  374   2HD2  ASN  52          2HD2      ASN  52  13.599 -17.997  -9.460
  375    HA   PRO  53           HA       PRO  53   7.209 -16.136  -8.161
  376   1HB   PRO  53          1HB       PRO  53   5.810 -14.258  -9.619
  377   2HB   PRO  53          2HB       PRO  53   6.317 -14.033  -7.938
  378   1HG   PRO  53          1HG       PRO  53   7.663 -12.948 -10.456
  379   2HG   PRO  53          2HG       PRO  53   7.314 -12.084  -8.941
  380   1HD   PRO  53          1HD       PRO  53   9.263 -12.993  -7.877
  381   2HD   PRO  53          2HD       PRO  53   9.813 -13.238  -9.561
  382    H    THR  54           H        THR  54   5.545 -16.491 -10.101
  383    HA   THR  54           HA       THR  54   7.025 -17.343 -12.641
  384    HB   THR  54           HB       THR  54   6.307 -19.202 -10.814
  385    HG1  THR  54           HG1      THR  54   5.812 -20.051 -13.354
  386   1HG2  THR  54          1HG2      THR  54   4.279 -20.432 -11.513
  387   2HG2  THR  54          2HG2      THR  54   3.831 -18.804 -10.954
  388   3HG2  THR  54          3HG2      THR  54   3.868 -19.169 -12.698
  389    H    LYS  55           H        LYS  55   5.111 -18.173 -14.208
  390    HA   LYS  55           HA       LYS  55   3.757 -15.669 -15.045
  391   1HB   LYS  55          1HB       LYS  55   2.813 -17.097 -16.929
  392   2HB   LYS  55          2HB       LYS  55   3.515 -18.522 -16.193
  393   1HG   LYS  55          1HG       LYS  55   4.833 -16.319 -17.748
  394   2HG   LYS  55          2HG       LYS  55   5.786 -16.945 -16.415
  395   1HD   LYS  55          1HD       LYS  55   6.247 -18.109 -18.646
  396   2HD   LYS  55          2HD       LYS  55   4.573 -18.641 -18.692
  397   1HE   LYS  55          1HE       LYS  55   5.324 -19.636 -16.211
  398   2HE   LYS  55          2HE       LYS  55   5.312 -20.570 -17.705
  399   1HZ   LYS  55          1HZ       LYS  55   7.572 -19.523 -16.194
  400   2HZ   LYS  55          2HZ       LYS  55   7.741 -19.415 -17.834
  401   3HZ   LYS  55          3HZ       LYS  55   7.469 -20.883 -17.127
  402    H    GLU  56           H        GLU  56   2.850 -18.703 -13.500
  403    HA   GLU  56           HA       GLU  56  -0.083 -18.355 -13.662
  404   1HB   GLU  56          1HB       GLU  56   1.728 -20.292 -12.173
  405   2HB   GLU  56          2HB       GLU  56   0.026 -20.215 -11.761
  406   1HG   GLU  56          1HG       GLU  56   0.972 -21.931 -13.614
  407   2HG   GLU  56          2HG       GLU  56   0.813 -20.562 -14.699
  408    H    GLU  57           H        GLU  57   2.388 -17.850 -11.149
  409    HA   GLU  57           HA       GLU  57   0.560 -17.088  -8.962
  410   1HB   GLU  57          1HB       GLU  57   2.388 -16.733  -7.615
  411   2HB   GLU  57          2HB       GLU  57   3.376 -16.054  -8.891
  412   1HG   GLU  57          1HG       GLU  57   2.786 -18.970  -9.319
  413   2HG   GLU  57          2HG       GLU  57   4.309 -18.102  -9.469
  414    H    LEU  58           H        LEU  58   2.283 -15.341 -11.497
  415    HA   LEU  58           HA       LEU  58   1.836 -12.610 -10.440
  416   1HB   LEU  58          1HB       LEU  58   3.004 -13.817 -12.949
  417   2HB   LEU  58          2HB       LEU  58   2.394 -12.181 -13.089
  418    HG   LEU  58           HG       LEU  58   4.177 -12.698 -10.698
  419   1HD1  LEU  58          1HD1      LEU  58   4.331 -10.466 -12.830
  420   2HD1  LEU  58          2HD1      LEU  58   3.326 -10.355 -11.378
  421   3HD1  LEU  58          3HD1      LEU  58   5.095 -10.474 -11.220
  422   1HD2  LEU  58          1HD2      LEU  58   6.278 -12.771 -11.988
  423   2HD2  LEU  58          2HD2      LEU  58   5.238 -14.112 -12.528
  424   3HD2  LEU  58          3HD2      LEU  58   5.393 -12.658 -13.531
  425    H    ASP  59           H        ASP  59   0.210 -14.810 -12.659
  426    HA   ASP  59           HA       ASP  59  -1.663 -12.976 -13.933
  427   1HB   ASP  59          1HB       ASP  59  -2.055 -15.990 -13.475
  428   2HB   ASP  59          2HB       ASP  59  -1.163 -15.278 -14.800
  429    H    ALA  60           H        ALA  60  -1.831 -14.900 -10.960
  430    HA   ALA  60           HA       ALA  60  -4.660 -14.317 -10.289
  431   1HB   ALA  60          1HB       ALA  60  -4.124 -15.341  -8.084
  432   2HB   ALA  60          2HB       ALA  60  -3.537 -16.344  -9.425
  433   3HB   ALA  60          3HB       ALA  60  -2.389 -15.362  -8.480
  434    H    ILE  61           H        ILE  61  -1.506 -12.953  -9.417
  435    HA   ILE  61           HA       ILE  61  -2.263 -11.228  -7.206
  436    HB   ILE  61           HB       ILE  61   0.096 -11.401  -9.024
  437   1HG1  ILE  61          1HG1      ILE  61   0.868 -12.315  -7.084
  438   2HG1  ILE  61          2HG1      ILE  61  -0.528 -11.765  -6.182
  439   1HG2  ILE  61          1HG2      ILE  61   1.087  -9.194  -8.349
  440   2HG2  ILE  61          2HG2      ILE  61  -0.373  -8.951  -9.306
  441   3HG2  ILE  61          3HG2      ILE  61  -0.434  -8.738  -7.541
  442   1HD1  ILE  61          1HD1      ILE  61   0.517  -9.575  -5.667
  443   2HD1  ILE  61          2HD1      ILE  61   1.587 -10.910  -5.189
  444   3HD1  ILE  61          3HD1      ILE  61   1.933  -9.989  -6.671
  445    H    ILE  62           H        ILE  62  -2.326 -10.795 -10.721
  446    HA   ILE  62           HA       ILE  62  -3.150  -7.925 -10.668
  447    HB   ILE  62           HB       ILE  62  -2.714  -9.963 -12.857
  448   1HG1  ILE  62          1HG1      ILE  62  -1.653  -7.119 -12.303
  449   2HG1  ILE  62          2HG1      ILE  62  -0.769  -8.623 -12.152
  450   1HG2  ILE  62          1HG2      ILE  62  -3.617  -8.420 -14.620
  451   2HG2  ILE  62          2HG2      ILE  62  -4.908  -8.933 -13.537
  452   3HG2  ILE  62          3HG2      ILE  62  -4.214  -7.305 -13.367
  453   1HD1  ILE  62          1HD1      ILE  62  -1.697  -7.426 -14.830
  454   2HD1  ILE  62          2HD1      ILE  62  -0.041  -7.521 -14.195
  455   3HD1  ILE  62          3HD1      ILE  62  -0.899  -9.013 -14.645
  456    H    GLU  63           H        GLU  63  -4.673 -11.102 -11.055
  457    HA   GLU  63           HA       GLU  63  -7.372 -10.475 -11.689
  458   1HB   GLU  63          1HB       GLU  63  -6.807 -12.575  -9.558
  459   2HB   GLU  63          2HB       GLU  63  -6.215 -12.802 -11.193
  460   1HG   GLU  63          1HG       GLU  63  -9.170 -12.455 -10.366
  461   2HG   GLU  63          2HG       GLU  63  -8.638 -12.541 -12.036
  462    H    GLU  64           H        GLU  64  -5.658 -10.150  -8.624
  463    HA   GLU  64           HA       GLU  64  -7.992  -9.553  -6.921
  464   1HB   GLU  64          1HB       GLU  64  -5.105  -9.853  -6.549
  465   2HB   GLU  64          2HB       GLU  64  -6.426 -10.175  -5.443
  466   1HG   GLU  64          1HG       GLU  64  -4.784  -7.619  -5.780
  467   2HG   GLU  64          2HG       GLU  64  -6.416  -7.478  -5.147
  468    H    VAL  65           H        VAL  65  -5.257  -7.416  -7.800
  469    HA   VAL  65           HA       VAL  65  -6.977  -4.955  -7.476
  470    HB   VAL  65           HB       VAL  65  -4.852  -4.776  -6.410
  471   1HG1  VAL  65          1HG1      VAL  65  -4.591  -3.039  -8.949
  472   2HG1  VAL  65          2HG1      VAL  65  -5.735  -2.698  -7.637
  473   3HG1  VAL  65          3HG1      VAL  65  -3.984  -2.673  -7.314
  474   1HG2  VAL  65          1HG2      VAL  65  -2.640  -5.031  -7.421
  475   2HG2  VAL  65          2HG2      VAL  65  -3.563  -6.490  -7.857
  476   3HG2  VAL  65          3HG2      VAL  65  -3.321  -5.212  -9.056
  477    H    ASP  66           H        ASP  66  -8.348  -5.505  -9.269
  478    HA   ASP  66           HA       ASP  66  -7.727  -4.061 -11.750
  479   1HB   ASP  66          1HB       ASP  66  -7.457  -7.109 -11.947
  480   2HB   ASP  66          2HB       ASP  66  -6.245  -5.904 -12.313
  481    H    GLU  67           H        GLU  67  -9.702  -3.597 -10.245
  482    HA   GLU  67           HA       GLU  67 -12.179  -5.220 -10.800
  483   1HB   GLU  67          1HB       GLU  67 -11.577  -4.147  -8.538
  484   2HB   GLU  67          2HB       GLU  67 -13.237  -4.042  -9.092
  485   1HG   GLU  67          1HG       GLU  67 -12.377  -1.625 -10.050
  486   2HG   GLU  67          2HG       GLU  67 -11.159  -1.832  -8.804
  487    H    ASP  68           H        ASP  68 -10.729  -3.783 -12.995
  488    HA   ASP  68           HA       ASP  68 -12.915  -1.852 -13.929
  489   1HB   ASP  68          1HB       ASP  68 -11.220  -0.320 -13.892
  490   2HB   ASP  68          2HB       ASP  68 -10.949  -0.963 -15.495
  491    H    GLY  69           H        GLY  69 -10.579  -4.378 -14.793
  492   1HA   GLY  69          1HA       GLY  69 -12.468  -5.429 -16.950
  493   2HA   GLY  69          2HA       GLY  69 -11.136  -6.339 -16.224
  494    H    SER  70           H        SER  70  -9.209  -6.367 -17.149
  495    HA   SER  70           HA       SER  70  -8.796  -5.518 -19.921
  496   1HB   SER  70          1HB       SER  70  -8.626  -3.250 -19.270
  497   2HB   SER  70          2HB       SER  70  -6.954  -3.774 -19.492
  498    HG   SER  70           HG       SER  70  -8.400  -3.416 -17.090
  499    H    GLY  71           H        GLY  71  -7.014  -5.883 -16.832
  500   1HA   GLY  71          1HA       GLY  71  -5.322  -8.138 -18.051
  501   2HA   GLY  71          2HA       GLY  71  -5.675  -7.971 -16.326
  502    H    THR  72           H        THR  72  -4.827  -5.246 -18.365
  503    HA   THR  72           HA       THR  72  -1.948  -5.217 -17.427
  504    HB   THR  72           HB       THR  72  -1.901  -3.102 -19.032
  505    HG1  THR  72           HG1      THR  72  -3.391  -3.733 -20.811
  506   1HG2  THR  72          1HG2      THR  72  -1.341  -4.483 -20.992
  507   2HG2  THR  72          2HG2      THR  72  -0.628  -5.226 -19.544
  508   3HG2  THR  72          3HG2      THR  72  -2.095  -5.925 -20.278
  509    H    ILE  73           H        ILE  73  -1.110  -3.715 -16.102
  510    HA   ILE  73           HA       ILE  73  -3.018  -1.889 -14.582
  511    HB   ILE  73           HB       ILE  73  -0.175  -2.765 -13.852
  512   1HG1  ILE  73          1HG1      ILE  73  -2.885  -3.679 -12.680
  513   2HG1  ILE  73          2HG1      ILE  73  -1.320  -4.078 -12.004
  514   1HG2  ILE  73          1HG2      ILE  73  -0.537  -1.684 -11.637
  515   2HG2  ILE  73          2HG2      ILE  73  -0.733  -0.481 -12.919
  516   3HG2  ILE  73          3HG2      ILE  73  -2.168  -1.153 -12.108
  517   1HD1  ILE  73          1HD1      ILE  73  -0.667  -5.406 -13.994
  518   2HD1  ILE  73          2HD1      ILE  73  -2.225  -5.962 -13.345
  519   3HD1  ILE  73          3HD1      ILE  73  -2.188  -4.962 -14.818
  520    H    ASP  74           H        ASP  74  -3.219  -0.393 -16.272
  521    HA   ASP  74           HA       ASP  74  -0.955   1.039 -17.513
  522   1HB   ASP  74          1HB       ASP  74  -2.489   2.313 -18.710
  523   2HB   ASP  74          2HB       ASP  74  -3.645   2.405 -17.402
  524    H    PHE  75           H        PHE  75  -1.567   3.705 -17.282
  525    HA   PHE  75           HA       PHE  75  -0.161   4.341 -14.715
  526   1HB   PHE  75          1HB       PHE  75   0.259   5.396 -17.099
  527   2HB   PHE  75          2HB       PHE  75  -1.123   6.405 -16.769
  528    HD1  PHE  75           HD1      PHE  75  -0.847   7.182 -13.914
  529    HD2  PHE  75           HD2      PHE  75   2.236   6.674 -16.873
  530    HE1  PHE  75           HE1      PHE  75   0.539   8.866 -12.774
  531    HE2  PHE  75           HE2      PHE  75   3.611   8.355 -15.712
  532    HZ   PHE  75           HZ       PHE  75   2.754   9.476 -13.685
  533    H    GLU  76           H        GLU  76  -3.355   4.678 -16.136
  534    HA   GLU  76           HA       GLU  76  -4.496   6.684 -14.339
  535   1HB   GLU  76          1HB       GLU  76  -5.741   4.662 -16.227
  536   2HB   GLU  76          2HB       GLU  76  -6.756   5.538 -15.102
  537   1HG   GLU  76          1HG       GLU  76  -4.961   6.828 -17.253
  538   2HG   GLU  76          2HG       GLU  76  -6.692   6.588 -17.363
  539    H    GLU  77           H        GLU  77  -4.263   3.167 -14.192
  540    HA   GLU  77           HA       GLU  77  -5.872   3.012 -11.620
  541   1HB   GLU  77          1HB       GLU  77  -5.425   0.470 -11.912
  542   2HB   GLU  77          2HB       GLU  77  -6.602   1.275 -12.924
  543   1HG   GLU  77          1HG       GLU  77  -4.784   1.431 -14.773
  544   2HG   GLU  77          2HG       GLU  77  -3.762   0.415 -13.763
  545    H    PHE  78           H        PHE  78  -2.592   2.736 -12.818
  546    HA   PHE  78           HA       PHE  78  -1.240   1.369 -10.686
  547   1HB   PHE  78          1HB       PHE  78  -0.076   1.968 -12.773
  548   2HB   PHE  78          2HB       PHE  78  -0.223   3.679 -12.458
  549    HD1  PHE  78           HD1      PHE  78   1.197   4.697 -10.533
  550    HD2  PHE  78           HD2      PHE  78   1.642   0.583 -11.711
  551    HE1  PHE  78           HE1      PHE  78   3.394   4.605  -9.424
  552    HE2  PHE  78           HE2      PHE  78   3.835   0.510 -10.597
  553    HZ   PHE  78           HZ       PHE  78   4.710   2.512  -9.443
  554    H    LEU  79           H        LEU  79  -2.241   4.759 -10.954
  555    HA   LEU  79           HA       LEU  79  -0.916   5.744  -8.508
  556   1HB   LEU  79          1HB       LEU  79  -3.098   6.861 -10.332
  557   2HB   LEU  79          2HB       LEU  79  -2.812   7.629  -8.786
  558    HG   LEU  79           HG       LEU  79  -0.202   7.489  -9.821
  559   1HD1  LEU  79          1HD1      LEU  79  -0.313   8.299 -12.180
  560   2HD1  LEU  79          2HD1      LEU  79  -1.023   6.680 -12.041
  561   3HD1  LEU  79          3HD1      LEU  79  -2.084   8.102 -12.193
  562   1HD2  LEU  79          1HD2      LEU  79  -2.217   9.817 -10.123
  563   2HD2  LEU  79          2HD2      LEU  79  -1.173   9.509  -8.713
  564   3HD2  LEU  79          3HD2      LEU  79  -0.446   9.954 -10.264
  565    H    VAL  80           H        VAL  80  -4.179   4.550  -9.245
  566    HA   VAL  80           HA       VAL  80  -5.463   5.070  -6.673
  567    HB   VAL  80           HB       VAL  80  -6.089   3.203  -8.964
  568   1HG1  VAL  80          1HG1      VAL  80  -8.082   2.266  -7.773
  569   2HG1  VAL  80          2HG1      VAL  80  -6.583   1.744  -6.993
  570   3HG1  VAL  80          3HG1      VAL  80  -7.559   3.034  -6.252
  571   1HG2  VAL  80          1HG2      VAL  80  -7.810   5.334  -7.536
  572   2HG2  VAL  80          2HG2      VAL  80  -6.927   5.582  -9.060
  573   3HG2  VAL  80          3HG2      VAL  80  -8.260   4.419  -8.996
  574    H    MET  81           H        MET  81  -3.350   2.521  -7.875
  575    HA   MET  81           HA       MET  81  -3.528   0.486  -5.862
  576   1HB   MET  81          1HB       MET  81  -0.743   1.184  -6.830
  577   2HB   MET  81          2HB       MET  81  -1.937   0.773  -8.048
  578   1HG   MET  81          1HG       MET  81  -1.174  -1.375  -7.664
  579   2HG   MET  81          2HG       MET  81  -2.374  -1.348  -6.361
  580   1HE   MET  81          1HE       MET  81   0.104  -3.317  -6.411
  581   2HE   MET  81          2HE       MET  81   0.790  -3.189  -4.763
  582   3HE   MET  81          3HE       MET  81  -0.981  -3.295  -4.984
  583    H    MET  82           H        MET  82  -0.929   2.947  -5.897
  584    HA   MET  82           HA       MET  82  -0.059   2.491  -3.157
  585   1HB   MET  82          1HB       MET  82   1.213   3.646  -5.099
  586   2HB   MET  82          2HB       MET  82   1.502   4.186  -3.455
  587   1HG   MET  82          1HG       MET  82  -0.597   5.901  -4.280
  588   2HG   MET  82          2HG       MET  82   0.287   5.630  -5.786
  589   1HE   MET  82          1HE       MET  82   3.159   5.092  -3.271
  590   2HE   MET  82          2HE       MET  82   4.040   6.430  -4.066
  591   3HE   MET  82          3HE       MET  82   3.231   5.183  -5.060
  592    H    VAL  83           H        VAL  83  -2.527   4.564  -4.541
  593    HA   VAL  83           HA       VAL  83  -2.832   6.580  -2.470
  594    HB   VAL  83           HB       VAL  83  -4.130   6.019  -4.917
  595   1HG1  VAL  83          1HG1      VAL  83  -4.834   8.333  -3.007
  596   2HG1  VAL  83          2HG1      VAL  83  -3.346   8.285  -3.962
  597   3HG1  VAL  83          3HG1      VAL  83  -4.922   8.318  -4.787
  598   1HG2  VAL  83          1HG2      VAL  83  -6.535   6.210  -4.545
  599   2HG2  VAL  83          2HG2      VAL  83  -5.989   4.825  -3.571
  600   3HG2  VAL  83          3HG2      VAL  83  -6.330   6.372  -2.782
  601    NH1  ARG  84           NH1      ARG  84  -5.282  -2.159  -2.216
  602    NH2  ARG  84           NH2      ARG  84  -7.312  -2.916  -1.533
  603    H    ARG  84           H        ARG  84  -4.156   3.320  -2.862
  604    HA   ARG  84           HA       ARG  84  -6.231   3.270  -0.821
  605   1HB   ARG  84          1HB       ARG  84  -4.584   1.165  -2.233
  606   2HB   ARG  84          2HB       ARG  84  -5.289   0.693  -0.694
  607   1HG   ARG  84          1HG       ARG  84  -7.473   0.744  -1.452
  608   2HG   ARG  84          2HG       ARG  84  -7.206   2.100  -2.550
  609   1HD   ARG  84          1HD       ARG  84  -5.601   0.065  -3.692
  610   2HD   ARG  84          2HD       ARG  84  -7.179   0.591  -4.282
  611    HE   ARG  84           HE       ARG  84  -8.127  -1.466  -3.419
  612   1HH1  ARG  84          1HH1      ARG  84  -8.332  -2.807  -1.561
  613   2HH1  ARG  84          2HH1      ARG  84  -6.782  -3.607  -0.990
  614   1HH2  ARG  84          1HH2      ARG  84  -4.752  -1.456  -2.742
  615   2HH2  ARG  84          2HH2      ARG  84  -4.895  -2.922  -1.649
  616    H    GLN  85           H        GLN  85  -2.738   2.573  -0.642
  617    HA   GLN  85           HA       GLN  85  -2.724   1.806   2.232
  618   1HB   GLN  85          1HB       GLN  85  -0.498   1.286   1.967
  619   2HB   GLN  85          2HB       GLN  85  -1.042   1.159   0.305
  620   1HG   GLN  85          1HG       GLN  85  -0.241   3.873   0.497
  621   2HG   GLN  85          2HG       GLN  85   0.609   2.574  -0.309
  622   1HE2  GLN  85          1HE2      GLN  85   3.150   3.905   2.024
  623   2HE2  GLN  85          2HE2      GLN  85   2.255   4.401   0.501
  624    H    MET  86           H        MET  86  -2.210   4.742   0.362
  625    HA   MET  86           HA       MET  86  -0.917   6.420   2.376
  626   1HB   MET  86          1HB       MET  86  -2.033   6.830  -0.318
  627   2HB   MET  86          2HB       MET  86  -2.482   8.160   0.734
  628   1HG   MET  86          1HG       MET  86   0.187   7.490  -0.412
  629   2HG   MET  86          2HG       MET  86   0.271   7.842   1.322
  630   1HE   MET  86          1HE       MET  86  -2.159   9.178  -1.631
  631   2HE   MET  86          2HE       MET  86  -1.381  10.756  -1.951
  632   3HE   MET  86          3HE       MET  86  -0.500   9.242  -2.304
  633    H    LYS  87           H        LYS  87  -4.271   5.622   1.668
  634    HA   LYS  87           HA       LYS  87  -5.809   7.586   3.043
  635   1HB   LYS  87          1HB       LYS  87  -7.618   6.114   3.087
  636   2HB   LYS  87          2HB       LYS  87  -6.636   5.421   1.805
  637   1HG   LYS  87          1HG       LYS  87  -7.041   4.359   4.635
  638   2HG   LYS  87          2HG       LYS  87  -5.609   3.880   3.739
  639   1HD   LYS  87          1HD       LYS  87  -8.549   3.270   3.153
  640   2HD   LYS  87          2HD       LYS  87  -7.401   3.290   1.819
  641   1HE   LYS  87          1HE       LYS  87  -7.071   1.056   2.335
  642   2HE   LYS  87          2HE       LYS  87  -6.001   1.666   3.604
  643   1HZ   LYS  87          1HZ       LYS  87  -8.395   1.802   4.824
  644   2HZ   LYS  87          2HZ       LYS  87  -7.380   0.502   4.922
  645   3HZ   LYS  87          3HZ       LYS  87  -8.637   0.489   3.850
  646    H    GLU  88           H        GLU  88  -6.442   7.944   5.122
  647    HA   GLU  88           HA       GLU  88  -4.629   7.696   7.305
  648   1HB   GLU  88          1HB       GLU  88  -6.413   9.310   7.405
  649   2HB   GLU  88          2HB       GLU  88  -7.662   8.082   7.334
  650   1HG   GLU  88          1HG       GLU  88  -6.501   7.251   9.655
  651   2HG   GLU  88          2HG       GLU  88  -7.743   8.491   9.608
  652    H    ASP  89           H        ASP  89  -7.274   5.547   6.323
  653    HA   ASP  89           HA       ASP  89  -7.019   3.598   8.522
  654   1HB   ASP  89          1HB       ASP  89  -8.432   3.456   5.815
  655   2HB   ASP  89          2HB       ASP  89  -8.291   2.036   6.825
  656    H    ALA  90           H        ALA  90  -5.956   1.685   8.609
  657    HA   ALA  90           HA       ALA  90  -4.003   0.896   6.394
  658   1HB   ALA  90          1HB       ALA  90  -2.128   0.651   8.042
  659   2HB   ALA  90          2HB       ALA  90  -2.672   2.338   7.956
  660   3HB   ALA  90          3HB       ALA  90  -3.142   1.324   9.342
   
  Start of MODEL          37
 Raw file had  660 H/Q atoms
  Start of MODEL   37
    1   1H    ALA   1          1H        ALA   1 -22.468  -1.184 -15.332
    2   2H    ALA   1          2H        ALA   1 -23.006   0.121 -16.245
    3   3H    ALA   1          3H        ALA   1 -22.394  -1.245 -17.011
    4    HA   ALA   1           HA       ALA   1 -20.269  -0.752 -16.666
    5   1HB   ALA   1          1HB       ALA   1 -21.177   2.135 -16.290
    6   2HB   ALA   1          2HB       ALA   1 -21.670   1.275 -17.760
    7   3HB   ALA   1          3HB       ALA   1 -19.939   1.482 -17.389
    8    H    SER   2           H        SER   2 -18.597   0.098 -15.291
    9    HA   SER   2           HA       SER   2 -19.205   1.169 -12.541
   10   1HB   SER   2          1HB       SER   2 -19.711  -1.190 -12.160
   11   2HB   SER   2          2HB       SER   2 -18.178  -1.704 -12.870
   12    HG   SER   2           HG       SER   2 -18.743  -0.679 -10.399
   13    H    MET   3           H        MET   3 -17.829   2.826 -12.915
   14    HA   MET   3           HA       MET   3 -14.950   2.609 -12.523
   15   1HB   MET   3          1HB       MET   3 -14.112   3.166 -14.831
   16   2HB   MET   3          2HB       MET   3 -14.731   1.534 -14.656
   17   1HG   MET   3          1HG       MET   3 -16.832   2.140 -15.853
   18   2HG   MET   3          2HG       MET   3 -16.361   3.844 -15.887
   19   1HE   MET   3          1HE       MET   3 -17.081   2.297 -18.745
   20   2HE   MET   3          2HE       MET   3 -16.703   0.816 -17.817
   21   3HE   MET   3          3HE       MET   3 -15.789   1.189 -19.307
   22    H    THR   4           H        THR   4 -13.978   4.766 -13.813
   23    HA   THR   4           HA       THR   4 -14.166   7.103 -14.366
   24    HB   THR   4           HB       THR   4 -16.947   7.232 -13.174
   25    HG1  THR   4           HG1      THR   4 -16.018   6.205 -15.605
   26   1HG2  THR   4          1HG2      THR   4 -17.191   8.860 -15.259
   27   2HG2  THR   4          2HG2      THR   4 -15.424   9.012 -15.140
   28   3HG2  THR   4          3HG2      THR   4 -16.456   9.475 -13.763
   29    H    ASP   5           H        ASP   5 -16.031   6.605 -11.341
   30    HA   ASP   5           HA       ASP   5 -14.550   8.668  -9.827
   31   1HB   ASP   5          1HB       ASP   5 -17.007   7.843  -9.435
   32   2HB   ASP   5          2HB       ASP   5 -16.026   8.362  -8.083
   33    H    GLN   6           H        GLN   6 -14.250   5.215 -10.288
   34    HA   GLN   6           HA       GLN   6 -12.821   4.263  -8.021
   35   1HB   GLN   6          1HB       GLN   6 -11.808   3.323 -10.713
   36   2HB   GLN   6          2HB       GLN   6 -13.522   3.136 -10.395
   37   1HG   GLN   6          1HG       GLN   6 -12.634   1.074  -9.694
   38   2HG   GLN   6          2HG       GLN   6 -12.872   1.922  -8.183
   39   1HE2  GLN   6          1HE2      GLN   6  -8.981   1.182  -9.465
   40   2HE2  GLN   6          2HE2      GLN   6 -10.405   1.051 -10.614
   41    H    GLN   7           H        GLN   7 -11.589   6.089 -10.804
   42    HA   GLN   7           HA       GLN   7  -8.772   6.194  -9.599
   43   1HB   GLN   7          1HB       GLN   7  -9.256   5.412 -12.089
   44   2HB   GLN   7          2HB       GLN   7  -7.881   6.441 -11.713
   45   1HG   GLN   7          1HG       GLN   7  -9.844   8.361 -12.276
   46   2HG   GLN   7          2HG       GLN   7  -8.561   7.842 -13.358
   47   1HE2  GLN   7          1HE2      GLN   7 -11.075   5.370 -14.885
   48   2HE2  GLN   7          2HE2      GLN   7  -9.499   5.203 -13.959
   49    H    ALA   8           H        ALA   8 -11.398   8.185 -10.935
   50    HA   ALA   8           HA       ALA   8 -10.387  10.820 -10.917
   51   1HB   ALA   8          1HB       ALA   8 -12.702  11.612 -10.455
   52   2HB   ALA   8          2HB       ALA   8 -12.699  10.273 -11.619
   53   3HB   ALA   8          3HB       ALA   8 -13.191   9.983  -9.931
   54    H    GLU   9           H        GLU   9 -11.190   8.796  -8.157
   55    HA   GLU   9           HA       GLU   9 -11.306  10.817  -6.042
   56   1HB   GLU   9          1HB       GLU   9 -10.870   8.908  -4.423
   57   2HB   GLU   9          2HB       GLU   9 -12.268   8.729  -5.473
   58   1HG   GLU   9          1HG       GLU   9 -11.542   6.683  -6.103
   59   2HG   GLU   9          2HG       GLU   9 -10.168   7.417  -6.923
   60    H    ALA  10           H        ALA  10  -8.659   8.643  -7.073
   61    HA   ALA  10           HA       ALA  10  -6.652   9.584  -5.155
   62   1HB   ALA  10          1HB       ALA  10  -5.021   8.320  -6.546
   63   2HB   ALA  10          2HB       ALA  10  -6.489   7.369  -6.252
   64   3HB   ALA  10          3HB       ALA  10  -6.225   8.128  -7.843
   65    NH1  ARG  11           NH1      ARG  11  -6.514  13.818 -14.578
   66    NH2  ARG  11           NH2      ARG  11  -8.722  14.322 -14.411
   67    H    ARG  11           H        ARG  11  -7.710  10.726  -8.287
   68    HA   ARG  11           HA       ARG  11  -5.311  12.281  -9.103
   69   1HB   ARG  11          1HB       ARG  11  -8.236  12.595 -10.026
   70   2HB   ARG  11          2HB       ARG  11  -6.838  13.372 -10.754
   71   1HG   ARG  11          1HG       ARG  11  -5.959  10.775 -10.898
   72   2HG   ARG  11          2HG       ARG  11  -7.698  10.479 -10.949
   73   1HD   ARG  11          1HD       ARG  11  -5.929  11.816 -12.992
   74   2HD   ARG  11          2HD       ARG  11  -7.346  10.795 -13.244
   75    HE   ARG  11           HE       ARG  11  -8.488  13.156 -12.197
   76   1HH1  ARG  11          1HH1      ARG  11  -9.614  14.162 -13.929
   77   2HH1  ARG  11          2HH1      ARG  11  -8.556  14.951 -15.204
   78   1HH2  ARG  11          1HH2      ARG  11  -5.725  13.257 -14.239
   79   2HH2  ARG  11          2HH2      ARG  11  -6.498  14.501 -15.344
   80    H    ALA  12           H        ALA  12  -8.380  13.014  -7.467
   81    HA   ALA  12           HA       ALA  12  -8.069  15.942  -7.302
   82   1HB   ALA  12          1HB       ALA  12  -9.930  15.867  -5.657
   83   2HB   ALA  12          2HB       ALA  12 -10.289  14.870  -7.080
   84   3HB   ALA  12          3HB       ALA  12  -9.808  14.094  -5.551
   85    H    PHE  13           H        PHE  13  -7.006  13.228  -5.327
   86    HA   PHE  13           HA       PHE  13  -6.282  14.751  -2.898
   87   1HB   PHE  13          1HB       PHE  13  -6.829  12.400  -2.707
   88   2HB   PHE  13          2HB       PHE  13  -5.605  11.916  -3.851
   89    HD1  PHE  13           HD1      PHE  13  -3.107  13.200  -2.952
   90    HD2  PHE  13           HD2      PHE  13  -6.323  11.653  -0.544
   91    HE1  PHE  13           HE1      PHE  13  -1.557  12.876  -1.068
   92    HE2  PHE  13           HE2      PHE  13  -4.757  11.335   1.325
   93    HZ   PHE  13           HZ       PHE  13  -2.376  11.947   1.072
   94    H    LEU  14           H        LEU  14  -4.497  13.424  -5.684
   95    HA   LEU  14           HA       LEU  14  -1.843  14.564  -4.764
   96   1HB   LEU  14          1HB       LEU  14  -0.824  13.343  -6.603
   97   2HB   LEU  14          2HB       LEU  14  -2.364  13.056  -7.382
   98    HG   LEU  14           HG       LEU  14  -3.059  11.518  -5.508
   99   1HD1  LEU  14          1HD1      LEU  14  -1.548   9.627  -6.119
  100   2HD1  LEU  14          2HD1      LEU  14  -1.977  10.576  -7.555
  101   3HD1  LEU  14          3HD1      LEU  14  -0.365  10.762  -6.819
  102   1HD2  LEU  14          1HD2      LEU  14  -0.200  11.951  -4.408
  103   2HD2  LEU  14          2HD2      LEU  14  -1.715  12.442  -3.612
  104   3HD2  LEU  14          3HD2      LEU  14  -1.358  10.723  -3.836
  105    H    SER  15           H        SER  15  -0.541  15.666  -6.505
  106    HA   SER  15           HA       SER  15  -2.233  17.686  -8.083
  107   1HB   SER  15          1HB       SER  15   0.371  18.621  -6.877
  108   2HB   SER  15          2HB       SER  15  -0.979  18.357  -5.770
  109    HG   SER  15           HG       SER  15  -1.677  19.630  -8.106
  110    H    GLU  16           H        GLU  16   0.090  19.071  -9.020
  111    HA   GLU  16           HA       GLU  16   0.847  17.319 -11.330
  112   1HB   GLU  16          1HB       GLU  16   1.501  20.256 -10.748
  113   2HB   GLU  16          2HB       GLU  16   0.165  19.662 -11.715
  114   1HG   GLU  16          1HG       GLU  16   2.980  18.842 -12.561
  115   2HG   GLU  16          2HG       GLU  16   1.554  19.091 -13.554
  116    H    GLU  17           H        GLU  17   2.320  18.735  -8.472
  117    HA   GLU  17           HA       GLU  17   5.151  18.101  -9.230
  118   1HB   GLU  17          1HB       GLU  17   5.482  19.814  -7.843
  119   2HB   GLU  17          2HB       GLU  17   5.331  18.656  -6.536
  120   1HG   GLU  17          1HG       GLU  17   2.756  19.241  -6.540
  121   2HG   GLU  17          2HG       GLU  17   3.175  20.582  -7.592
  122    H    MET  18           H        MET  18   2.648  16.807  -7.069
  123    HA   MET  18           HA       MET  18   4.276  14.737  -5.733
  124   1HB   MET  18          1HB       MET  18   2.078  13.713  -5.042
  125   2HB   MET  18          2HB       MET  18   1.227  14.842  -6.080
  126   1HG   MET  18          1HG       MET  18   2.840  15.543  -3.554
  127   2HG   MET  18          2HG       MET  18   2.265  16.776  -4.689
  128   1HE   MET  18          1HE       MET  18   0.167  18.033  -4.192
  129   2HE   MET  18          2HE       MET  18  -0.838  17.616  -2.772
  130   3HE   MET  18          3HE       MET  18   0.921  17.872  -2.575
  131    H    ILE  19           H        ILE  19   2.324  14.892  -8.667
  132    HA   ILE  19           HA       ILE  19   2.109  12.042  -9.271
  133    HB   ILE  19           HB       ILE  19   1.800  14.546 -10.948
  134   1HG1  ILE  19          1HG1      ILE  19  -0.053  13.533  -9.394
  135   2HG1  ILE  19          2HG1      ILE  19  -0.164  12.210 -10.535
  136   1HG2  ILE  19          1HG2      ILE  19   1.277  13.209 -13.004
  137   2HG2  ILE  19          2HG2      ILE  19   2.956  12.960 -12.527
  138   3HG2  ILE  19          3HG2      ILE  19   1.746  11.705 -12.173
  139   1HD1  ILE  19          1HD1      ILE  19  -0.884  13.699 -12.381
  140   2HD1  ILE  19          2HD1      ILE  19  -1.920  13.923 -10.957
  141   3HD1  ILE  19          3HD1      ILE  19  -0.673  15.133 -11.339
  142    H    ALA  20           H        ALA  20   4.571  14.501  -9.887
  143    HA   ALA  20           HA       ALA  20   6.247  13.247 -11.839
  144   1HB   ALA  20          1HB       ALA  20   8.092  14.681 -10.972
  145   2HB   ALA  20          2HB       ALA  20   6.571  15.586 -11.098
  146   3HB   ALA  20          3HB       ALA  20   7.157  15.048  -9.504
  147    H    GLU  21           H        GLU  21   6.176  12.802  -8.314
  148    HA   GLU  21           HA       GLU  21   8.646  11.275  -7.989
  149   1HB   GLU  21          1HB       GLU  21   7.878  10.693  -5.767
  150   2HB   GLU  21          2HB       GLU  21   6.203  11.024  -6.162
  151   1HG   GLU  21          1HG       GLU  21   6.503  13.395  -6.078
  152   2HG   GLU  21          2HG       GLU  21   8.225  13.304  -6.404
  153    H    PHE  22           H        PHE  22   5.315  10.391  -8.746
  154    HA   PHE  22           HA       PHE  22   5.714   7.431  -8.531
  155   1HB   PHE  22          1HB       PHE  22   3.326   8.937  -9.763
  156   2HB   PHE  22          2HB       PHE  22   3.389   7.242  -9.365
  157    HD1  PHE  22           HD1      PHE  22   3.619  10.636  -7.710
  158    HD2  PHE  22           HD2      PHE  22   2.827   6.439  -7.174
  159    HE1  PHE  22           HE1      PHE  22   2.793  11.072  -5.435
  160    HE2  PHE  22           HE2      PHE  22   2.004   6.896  -4.900
  161    HZ   PHE  22           HZ       PHE  22   2.006   9.205  -4.019
  162    H    LYS  23           H        LYS  23   5.919   9.908 -10.991
  163    HA   LYS  23           HA       LYS  23   5.618   8.344 -13.442
  164   1HB   LYS  23          1HB       LYS  23   7.054  10.974 -12.828
  165   2HB   LYS  23          2HB       LYS  23   7.275  10.213 -14.388
  166   1HG   LYS  23          1HG       LYS  23   4.907  11.684 -13.302
  167   2HG   LYS  23          2HG       LYS  23   4.483  10.198 -14.136
  168   1HD   LYS  23          1HD       LYS  23   4.468  12.185 -15.672
  169   2HD   LYS  23          2HD       LYS  23   6.185  12.465 -15.355
  170   1HE   LYS  23          1HE       LYS  23   5.570   9.657 -16.260
  171   2HE   LYS  23          2HE       LYS  23   6.881  10.737 -16.758
  172   1HZ   LYS  23          1HZ       LYS  23   4.886  12.011 -17.895
  173   2HZ   LYS  23          2HZ       LYS  23   4.155  10.531 -17.832
  174   3HZ   LYS  23          3HZ       LYS  23   5.590  10.710 -18.630
  175    H    ALA  24           H        ALA  24   8.575   9.376 -11.704
  176    HA   ALA  24           HA       ALA  24  10.601   8.188 -13.332
  177   1HB   ALA  24          1HB       ALA  24  12.061   8.208 -11.319
  178   2HB   ALA  24          2HB       ALA  24  11.127   9.710 -11.451
  179   3HB   ALA  24          3HB       ALA  24  10.654   8.469 -10.262
  180    H    ALA  25           H        ALA  25   9.205   6.751 -10.359
  181    HA   ALA  25           HA       ALA  25  10.443   4.098 -10.636
  182   1HB   ALA  25          1HB       ALA  25   8.918   3.422  -8.791
  183   2HB   ALA  25          2HB       ALA  25   9.695   4.978  -8.442
  184   3HB   ALA  25          3HB       ALA  25   7.990   4.931  -8.958
  185    H    PHE  26           H        PHE  26   7.563   5.561 -11.946
  186    HA   PHE  26           HA       PHE  26   5.898   3.170 -12.386
  187   1HB   PHE  26          1HB       PHE  26   4.836   5.365 -12.462
  188   2HB   PHE  26          2HB       PHE  26   5.835   5.905 -13.785
  189    HD1  PHE  26           HD1      PHE  26   5.264   5.249 -16.121
  190    HD2  PHE  26           HD2      PHE  26   3.045   3.593 -12.829
  191    HE1  PHE  26           HE1      PHE  26   3.550   4.416 -17.681
  192    HE2  PHE  26           HE2      PHE  26   1.339   2.772 -14.403
  193    HZ   PHE  26           HZ       PHE  26   1.590   3.176 -16.827
  194    H    ASP  27           H        ASP  27   8.297   4.911 -14.347
  195    HA   ASP  27           HA       ASP  27   8.081   3.255 -16.777
  196   1HB   ASP  27          1HB       ASP  27  10.056   5.348 -15.832
  197   2HB   ASP  27          2HB       ASP  27  10.592   4.244 -17.078
  198    H    MET  28           H        MET  28  10.149   3.194 -13.899
  199    HA   MET  28           HA       MET  28  12.038   1.131 -14.504
  200   1HB   MET  28          1HB       MET  28  10.796   2.050 -11.913
  201   2HB   MET  28          2HB       MET  28  12.475   2.006 -12.418
  202   1HG   MET  28          1HG       MET  28  10.942  -0.578 -11.742
  203   2HG   MET  28          2HG       MET  28  12.692  -0.374 -11.921
  204   1HE   MET  28          1HE       MET  28  11.881  -1.812  -9.368
  205   2HE   MET  28          2HE       MET  28  11.303  -0.846  -7.978
  206   3HE   MET  28          3HE       MET  28  10.229  -1.117  -9.382
  207    H    PHE  29           H        PHE  29   8.862   0.655 -12.920
  208    HA   PHE  29           HA       PHE  29   8.651  -2.187 -12.974
  209   1HB   PHE  29          1HB       PHE  29   6.383  -0.145 -13.370
  210   2HB   PHE  29          2HB       PHE  29   6.099  -1.856 -13.195
  211    HD1  PHE  29           HD1      PHE  29   7.906  -2.740 -11.024
  212    HD2  PHE  29           HD2      PHE  29   5.754   0.973 -11.376
  213    HE1  PHE  29           HE1      PHE  29   7.901  -2.496  -8.575
  214    HE2  PHE  29           HE2      PHE  29   5.754   1.191  -8.925
  215    HZ   PHE  29           HZ       PHE  29   6.812  -0.544  -7.522
  216    H    ASP  30           H        ASP  30   7.785   0.145 -15.529
  217    HA   ASP  30           HA       ASP  30   6.767  -1.649 -17.560
  218   1HB   ASP  30          1HB       ASP  30   8.405   0.802 -18.351
  219   2HB   ASP  30          2HB       ASP  30   6.876   1.000 -17.526
  220    H    ALA  31           H        ALA  31   7.728  -2.727 -19.250
  221    HA   ALA  31           HA       ALA  31  10.727  -3.337 -18.989
  222   1HB   ALA  31          1HB       ALA  31  10.201  -5.636 -19.809
  223   2HB   ALA  31          2HB       ALA  31   9.325  -5.255 -18.314
  224   3HB   ALA  31          3HB       ALA  31   8.466  -5.247 -19.876
  225    H    ASP  32           H        ASP  32   7.984  -2.932 -21.204
  226    HA   ASP  32           HA       ASP  32   9.701  -3.091 -23.687
  227   1HB   ASP  32          1HB       ASP  32   7.808  -3.955 -24.529
  228   2HB   ASP  32          2HB       ASP  32   7.233  -2.309 -24.650
  229    H    GLY  33           H        GLY  33   7.111  -0.755 -22.997
  230   1HA   GLY  33          1HA       GLY  33   8.190   1.714 -22.392
  231   2HA   GLY  33          2HA       GLY  33   8.879   1.501 -23.985
  232    H    GLY  34           H        GLY  34   5.663   0.700 -22.630
  233   1HA   GLY  34          1HA       GLY  34   4.260   2.331 -24.811
  234   2HA   GLY  34          2HA       GLY  34   3.496   1.067 -23.838
  235    H    GLY  35           H        GLY  35   1.882   2.169 -22.925
  236   1HA   GLY  35          1HA       GLY  35   2.590   4.338 -20.864
  237   2HA   GLY  35          2HA       GLY  35   1.150   4.517 -21.877
  238    H    ASP  36           H        ASP  36   2.367   1.475 -20.561
  239    HA   ASP  36           HA       ASP  36   0.419   1.315 -18.293
  240   1HB   ASP  36          1HB       ASP  36  -0.330  -1.018 -19.767
  241   2HB   ASP  36          2HB       ASP  36  -1.330   0.321 -19.252
  242    H    ILE  37           H        ILE  37   0.359  -1.371 -17.913
  243    HA   ILE  37           HA       ILE  37   3.206  -2.444 -18.065
  244    HB   ILE  37           HB       ILE  37   1.911  -3.001 -15.456
  245   1HG1  ILE  37          1HG1      ILE  37   2.401  -0.135 -16.197
  246   2HG1  ILE  37          2HG1      ILE  37   1.362  -0.826 -14.965
  247   1HG2  ILE  37          1HG2      ILE  37   4.228  -2.912 -14.622
  248   2HG2  ILE  37          2HG2      ILE  37   4.163  -3.874 -16.106
  249   3HG2  ILE  37          3HG2      ILE  37   4.802  -2.214 -16.156
  250   1HD1  ILE  37          1HD1      ILE  37   4.395  -0.405 -14.649
  251   2HD1  ILE  37          2HD1      ILE  37   3.085   0.501 -13.860
  252   3HD1  ILE  37          3HD1      ILE  37   3.351  -1.208 -13.445
  253    H    SER  38           H        SER  38   2.976  -4.749 -16.743
  254    HA   SER  38           HA       SER  38   0.525  -6.286 -17.630
  255   1HB   SER  38          1HB       SER  38   2.312  -5.951 -19.607
  256   2HB   SER  38          2HB       SER  38   1.388  -7.443 -19.412
  257    HG   SER  38           HG       SER  38   3.196  -8.388 -19.195
  258    H    THR  39           H        THR  39   1.377  -8.792 -17.447
  259    HA   THR  39           HA       THR  39   2.047  -9.147 -14.531
  260    HB   THR  39           HB       THR  39   1.687 -11.666 -15.111
  261    HG1  THR  39           HG1      THR  39   0.759 -12.119 -16.936
  262   1HG2  THR  39          1HG2      THR  39  -0.753 -11.522 -14.875
  263   2HG2  THR  39          2HG2      THR  39  -0.007 -10.295 -13.826
  264   3HG2  THR  39          3HG2      THR  39  -0.762  -9.813 -15.368
  265    H    LYS  40           H        LYS  40   3.434  -9.741 -17.719
  266    HA   LYS  40           HA       LYS  40   5.730 -11.397 -16.871
  267   1HB   LYS  40          1HB       LYS  40   5.348  -9.721 -19.408
  268   2HB   LYS  40          2HB       LYS  40   4.823 -11.374 -19.229
  269   1HG   LYS  40          1HG       LYS  40   7.766 -10.553 -18.850
  270   2HG   LYS  40          2HG       LYS  40   7.153 -12.147 -19.203
  271   1HD   LYS  40          1HD       LYS  40   8.376 -10.937 -21.145
  272   2HD   LYS  40          2HD       LYS  40   6.869 -11.741 -21.474
  273   1HE   LYS  40          1HE       LYS  40   6.260  -9.891 -22.584
  274   2HE   LYS  40          2HE       LYS  40   5.835  -9.230 -21.011
  275   1HZ   LYS  40          1HZ       LYS  40   8.626  -8.877 -21.802
  276   2HZ   LYS  40          2HZ       LYS  40   7.585  -7.799 -21.105
  277   3HZ   LYS  40          3HZ       LYS  40   7.522  -8.074 -22.733
  278    H    GLU  41           H        GLU  41   5.056  -7.954 -17.268
  279    HA   GLU  41           HA       GLU  41   7.864  -6.998 -16.979
  280   1HB   GLU  41          1HB       GLU  41   7.000  -4.745 -17.029
  281   2HB   GLU  41          2HB       GLU  41   5.368  -5.275 -16.682
  282   1HG   GLU  41          1HG       GLU  41   6.916  -5.706 -19.308
  283   2HG   GLU  41          2HG       GLU  41   5.410  -6.529 -18.960
  284    H    LEU  42           H        LEU  42   4.936  -6.722 -14.935
  285    HA   LEU  42           HA       LEU  42   6.191  -5.495 -12.611
  286   1HB   LEU  42          1HB       LEU  42   3.655  -7.225 -12.785
  287   2HB   LEU  42          2HB       LEU  42   3.736  -5.484 -12.939
  288    HG   LEU  42           HG       LEU  42   4.851  -6.501 -10.343
  289   1HD1  LEU  42          1HD1      LEU  42   3.502  -4.594  -9.428
  290   2HD1  LEU  42          2HD1      LEU  42   4.540  -4.066 -10.761
  291   3HD1  LEU  42          3HD1      LEU  42   2.796  -4.302 -11.038
  292   1HD2  LEU  42          1HD2      LEU  42   1.823  -6.817 -10.897
  293   2HD2  LEU  42          2HD2      LEU  42   2.973  -8.142 -10.594
  294   3HD2  LEU  42          3HD2      LEU  42   2.619  -6.973  -9.310
  295    H    GLY  43           H        GLY  43   5.763  -8.847 -13.617
  296   1HA   GLY  43          1HA       GLY  43   6.397 -10.248 -11.125
  297   2HA   GLY  43          2HA       GLY  43   6.549 -10.950 -12.742
  298    H    THR  44           H        THR  44   8.370  -8.904 -13.726
  299    HA   THR  44           HA       THR  44  10.902 -10.278 -13.000
  300    HB   THR  44           HB       THR  44  10.122  -8.244 -15.069
  301    HG1  THR  44           HG1      THR  44  10.852  -9.750 -16.336
  302   1HG2  THR  44          1HG2      THR  44  12.492  -7.838 -15.755
  303   2HG2  THR  44          2HG2      THR  44  12.146  -7.101 -14.177
  304   3HG2  THR  44          3HG2      THR  44  13.072  -8.622 -14.264
  305    H    VAL  45           H        VAL  45   9.665  -6.948 -12.688
  306    HA   VAL  45           HA       VAL  45  11.920  -5.679 -11.446
  307    HB   VAL  45           HB       VAL  45   9.123  -4.972 -11.852
  308   1HG1  VAL  45          1HG1      VAL  45   8.803  -3.356  -9.978
  309   2HG1  VAL  45          2HG1      VAL  45   8.887  -5.009  -9.356
  310   3HG1  VAL  45          3HG1      VAL  45  10.294  -3.934  -9.188
  311   1HG2  VAL  45          1HG2      VAL  45  11.600  -3.182 -11.382
  312   2HG2  VAL  45          2HG2      VAL  45  11.019  -3.760 -12.961
  313   3HG2  VAL  45          3HG2      VAL  45  10.023  -2.644 -12.017
  314    H    MET  46           H        MET  46   9.302  -7.620 -10.059
  315    HA   MET  46           HA       MET  46   9.984  -7.196  -7.201
  316   1HB   MET  46          1HB       MET  46   8.265  -9.386  -8.509
  317   2HB   MET  46          2HB       MET  46   8.479  -9.195  -6.778
  318   1HG   MET  46          1HG       MET  46   6.915  -7.423  -8.698
  319   2HG   MET  46          2HG       MET  46   7.607  -6.673  -7.249
  320   1HE   MET  46          1HE       MET  46   4.598  -6.406  -7.325
  321   2HE   MET  46          2HE       MET  46   4.049  -7.115  -5.778
  322   3HE   MET  46          3HE       MET  46   5.509  -6.084  -5.817
  323    NH1  ARG  47           NH1      ARG  47  17.132 -13.145  -8.769
  324    NH2  ARG  47           NH2      ARG  47  17.767 -13.628 -10.897
  325    H    ARG  47           H        ARG  47  10.744  -9.597  -9.684
  326    HA   ARG  47           HA       ARG  47  12.193 -11.653  -8.346
  327   1HB   ARG  47          1HB       ARG  47  11.910 -10.914 -11.011
  328   2HB   ARG  47          2HB       ARG  47  13.614 -10.571 -10.746
  329   1HG   ARG  47          1HG       ARG  47  13.315 -12.881 -11.592
  330   2HG   ARG  47          2HG       ARG  47  12.238 -13.278 -10.253
  331   1HD   ARG  47          1HD       ARG  47  14.540 -12.357  -8.884
  332   2HD   ARG  47          2HD       ARG  47  14.067 -14.032  -9.124
  333    HE   ARG  47           HE       ARG  47  15.447 -13.570 -11.501
  334   1HH1  ARG  47          1HH1      ARG  47  16.362 -12.954  -8.118
  335   2HH1  ARG  47          2HH1      ARG  47  18.132 -13.178  -8.544
  336   1HH2  ARG  47          1HH2      ARG  47  17.486 -13.804 -11.868
  337   2HH2  ARG  47          2HH2      ARG  47  18.723 -13.627 -10.524
  338    H    MET  48           H        MET  48  13.092  -8.295  -8.898
  339    HA   MET  48           HA       MET  48  15.876  -8.577  -7.763
  340   1HB   MET  48          1HB       MET  48  14.317  -6.293  -9.021
  341   2HB   MET  48          2HB       MET  48  15.615  -5.893  -7.911
  342   1HG   MET  48          1HG       MET  48  16.856  -7.799  -9.595
  343   2HG   MET  48          2HG       MET  48  15.785  -6.921 -10.699
  344   1HE   MET  48          1HE       MET  48  15.522  -3.988 -10.115
  345   2HE   MET  48          2HE       MET  48  17.044  -3.282 -10.732
  346   3HE   MET  48          3HE       MET  48  16.225  -4.579 -11.652
  347    H    LEU  49           H        LEU  49  14.951  -9.542  -5.794
  348    HA   LEU  49           HA       LEU  49  14.880  -7.462  -3.611
  349   1HB   LEU  49          1HB       LEU  49  12.550  -9.442  -3.950
  350   2HB   LEU  49          2HB       LEU  49  12.457  -7.705  -4.149
  351    HG   LEU  49           HG       LEU  49  13.511  -8.120  -1.493
  352   1HD1  LEU  49          1HD1      LEU  49  11.394  -6.997  -0.791
  353   2HD1  LEU  49          2HD1      LEU  49  12.086  -6.196  -2.214
  354   3HD1  LEU  49          3HD1      LEU  49  10.681  -7.275  -2.401
  355   1HD2  LEU  49          1HD2      LEU  49  11.046  -9.915  -2.021
  356   2HD2  LEU  49          2HD2      LEU  49  12.663 -10.473  -1.526
  357   3HD2  LEU  49          3HD2      LEU  49  11.696  -9.489  -0.418
  358    H    GLY  50           H        GLY  50  13.845 -10.867  -3.690
  359   1HA   GLY  50          1HA       GLY  50  15.327 -11.875  -1.456
  360   2HA   GLY  50          2HA       GLY  50  16.468 -11.997  -2.803
  361    H    GLN  51           H        GLN  51  12.944 -12.361  -2.937
  362    HA   GLN  51           HA       GLN  51  13.015 -15.372  -3.138
  363   1HB   GLN  51          1HB       GLN  51  10.791 -15.345  -2.667
  364   2HB   GLN  51          2HB       GLN  51  11.162 -13.743  -2.058
  365   1HG   GLN  51          1HG       GLN  51  10.500 -12.852  -4.443
  366   2HG   GLN  51          2HG       GLN  51   9.840 -14.445  -4.740
  367   1HE2  GLN  51          1HE2      GLN  51   7.589 -11.772  -2.706
  368   2HE2  GLN  51          2HE2      GLN  51   9.188 -11.373  -3.512
  369    H    ASN  52           H        ASN  52  11.189 -15.959  -5.013
  370    HA   ASN  52           HA       ASN  52  11.827 -14.671  -7.633
  371   1HB   ASN  52          1HB       ASN  52  13.747 -16.352  -6.972
  372   2HB   ASN  52          2HB       ASN  52  12.624 -17.624  -7.401
  373   1HD2  ASN  52          1HD2      ASN  52  14.804 -16.532 -10.380
  374   2HD2  ASN  52          2HD2      ASN  52  15.178 -16.887  -8.618
  375    HA   PRO  53           HA       PRO  53   7.573 -16.733  -7.403
  376   1HB   PRO  53          1HB       PRO  53   6.072 -14.786  -8.656
  377   2HB   PRO  53          2HB       PRO  53   6.639 -14.679  -6.983
  378   1HG   PRO  53          1HG       PRO  53   7.859 -13.363  -9.454
  379   2HG   PRO  53          2HG       PRO  53   7.550 -12.632  -7.862
  380   1HD   PRO  53          1HD       PRO  53   9.561 -13.569  -6.949
  381   2HD   PRO  53          2HD       PRO  53  10.048 -13.665  -8.668
  382    H    THR  54           H        THR  54   5.841 -16.981  -9.301
  383    HA   THR  54           HA       THR  54   7.275 -17.721 -11.906
  384    HB   THR  54           HB       THR  54   6.817 -19.776 -10.734
  385    HG1  THR  54           HG1      THR  54   4.724 -19.943 -12.472
  386   1HG2  THR  54          1HG2      THR  54   4.561 -20.596 -10.139
  387   2HG2  THR  54          2HG2      THR  54   4.919 -19.110  -9.230
  388   3HG2  THR  54          3HG2      THR  54   3.821 -19.054 -10.633
  389    H    LYS  55           H        LYS  55   5.814 -17.835 -13.770
  390    HA   LYS  55           HA       LYS  55   4.445 -15.258 -14.120
  391   1HB   LYS  55          1HB       LYS  55   5.160 -17.589 -15.865
  392   2HB   LYS  55          2HB       LYS  55   5.339 -15.871 -16.155
  393   1HG   LYS  55          1HG       LYS  55   2.569 -16.160 -16.321
  394   2HG   LYS  55          2HG       LYS  55   3.680 -16.047 -17.674
  395   1HD   LYS  55          1HD       LYS  55   3.851 -18.783 -17.169
  396   2HD   LYS  55          2HD       LYS  55   2.748 -18.043 -18.319
  397   1HE   LYS  55          1HE       LYS  55   2.027 -19.683 -16.148
  398   2HE   LYS  55          2HE       LYS  55   1.599 -18.078 -15.560
  399   1HZ   LYS  55          1HZ       LYS  55  -0.103 -19.404 -16.939
  400   2HZ   LYS  55          2HZ       LYS  55   0.760 -18.948 -18.272
  401   3HZ   LYS  55          3HZ       LYS  55   0.073 -17.802 -17.301
  402    H    GLU  56           H        GLU  56   3.403 -18.597 -13.640
  403    HA   GLU  56           HA       GLU  56   0.531 -18.245 -14.113
  404   1HB   GLU  56          1HB       GLU  56   2.294 -20.418 -13.320
  405   2HB   GLU  56          2HB       GLU  56   0.910 -20.411 -12.246
  406   1HG   GLU  56          1HG       GLU  56   0.921 -21.746 -14.606
  407   2HG   GLU  56          2HG       GLU  56   0.399 -20.199 -15.252
  408    H    GLU  57           H        GLU  57   2.613 -18.009 -11.259
  409    HA   GLU  57           HA       GLU  57   0.498 -17.669  -9.210
  410   1HB   GLU  57          1HB       GLU  57   3.459 -16.918  -9.097
  411   2HB   GLU  57          2HB       GLU  57   2.753 -18.445  -8.612
  412   1HG   GLU  57          1HG       GLU  57   1.522 -16.109  -7.180
  413   2HG   GLU  57          2HG       GLU  57   2.079 -17.649  -6.537
  414    H    LEU  58           H        LEU  58   2.309 -15.553 -11.365
  415    HA   LEU  58           HA       LEU  58   1.724 -12.983 -10.095
  416   1HB   LEU  58          1HB       LEU  58   2.853 -13.897 -12.738
  417   2HB   LEU  58          2HB       LEU  58   2.173 -12.283 -12.716
  418    HG   LEU  58           HG       LEU  58   3.987 -12.827 -10.388
  419   1HD1  LEU  58          1HD1      LEU  58   4.175 -10.625 -12.548
  420   2HD1  LEU  58          2HD1      LEU  58   3.152 -10.490 -11.110
  421   3HD1  LEU  58          3HD1      LEU  58   4.919 -10.613 -10.929
  422   1HD2  LEU  58          1HD2      LEU  58   6.103 -12.924 -11.651
  423   2HD2  LEU  58          2HD2      LEU  58   5.066 -14.269 -12.186
  424   3HD2  LEU  58          3HD2      LEU  58   5.238 -12.829 -13.206
  425    H    ASP  59           H        ASP  59   0.104 -14.966 -12.523
  426    HA   ASP  59           HA       ASP  59  -1.951 -13.213 -13.539
  427   1HB   ASP  59          1HB       ASP  59  -2.105 -16.236 -13.029
  428   2HB   ASP  59          2HB       ASP  59  -1.620 -15.438 -14.507
  429    H    ALA  60           H        ALA  60  -1.697 -14.982 -10.494
  430    HA   ALA  60           HA       ALA  60  -4.457 -14.419  -9.524
  431   1HB   ALA  60          1HB       ALA  60  -3.669 -15.410  -7.380
  432   2HB   ALA  60          2HB       ALA  60  -3.245 -16.437  -8.764
  433   3HB   ALA  60          3HB       ALA  60  -1.992 -15.444  -7.975
  434    H    ILE  61           H        ILE  61  -1.209 -13.087  -8.984
  435    HA   ILE  61           HA       ILE  61  -1.667 -11.100  -6.953
  436    HB   ILE  61           HB       ILE  61   0.349 -11.451  -9.109
  437   1HG1  ILE  61          1HG1      ILE  61   0.250 -11.474  -6.211
  438   2HG1  ILE  61          2HG1      ILE  61   1.571 -11.934  -7.263
  439   1HG2  ILE  61          1HG2      ILE  61   1.307  -9.133  -8.975
  440   2HG2  ILE  61          2HG2      ILE  61  -0.305  -9.097  -9.686
  441   3HG2  ILE  61          3HG2      ILE  61  -0.079  -8.597  -7.994
  442   1HD1  ILE  61          1HD1      ILE  61   1.151  -9.092  -6.161
  443   2HD1  ILE  61          2HD1      ILE  61   2.397 -10.269  -5.692
  444   3HD1  ILE  61          3HD1      ILE  61   2.425  -9.558  -7.322
  445    H    ILE  62           H        ILE  62  -2.419 -11.129 -10.407
  446    HA   ILE  62           HA       ILE  62  -3.330  -8.293 -10.574
  447    HB   ILE  62           HB       ILE  62  -3.621 -10.611 -12.549
  448   1HG1  ILE  62          1HG1      ILE  62  -1.398 -10.119 -12.884
  449   2HG1  ILE  62          2HG1      ILE  62  -1.490  -8.590 -12.037
  450   1HG2  ILE  62          1HG2      ILE  62  -4.378  -8.937 -14.261
  451   2HG2  ILE  62          2HG2      ILE  62  -5.525  -9.007 -12.925
  452   3HG2  ILE  62          3HG2      ILE  62  -4.380  -7.650 -13.030
  453   1HD1  ILE  62          1HD1      ILE  62  -2.331  -7.393 -14.040
  454   2HD1  ILE  62          2HD1      ILE  62  -0.836  -8.274 -14.417
  455   3HD1  ILE  62          3HD1      ILE  62  -2.402  -8.925 -14.954
  456    H    GLU  63           H        GLU  63  -4.823 -11.511 -10.307
  457    HA   GLU  63           HA       GLU  63  -7.606 -10.939 -10.394
  458   1HB   GLU  63          1HB       GLU  63  -6.320 -13.210  -9.961
  459   2HB   GLU  63          2HB       GLU  63  -6.567 -12.853  -8.263
  460   1HG   GLU  63          1HG       GLU  63  -8.447 -14.178  -8.713
  461   2HG   GLU  63          2HG       GLU  63  -9.138 -12.579  -8.928
  462    H    GLU  64           H        GLU  64  -5.276 -10.331  -7.820
  463    HA   GLU  64           HA       GLU  64  -7.202  -9.333  -5.797
  464   1HB   GLU  64          1HB       GLU  64  -4.198  -9.462  -6.017
  465   2HB   GLU  64          2HB       GLU  64  -5.267 -10.111  -4.789
  466   1HG   GLU  64          1HG       GLU  64  -5.096  -7.080  -4.953
  467   2HG   GLU  64          2HG       GLU  64  -3.644  -7.917  -4.431
  468    H    VAL  65           H        VAL  65  -4.929  -7.817  -8.094
  469    HA   VAL  65           HA       VAL  65  -6.178  -5.076  -7.591
  470    HB   VAL  65           HB       VAL  65  -3.444  -5.850  -8.708
  471   1HG1  VAL  65          1HG1      VAL  65  -2.963  -3.423  -9.077
  472   2HG1  VAL  65          2HG1      VAL  65  -4.290  -3.968 -10.119
  473   3HG1  VAL  65          3HG1      VAL  65  -4.644  -2.998  -8.669
  474   1HG2  VAL  65          1HG2      VAL  65  -4.211  -4.140  -6.242
  475   2HG2  VAL  65          2HG2      VAL  65  -3.547  -5.791  -6.212
  476   3HG2  VAL  65          3HG2      VAL  65  -2.556  -4.456  -6.816
  477    H    ASP  66           H        ASP  66  -7.982  -5.209  -8.848
  478    HA   ASP  66           HA       ASP  66  -8.003  -4.482 -11.590
  479   1HB   ASP  66          1HB       ASP  66  -8.880  -7.177 -12.159
  480   2HB   ASP  66          2HB       ASP  66  -7.312  -7.304 -11.395
  481    H    GLU  67           H        GLU  67  -9.514  -3.407 -10.099
  482    HA   GLU  67           HA       GLU  67 -12.113  -4.729  -9.389
  483   1HB   GLU  67          1HB       GLU  67 -10.771  -2.539  -8.366
  484   2HB   GLU  67          2HB       GLU  67 -11.981  -1.736  -9.347
  485   1HG   GLU  67          1HG       GLU  67 -12.561  -2.198  -6.853
  486   2HG   GLU  67          2HG       GLU  67 -13.799  -2.565  -8.042
  487    H    ASP  68           H        ASP  68 -10.752  -2.718 -11.932
  488    HA   ASP  68           HA       ASP  68 -13.350  -2.252 -13.357
  489   1HB   ASP  68          1HB       ASP  68 -11.561  -0.532 -13.497
  490   2HB   ASP  68          2HB       ASP  68 -12.131  -1.067 -15.062
  491    H    GLY  69           H        GLY  69 -10.621  -4.471 -13.500
  492   1HA   GLY  69          1HA       GLY  69 -10.621  -6.778 -14.367
  493   2HA   GLY  69          2HA       GLY  69 -12.237  -6.495 -15.027
  494    H    SER  70           H        SER  70  -9.338  -4.516 -15.515
  495    HA   SER  70           HA       SER  70  -9.592  -4.579 -18.516
  496   1HB   SER  70          1HB       SER  70  -7.579  -3.056 -18.457
  497   2HB   SER  70          2HB       SER  70  -8.983  -2.452 -17.574
  498    HG   SER  70           HG       SER  70  -7.245  -2.192 -16.294
  499    H    GLY  71           H        GLY  71  -7.270  -5.644 -16.012
  500   1HA   GLY  71          1HA       GLY  71  -6.304  -8.041 -16.257
  501   2HA   GLY  71          2HA       GLY  71  -6.105  -7.690 -17.980
  502    H    THR  72           H        THR  72  -5.242  -4.944 -17.563
  503    HA   THR  72           HA       THR  72  -2.347  -5.463 -16.740
  504    HB   THR  72           HB       THR  72  -1.988  -3.205 -18.083
  505    HG1  THR  72           HG1      THR  72  -3.412  -2.995 -19.752
  506   1HG2  THR  72          1HG2      THR  72  -1.553  -4.405 -20.187
  507   2HG2  THR  72          2HG2      THR  72  -0.985  -5.403 -18.830
  508   3HG2  THR  72          3HG2      THR  72  -2.508  -5.811 -19.663
  509    H    ILE  73           H        ILE  73  -1.392  -3.018 -16.289
  510    HA   ILE  73           HA       ILE  73  -3.111  -1.667 -14.148
  511    HB   ILE  73           HB       ILE  73  -0.290  -2.760 -13.764
  512   1HG1  ILE  73          1HG1      ILE  73  -2.600  -4.020 -13.126
  513   2HG1  ILE  73          2HG1      ILE  73  -2.563  -2.963 -11.731
  514   1HG2  ILE  73          1HG2      ILE  73  -0.053  -1.448 -11.659
  515   2HG2  ILE  73          2HG2      ILE  73  -0.270  -0.342 -13.022
  516   3HG2  ILE  73          3HG2      ILE  73  -1.627  -0.661 -11.915
  517   1HD1  ILE  73          1HD1      ILE  73  -0.377  -3.850 -10.968
  518   2HD1  ILE  73          2HD1      ILE  73  -1.543  -5.167 -11.213
  519   3HD1  ILE  73          3HD1      ILE  73  -0.264  -4.884 -12.418
  520    H    ASP  74           H        ASP  74  -3.502   0.123 -15.276
  521    HA   ASP  74           HA       ASP  74  -1.473   1.524 -16.964
  522   1HB   ASP  74          1HB       ASP  74  -3.156   2.994 -17.676
  523   2HB   ASP  74          2HB       ASP  74  -4.057   2.899 -16.180
  524    H    PHE  75           H        PHE  75  -1.596   4.103 -16.519
  525    HA   PHE  75           HA       PHE  75   0.138   4.496 -14.129
  526   1HB   PHE  75          1HB       PHE  75   0.543   5.702 -16.296
  527   2HB   PHE  75          2HB       PHE  75  -0.966   6.559 -16.130
  528    HD1  PHE  75           HD1      PHE  75  -1.235   7.957 -13.801
  529    HD2  PHE  75           HD2      PHE  75   2.531   6.753 -15.503
  530    HE1  PHE  75           HE1      PHE  75  -0.086   9.730 -12.540
  531    HE2  PHE  75           HE2      PHE  75   3.662   8.530 -14.226
  532    HZ   PHE  75           HZ       PHE  75   2.361  10.013 -12.742
  533    H    GLU  76           H        GLU  76  -3.152   5.351 -15.134
  534    HA   GLU  76           HA       GLU  76  -3.879   7.035 -12.831
  535   1HB   GLU  76          1HB       GLU  76  -5.959   7.266 -13.738
  536   2HB   GLU  76          2HB       GLU  76  -6.093   5.590 -14.225
  537   1HG   GLU  76          1HG       GLU  76  -4.292   7.587 -15.725
  538   2HG   GLU  76          2HG       GLU  76  -4.737   5.973 -16.238
  539    H    GLU  77           H        GLU  77  -3.987   3.589 -13.508
  540    HA   GLU  77           HA       GLU  77  -5.645   2.814 -11.150
  541   1HB   GLU  77          1HB       GLU  77  -5.653   1.442 -13.201
  542   2HB   GLU  77          2HB       GLU  77  -3.951   1.084 -13.016
  543   1HG   GLU  77          1HG       GLU  77  -4.312  -0.359 -11.113
  544   2HG   GLU  77          2HG       GLU  77  -5.911   0.300 -10.789
  545    H    PHE  78           H        PHE  78  -2.225   3.099 -11.911
  546    HA   PHE  78           HA       PHE  78  -1.083   1.627  -9.643
  547   1HB   PHE  78          1HB       PHE  78   0.229   2.297 -11.691
  548   2HB   PHE  78          2HB       PHE  78   0.144   3.977 -11.227
  549    HD1  PHE  78           HD1      PHE  78   1.762   0.707 -10.578
  550    HD2  PHE  78           HD2      PHE  78   1.464   4.764  -9.175
  551    HE1  PHE  78           HE1      PHE  78   3.799   0.402  -9.229
  552    HE2  PHE  78           HE2      PHE  78   3.499   4.439  -7.831
  553    HZ   PHE  78           HZ       PHE  78   4.671   2.264  -7.856
  554    H    LEU  79           H        LEU  79  -1.695   5.107 -10.177
  555    HA   LEU  79           HA       LEU  79  -0.849   6.101  -7.583
  556   1HB   LEU  79          1HB       LEU  79  -2.657   7.205  -9.765
  557   2HB   LEU  79          2HB       LEU  79  -2.697   7.989  -8.200
  558    HG   LEU  79           HG       LEU  79  -0.053   8.137  -8.431
  559   1HD1  LEU  79          1HD1      LEU  79   0.777   8.258 -10.782
  560   2HD1  LEU  79          2HD1      LEU  79   0.169   6.633 -10.417
  561   3HD1  LEU  79          3HD1      LEU  79  -0.814   7.746 -11.399
  562   1HD2  LEU  79          1HD2      LEU  79  -1.894   9.895 -10.190
  563   2HD2  LEU  79          2HD2      LEU  79  -1.513  10.167  -8.472
  564   3HD2  LEU  79          3HD2      LEU  79  -0.235  10.310  -9.688
  565    H    VAL  80           H        VAL  80  -3.862   4.664  -8.682
  566    HA   VAL  80           HA       VAL  80  -5.582   5.350  -6.418
  567    HB   VAL  80           HB       VAL  80  -5.748   3.158  -8.517
  568   1HG1  VAL  80          1HG1      VAL  80  -7.720   5.449  -7.917
  569   2HG1  VAL  80          2HG1      VAL  80  -6.382   5.603  -9.063
  570   3HG1  VAL  80          3HG1      VAL  80  -7.662   4.404  -9.360
  571   1HG2  VAL  80          1HG2      VAL  80  -7.916   2.374  -7.681
  572   2HG2  VAL  80          2HG2      VAL  80  -6.750   2.195  -6.350
  573   3HG2  VAL  80          3HG2      VAL  80  -7.897   3.542  -6.337
  574    H    MET  81           H        MET  81  -3.669   2.413  -7.152
  575    HA   MET  81           HA       MET  81  -4.132   0.816  -4.799
  576   1HB   MET  81          1HB       MET  81  -1.859  -0.205  -5.186
  577   2HB   MET  81          2HB       MET  81  -1.497   1.049  -6.359
  578   1HG   MET  81          1HG       MET  81  -3.719   0.179  -7.601
  579   2HG   MET  81          2HG       MET  81  -3.452  -1.279  -6.630
  580   1HE   MET  81          1HE       MET  81  -1.336  -2.805  -6.683
  581   2HE   MET  81          2HE       MET  81   0.095  -2.534  -7.722
  582   3HE   MET  81          3HE       MET  81  -0.205  -1.462  -6.324
  583    H    MET  82           H        MET  82  -1.518   3.187  -5.374
  584    HA   MET  82           HA       MET  82  -0.359   3.015  -2.669
  585   1HB   MET  82          1HB       MET  82   0.054   4.874  -5.038
  586   2HB   MET  82          2HB       MET  82   0.704   5.347  -3.480
  587   1HG   MET  82          1HG       MET  82   2.209   3.964  -5.174
  588   2HG   MET  82          2HG       MET  82   1.302   2.555  -4.609
  589   1HE   MET  82          1HE       MET  82   4.626   2.840  -4.149
  590   2HE   MET  82          2HE       MET  82   3.525   1.456  -3.880
  591   3HE   MET  82          3HE       MET  82   4.588   2.018  -2.557
  592    H    VAL  83           H        VAL  83  -2.973   4.856  -4.070
  593    HA   VAL  83           HA       VAL  83  -2.988   7.173  -2.249
  594    HB   VAL  83           HB       VAL  83  -4.627   6.257  -4.495
  595   1HG1  VAL  83          1HG1      VAL  83  -6.801   7.311  -3.851
  596   2HG1  VAL  83          2HG1      VAL  83  -6.455   5.917  -2.818
  597   3HG1  VAL  83          3HG1      VAL  83  -6.213   7.562  -2.187
  598   1HG2  VAL  83          1HG2      VAL  83  -4.287   9.067  -3.252
  599   2HG2  VAL  83          2HG2      VAL  83  -3.294   8.382  -4.559
  600   3HG2  VAL  83          3HG2      VAL  83  -5.010   8.705  -4.841
  601    NH1  ARG  84           NH1      ARG  84  -9.468  -0.605  -1.652
  602    NH2  ARG  84           NH2      ARG  84  -8.119  -2.362  -2.156
  603    H    ARG  84           H        ARG  84  -4.613   4.015  -2.314
  604    HA   ARG  84           HA       ARG  84  -6.559   4.325  -0.172
  605   1HB   ARG  84          1HB       ARG  84  -5.183   1.945  -1.454
  606   2HB   ARG  84          2HB       ARG  84  -5.932   1.691   0.115
  607   1HG   ARG  84          1HG       ARG  84  -8.084   1.871  -0.669
  608   2HG   ARG  84          2HG       ARG  84  -7.706   3.174  -1.798
  609   1HD   ARG  84          1HD       ARG  84  -6.504   1.419  -3.285
  610   2HD   ARG  84          2HD       ARG  84  -8.264   1.308  -3.220
  611    HE   ARG  84           HE       ARG  84  -6.308  -0.621  -1.923
  612   1HH1  ARG  84          1HH1      ARG  84  -9.563   0.411  -1.543
  613   2HH1  ARG  84          2HH1      ARG  84 -10.207  -1.307  -1.542
  614   1HH2  ARG  84          1HH2      ARG  84  -7.193  -2.684  -2.456
  615   2HH2  ARG  84          2HH2      ARG  84  -8.948  -2.943  -1.989
  616    H    GLN  85           H        GLN  85  -3.209   3.060  -0.075
  617    HA   GLN  85           HA       GLN  85  -3.141   2.596   2.850
  618   1HB   GLN  85          1HB       GLN  85  -0.977   2.643   0.689
  619   2HB   GLN  85          2HB       GLN  85  -0.556   2.520   2.387
  620   1HG   GLN  85          1HG       GLN  85  -1.835   0.479   0.581
  621   2HG   GLN  85          2HG       GLN  85  -2.477   0.507   2.209
  622   1HE2  GLN  85          1HE2      GLN  85   1.618  -0.077   2.333
  623   2HE2  GLN  85          2HE2      GLN  85   0.879   1.442   1.616
  624    H    MET  86           H        MET  86  -2.262   5.233   0.684
  625    HA   MET  86           HA       MET  86  -0.571   6.885   2.302
  626   1HB   MET  86          1HB       MET  86  -2.343   8.680   0.881
  627   2HB   MET  86          2HB       MET  86  -2.126   7.265  -0.132
  628   1HG   MET  86          1HG       MET  86   0.460   8.265   1.021
  629   2HG   MET  86          2HG       MET  86   0.068   7.759  -0.631
  630   1HE   MET  86          1HE       MET  86  -2.617   9.520  -1.254
  631   2HE   MET  86          2HE       MET  86  -1.891  10.957  -2.032
  632   3HE   MET  86          3HE       MET  86  -1.293   9.324  -2.444
  633    H    LYS  87           H        LYS  87  -4.070   6.464   2.349
  634    HA   LYS  87           HA       LYS  87  -4.994   8.694   3.903
  635   1HB   LYS  87          1HB       LYS  87  -6.667   6.829   4.939
  636   2HB   LYS  87          2HB       LYS  87  -5.993   5.835   3.656
  637   1HG   LYS  87          1HG       LYS  87  -6.907   7.118   1.916
  638   2HG   LYS  87          2HG       LYS  87  -7.003   8.594   2.862
  639   1HD   LYS  87          1HD       LYS  87  -8.771   6.848   4.229
  640   2HD   LYS  87          2HD       LYS  87  -9.195   8.171   3.149
  641   1HE   LYS  87          1HE       LYS  87  -8.566   5.463   1.869
  642   2HE   LYS  87          2HE       LYS  87 -10.116   5.655   2.701
  643   1HZ   LYS  87          1HZ       LYS  87  -9.151   7.006   0.285
  644   2HZ   LYS  87          2HZ       LYS  87 -10.179   7.853   1.262
  645   3HZ   LYS  87          3HZ       LYS  87 -10.650   6.401   0.629
  646    H    GLU  88           H        GLU  88  -5.591   8.774   6.169
  647    HA   GLU  88           HA       GLU  88  -5.289   8.442   8.546
  648   1HB   GLU  88          1HB       GLU  88  -4.862   5.961   7.854
  649   2HB   GLU  88          2HB       GLU  88  -3.154   6.323   8.003
  650   1HG   GLU  88          1HG       GLU  88  -3.215   6.314  10.316
  651   2HG   GLU  88          2HG       GLU  88  -4.728   7.199  10.397
  652    H    ASP  89           H        ASP  89  -2.024   7.685   7.313
  653    HA   ASP  89           HA       ASP  89  -0.760  10.230   7.220
  654   1HB   ASP  89          1HB       ASP  89  -1.396   9.528  10.040
  655   2HB   ASP  89          2HB       ASP  89   0.306   9.845   9.795
  656    H    ALA  90           H        ALA  90   1.149   9.864   6.398
  657    HA   ALA  90           HA       ALA  90   3.104   8.719   5.569
  658   1HB   ALA  90          1HB       ALA  90   4.379   7.296   7.194
  659   2HB   ALA  90          2HB       ALA  90   3.876   8.820   7.953
  660   3HB   ALA  90          3HB       ALA  90   3.007   7.313   8.331
   
  Start of MODEL          38
 Raw file had  660 H/Q atoms
  Start of MODEL   38
    1   1H    ALA   1          1H        ALA   1 -18.854  16.228 -21.667
    2   2H    ALA   1          2H        ALA   1 -18.256  17.036 -20.318
    3   3H    ALA   1          3H        ALA   1 -17.301  15.901 -21.111
    4    HA   ALA   1           HA       ALA   1 -19.426  15.567 -19.182
    5   1HB   ALA   1          1HB       ALA   1 -19.190  13.213 -21.051
    6   2HB   ALA   1          2HB       ALA   1 -20.053  14.617 -21.708
    7   3HB   ALA   1          3HB       ALA   1 -20.622  13.847 -20.204
    8    H    SER   2           H        SER   2 -18.027  15.266 -17.573
    9    HA   SER   2           HA       SER   2 -15.635  13.387 -17.879
   10   1HB   SER   2          1HB       SER   2 -15.075  14.503 -15.520
   11   2HB   SER   2          2HB       SER   2 -14.709  15.320 -17.041
   12    HG   SER   2           HG       SER   2 -16.031  16.322 -15.174
   13    H    MET   3           H        MET   3 -15.619  11.494 -16.891
   14    HA   MET   3           HA       MET   3 -17.941  10.699 -15.065
   15   1HB   MET   3          1HB       MET   3 -16.935   9.482 -17.418
   16   2HB   MET   3          2HB       MET   3 -16.333   8.452 -16.131
   17   1HG   MET   3          1HG       MET   3 -18.429   7.477 -16.663
   18   2HG   MET   3          2HG       MET   3 -18.814   8.431 -15.225
   19   1HE   MET   3          1HE       MET   3 -21.933   8.410 -17.060
   20   2HE   MET   3          2HE       MET   3 -21.786   9.837 -15.993
   21   3HE   MET   3          3HE       MET   3 -21.036   8.286 -15.514
   22    H    THR   4           H        THR   4 -14.684   9.344 -15.575
   23    HA   THR   4           HA       THR   4 -12.942   8.715 -14.088
   24    HB   THR   4           HB       THR   4 -12.430  10.572 -12.318
   25    HG1  THR   4           HG1      THR   4 -13.350  12.563 -13.211
   26   1HG2  THR   4          1HG2      THR   4 -12.206  11.020 -15.347
   27   2HG2  THR   4          2HG2      THR   4 -10.930  10.520 -14.215
   28   3HG2  THR   4          3HG2      THR   4 -11.564  12.186 -14.171
   29    H    ASP   5           H        ASP   5 -13.861   6.881 -13.224
   30    HA   ASP   5           HA       ASP   5 -15.686   6.919 -10.837
   31   1HB   ASP   5          1HB       ASP   5 -15.990   5.126 -12.504
   32   2HB   ASP   5          2HB       ASP   5 -14.348   4.568 -12.283
   33    H    GLN   6           H        GLN   6 -12.909   4.788 -11.048
   34    HA   GLN   6           HA       GLN   6 -12.152   5.265  -8.187
   35   1HB   GLN   6          1HB       GLN   6 -10.652   3.436  -8.389
   36   2HB   GLN   6          2HB       GLN   6 -12.074   2.999  -9.318
   37   1HG   GLN   6          1HG       GLN   6  -9.487   4.096 -10.578
   38   2HG   GLN   6          2HG       GLN   6 -10.895   3.553 -11.463
   39   1HE2  GLN   6          1HE2      GLN   6  -8.692   0.598 -11.597
   40   2HE2  GLN   6          2HE2      GLN   6  -9.073   2.193 -12.420
   41    H    GLN   7           H        GLN   7 -10.939   6.051 -11.411
   42    HA   GLN   7           HA       GLN   7  -8.278   7.113 -10.711
   43   1HB   GLN   7          1HB       GLN   7  -8.994   6.509 -13.084
   44   2HB   GLN   7          2HB       GLN   7  -8.166   8.048 -12.899
   45   1HG   GLN   7          1HG       GLN   7 -11.180   8.203 -12.827
   46   2HG   GLN   7          2HG       GLN   7 -10.018   9.344 -13.486
   47   1HE2  GLN   7          1HE2      GLN   7 -10.889   5.998 -15.851
   48   2HE2  GLN   7          2HE2      GLN   7 -10.697   5.831 -14.034
   49    H    ALA   8           H        ALA   8 -11.542   8.419 -10.655
   50    HA   ALA   8           HA       ALA   8 -11.280  11.224 -10.597
   51   1HB   ALA   8          1HB       ALA   8 -13.253  11.294  -9.080
   52   2HB   ALA   8          2HB       ALA   8 -13.460  10.076 -10.353
   53   3HB   ALA   8          3HB       ALA   8 -13.058   9.568  -8.693
   54    H    GLU   9           H        GLU   9 -11.403   9.398  -7.530
   55    HA   GLU   9           HA       GLU   9 -10.420  11.459  -5.785
   56   1HB   GLU   9          1HB       GLU   9  -9.616   9.397  -4.283
   57   2HB   GLU   9          2HB       GLU   9 -11.311   9.819  -4.478
   58   1HG   GLU   9          1HG       GLU   9 -10.192   7.778  -6.446
   59   2HG   GLU   9          2HG       GLU   9 -10.423   7.268  -4.778
   60    H    ALA  10           H        ALA  10  -8.542   8.660  -7.006
   61    HA   ALA  10           HA       ALA  10  -5.971   9.239  -5.928
   62   1HB   ALA  10          1HB       ALA  10  -5.022   7.855  -7.767
   63   2HB   ALA  10          2HB       ALA  10  -6.495   7.122  -7.105
   64   3HB   ALA  10          3HB       ALA  10  -6.548   7.958  -8.677
   65    NH1  ARG  11           NH1      ARG  11  -6.039  12.410 -15.920
   66    NH2  ARG  11           NH2      ARG  11  -8.088  11.431 -15.954
   67    H    ARG  11           H        ARG  11  -7.628  10.775  -8.599
   68    HA   ARG  11           HA       ARG  11  -5.262  12.048  -9.922
   69   1HB   ARG  11          1HB       ARG  11  -7.537  11.479 -11.051
   70   2HB   ARG  11          2HB       ARG  11  -8.200  12.872 -10.210
   71   1HG   ARG  11          1HG       ARG  11  -7.615  14.082 -12.030
   72   2HG   ARG  11          2HG       ARG  11  -5.977  14.064 -11.373
   73   1HD   ARG  11          1HD       ARG  11  -5.446  13.205 -13.454
   74   2HD   ARG  11          2HD       ARG  11  -5.864  11.664 -12.702
   75    HE   ARG  11           HE       ARG  11  -8.344  12.611 -13.757
   76   1HH1  ARG  11          1HH1      ARG  11  -5.344  12.947 -15.390
   77   2HH1  ARG  11          2HH1      ARG  11  -5.963  12.099 -16.895
   78   1HH2  ARG  11          1HH2      ARG  11  -8.953  11.213 -15.447
   79   2HH2  ARG  11          2HH2      ARG  11  -7.872  11.199 -16.930
   80    H    ALA  12           H        ALA  12  -8.076  13.369  -8.148
   81    HA   ALA  12           HA       ALA  12  -7.291  16.088  -7.863
   82   1HB   ALA  12          1HB       ALA  12  -8.786  16.225  -5.881
   83   2HB   ALA  12          2HB       ALA  12  -9.530  15.279  -7.185
   84   3HB   ALA  12          3HB       ALA  12  -8.847  14.450  -5.764
   85    H    PHE  13           H        PHE  13  -6.334  13.292  -5.901
   86    HA   PHE  13           HA       PHE  13  -4.928  14.770  -3.763
   87   1HB   PHE  13          1HB       PHE  13  -4.621  11.822  -4.572
   88   2HB   PHE  13          2HB       PHE  13  -5.903  12.431  -3.556
   89    HD1  PHE  13           HD1      PHE  13  -2.096  12.728  -3.726
   90    HD2  PHE  13           HD2      PHE  13  -5.545  12.099  -1.228
   91    HE1  PHE  13           HE1      PHE  13  -0.635  12.394  -1.773
   92    HE2  PHE  13           HE2      PHE  13  -4.068  11.774   0.712
   93    HZ   PHE  13           HZ       PHE  13  -1.615  11.909   0.444
   94    H    LEU  14           H        LEU  14  -3.835  12.840  -6.573
   95    HA   LEU  14           HA       LEU  14  -0.956  13.749  -6.253
   96   1HB   LEU  14          1HB       LEU  14  -0.330  12.040  -7.782
   97   2HB   LEU  14          2HB       LEU  14  -1.918  11.939  -8.510
   98    HG   LEU  14           HG       LEU  14  -2.639  11.073  -6.037
   99   1HD1  LEU  14          1HD1      LEU  14  -2.382   8.735  -6.876
  100   2HD1  LEU  14          2HD1      LEU  14  -2.959   9.805  -8.167
  101   3HD1  LEU  14          3HD1      LEU  14  -1.255   9.284  -8.142
  102   1HD2  LEU  14          1HD2      LEU  14   0.338  10.246  -6.195
  103   2HD2  LEU  14          2HD2      LEU  14  -0.391  11.311  -4.968
  104   3HD2  LEU  14          3HD2      LEU  14  -0.858   9.605  -5.040
  105    H    SER  15           H        SER  15  -0.672  15.737  -6.952
  106    HA   SER  15           HA       SER  15  -2.064  17.137  -9.126
  107   1HB   SER  15          1HB       SER  15  -0.620  18.943  -8.736
  108   2HB   SER  15          2HB       SER  15   0.750  17.924  -8.287
  109    HG   SER  15           HG       SER  15  -1.632  17.897  -6.777
  110    H    GLU  16           H        GLU  16  -0.129  18.202 -10.721
  111    HA   GLU  16           HA       GLU  16   0.339  16.013 -12.719
  112   1HB   GLU  16          1HB       GLU  16  -0.435  18.550 -13.091
  113   2HB   GLU  16          2HB       GLU  16   1.288  18.861 -13.174
  114   1HG   GLU  16          1HG       GLU  16  -0.056  16.713 -14.929
  115   2HG   GLU  16          2HG       GLU  16  -0.016  18.403 -15.400
  116    H    GLU  17           H        GLU  17   2.171  18.077 -10.540
  117    HA   GLU  17           HA       GLU  17   4.875  17.311 -11.605
  118   1HB   GLU  17          1HB       GLU  17   5.850  18.805 -10.056
  119   2HB   GLU  17          2HB       GLU  17   4.406  19.598 -10.656
  120   1HG   GLU  17          1HG       GLU  17   3.229  19.314  -8.555
  121   2HG   GLU  17          2HG       GLU  17   4.324  18.060  -7.998
  122    H    MET  18           H        MET  18   2.723  16.489  -8.933
  123    HA   MET  18           HA       MET  18   4.505  14.604  -7.481
  124   1HB   MET  18          1HB       MET  18   1.429  14.669  -7.514
  125   2HB   MET  18          2HB       MET  18   2.426  13.718  -6.429
  126   1HG   MET  18          1HG       MET  18   2.848  16.745  -6.464
  127   2HG   MET  18          2HG       MET  18   1.424  16.076  -5.648
  128   1HE   MET  18          1HE       MET  18   1.518  15.794  -3.171
  129   2HE   MET  18          2HE       MET  18   3.045  16.006  -2.264
  130   3HE   MET  18          3HE       MET  18   2.498  17.277  -3.398
  131    H    ILE  19           H        ILE  19   2.252  14.446 -10.191
  132    HA   ILE  19           HA       ILE  19   2.123  11.534 -10.523
  133    HB   ILE  19           HB       ILE  19   1.455  13.871 -12.327
  134   1HG1  ILE  19          1HG1      ILE  19  -0.094  12.708 -10.466
  135   2HG1  ILE  19          2HG1      ILE  19  -0.340  11.474 -11.683
  136   1HG2  ILE  19          1HG2      ILE  19   0.804  12.352 -14.212
  137   2HG2  ILE  19          2HG2      ILE  19   2.539  12.247 -13.918
  138   3HG2  ILE  19          3HG2      ILE  19   1.469  10.948 -13.341
  139   1HD1  ILE  19          1HD1      ILE  19  -1.328  13.082 -13.290
  140   2HD1  ILE  19          2HD1      ILE  19  -2.163  13.169 -11.725
  141   3HD1  ILE  19          3HD1      ILE  19  -0.998  14.436 -12.175
  142    H    ALA  20           H        ALA  20   4.331  14.067 -11.614
  143    HA   ALA  20           HA       ALA  20   5.979  12.609 -13.496
  144   1HB   ALA  20          1HB       ALA  20   7.714  14.343 -13.058
  145   2HB   ALA  20          2HB       ALA  20   6.105  15.067 -13.247
  146   3HB   ALA  20          3HB       ALA  20   6.826  14.912 -11.625
  147    H    GLU  21           H        GLU  21   6.023  12.760  -9.965
  148    HA   GLU  21           HA       GLU  21   8.655  11.613  -9.421
  149   1HB   GLU  21          1HB       GLU  21   7.177  12.839  -7.761
  150   2HB   GLU  21          2HB       GLU  21   6.171  11.409  -7.633
  151   1HG   GLU  21          1HG       GLU  21   8.981  11.891  -6.575
  152   2HG   GLU  21          2HG       GLU  21   8.592  10.245  -7.046
  153    H    PHE  22           H        PHE  22   5.479  10.237 -10.087
  154    HA   PHE  22           HA       PHE  22   6.294   7.390  -9.524
  155   1HB   PHE  22          1HB       PHE  22   3.647   8.584 -10.549
  156   2HB   PHE  22          2HB       PHE  22   3.923   6.873 -10.365
  157    HD1  PHE  22           HD1      PHE  22   3.307  10.010  -8.507
  158    HD2  PHE  22           HD2      PHE  22   4.232   5.827  -8.093
  159    HE1  PHE  22           HE1      PHE  22   2.782  10.121  -6.107
  160    HE2  PHE  22           HE2      PHE  22   3.702   5.958  -5.693
  161    HZ   PHE  22           HZ       PHE  22   2.960   8.096  -4.700
  162    H    LYS  23           H        LYS  23   5.993   9.591 -12.223
  163    HA   LYS  23           HA       LYS  23   5.720   7.884 -14.523
  164   1HB   LYS  23          1HB       LYS  23   6.951  10.597 -14.061
  165   2HB   LYS  23          2HB       LYS  23   7.546   9.749 -15.471
  166   1HG   LYS  23          1HG       LYS  23   4.979  11.139 -15.069
  167   2HG   LYS  23          2HG       LYS  23   4.696   9.487 -15.591
  168   1HD   LYS  23          1HD       LYS  23   6.358  11.613 -17.068
  169   2HD   LYS  23          2HD       LYS  23   6.398   9.906 -17.523
  170   1HE   LYS  23          1HE       LYS  23   4.748  11.152 -18.935
  171   2HE   LYS  23          2HE       LYS  23   3.925   9.917 -17.971
  172   1HZ   LYS  23          1HZ       LYS  23   4.143  12.618 -16.825
  173   2HZ   LYS  23          2HZ       LYS  23   2.934  11.503 -16.666
  174   3HZ   LYS  23          3HZ       LYS  23   3.068  12.384 -18.057
  175    H    ALA  24           H        ALA  24   8.743   8.960 -12.936
  176    HA   ALA  24           HA       ALA  24  10.715   7.722 -14.573
  177   1HB   ALA  24          1HB       ALA  24  12.224   7.766 -12.597
  178   2HB   ALA  24          2HB       ALA  24  11.289   9.268 -12.724
  179   3HB   ALA  24          3HB       ALA  24  10.843   8.044 -11.508
  180    H    ALA  25           H        ALA  25   9.602   6.326 -11.468
  181    HA   ALA  25           HA       ALA  25  10.811   3.698 -11.796
  182   1HB   ALA  25          1HB       ALA  25   9.408   3.014  -9.859
  183   2HB   ALA  25          2HB       ALA  25  10.155   4.599  -9.581
  184   3HB   ALA  25          3HB       ALA  25   8.427   4.493 -10.004
  185    H    PHE  26           H        PHE  26   7.816   5.050 -12.967
  186    HA   PHE  26           HA       PHE  26   6.217   2.592 -13.282
  187   1HB   PHE  26          1HB       PHE  26   4.974   4.629 -13.293
  188   2HB   PHE  26          2HB       PHE  26   5.969   5.382 -14.510
  189    HD1  PHE  26           HD1      PHE  26   3.066   3.229 -13.878
  190    HD2  PHE  26           HD2      PHE  26   5.773   4.511 -16.966
  191    HE1  PHE  26           HE1      PHE  26   1.446   2.541 -15.599
  192    HE2  PHE  26           HE2      PHE  26   4.140   3.817 -18.672
  193    HZ   PHE  26           HZ       PHE  26   1.991   2.805 -17.995
  194    H    ASP  27           H        ASP  27   8.524   4.349 -15.307
  195    HA   ASP  27           HA       ASP  27   8.289   2.711 -17.758
  196   1HB   ASP  27          1HB       ASP  27  10.906   4.090 -17.044
  197   2HB   ASP  27          2HB       ASP  27   9.495   5.071 -17.365
  198    H    MET  28           H        MET  28  10.081   2.482 -14.741
  199    HA   MET  28           HA       MET  28  12.042   0.414 -15.472
  200   1HB   MET  28          1HB       MET  28  11.949   1.904 -13.284
  201   2HB   MET  28          2HB       MET  28  10.919   0.637 -12.644
  202   1HG   MET  28          1HG       MET  28  12.845  -1.048 -13.278
  203   2HG   MET  28          2HG       MET  28  13.858   0.390 -13.488
  204   1HE   MET  28          1HE       MET  28  12.220   2.331 -11.278
  205   2HE   MET  28          2HE       MET  28  13.309   2.141  -9.872
  206   3HE   MET  28          3HE       MET  28  13.997   2.381 -11.505
  207    H    PHE  29           H        PHE  29   8.703   0.360 -14.322
  208    HA   PHE  29           HA       PHE  29   8.509  -2.589 -13.914
  209   1HB   PHE  29          1HB       PHE  29   5.911  -1.984 -14.012
  210   2HB   PHE  29          2HB       PHE  29   6.452  -0.327 -13.954
  211    HD1  PHE  29           HD1      PHE  29   7.675   0.548 -11.905
  212    HD2  PHE  29           HD2      PHE  29   6.092  -3.454 -12.011
  213    HE1  PHE  29           HE1      PHE  29   7.824   0.411  -9.452
  214    HE2  PHE  29           HE2      PHE  29   6.255  -3.571  -9.558
  215    HZ   PHE  29           HZ       PHE  29   7.108  -1.641  -8.276
  216    H    ASP  30           H        ASP  30   7.823  -0.250 -16.470
  217    HA   ASP  30           HA       ASP  30   6.391  -1.902 -18.380
  218   1HB   ASP  30          1HB       ASP  30   8.284   0.449 -18.950
  219   2HB   ASP  30          2HB       ASP  30   6.562   0.544 -18.663
  220    H    ALA  31           H        ALA  31   9.681  -0.878 -19.155
  221    HA   ALA  31           HA       ALA  31  11.703  -2.137 -19.608
  222   1HB   ALA  31          1HB       ALA  31  11.755  -4.613 -19.383
  223   2HB   ALA  31          2HB       ALA  31  11.039  -3.846 -17.952
  224   3HB   ALA  31          3HB       ALA  31   9.993  -4.667 -19.140
  225    H    ASP  32           H        ASP  32   8.616  -2.734 -21.148
  226    HA   ASP  32           HA       ASP  32   9.790  -3.935 -23.660
  227   1HB   ASP  32          1HB       ASP  32   7.740  -4.734 -24.177
  228   2HB   ASP  32          2HB       ASP  32   7.389  -4.435 -22.491
  229    H    GLY  33           H        GLY  33   7.692  -1.128 -22.889
  230   1HA   GLY  33          1HA       GLY  33   8.612   1.233 -23.454
  231   2HA   GLY  33          2HA       GLY  33   9.253   0.532 -24.922
  232    H    GLY  34           H        GLY  34   6.069   0.334 -23.290
  233   1HA   GLY  34          1HA       GLY  34   3.937   0.257 -24.807
  234   2HA   GLY  34          2HA       GLY  34   4.718   1.508 -25.782
  235    H    GLY  35           H        GLY  35   3.555   0.833 -22.495
  236   1HA   GLY  35          1HA       GLY  35   3.460   3.317 -21.134
  237   2HA   GLY  35          2HA       GLY  35   2.202   3.517 -22.361
  238    H    ASP  36           H        ASP  36   3.131   0.543 -20.666
  239    HA   ASP  36           HA       ASP  36   1.030   0.611 -18.609
  240   1HB   ASP  36          1HB       ASP  36  -0.309  -1.425 -19.513
  241   2HB   ASP  36          2HB       ASP  36  -0.697   0.176 -20.096
  242    H    ILE  37           H        ILE  37   0.690  -1.947 -17.983
  243    HA   ILE  37           HA       ILE  37   3.337  -3.437 -18.125
  244    HB   ILE  37           HB       ILE  37   2.534  -3.867 -15.469
  245   1HG1  ILE  37          1HG1      ILE  37   1.636  -1.189 -16.081
  246   2HG1  ILE  37          2HG1      ILE  37   1.648  -2.021 -14.537
  247   1HG2  ILE  37          1HG2      ILE  37   4.781  -3.031 -14.901
  248   2HG2  ILE  37          2HG2      ILE  37   4.852  -3.961 -16.405
  249   3HG2  ILE  37          3HG2      ILE  37   4.911  -2.183 -16.460
  250   1HD1  ILE  37          1HD1      ILE  37   3.958  -0.284 -15.596
  251   2HD1  ILE  37          2HD1      ILE  37   2.829   0.097 -14.277
  252   3HD1  ILE  37          3HD1      ILE  37   4.006  -1.222 -14.079
  253    H    SER  38           H        SER  38   2.900  -5.327 -18.908
  254    HA   SER  38           HA       SER  38   0.244  -6.708 -18.531
  255   1HB   SER  38          1HB       SER  38   0.866  -8.170 -20.239
  256   2HB   SER  38          2HB       SER  38   1.688  -6.681 -20.712
  257    HG   SER  38           HG       SER  38   2.869  -8.777 -20.654
  258    H    THR  39           H        THR  39   0.917  -9.310 -18.340
  259    HA   THR  39           HA       THR  39   1.717  -9.621 -15.456
  260    HB   THR  39           HB       THR  39   1.240 -12.201 -16.225
  261    HG1  THR  39           HG1      THR  39  -0.550 -12.113 -17.600
  262   1HG2  THR  39          1HG2      THR  39  -1.033 -12.000 -15.317
  263   2HG2  THR  39          2HG2      THR  39   0.061 -10.994 -14.339
  264   3HG2  THR  39          3HG2      THR  39  -1.029 -10.234 -15.529
  265    H    LYS  40           H        LYS  40   2.953 -10.302 -18.674
  266    HA   LYS  40           HA       LYS  40   5.204 -12.054 -17.808
  267   1HB   LYS  40          1HB       LYS  40   3.931 -11.827 -20.153
  268   2HB   LYS  40          2HB       LYS  40   5.176 -10.665 -20.530
  269   1HG   LYS  40          1HG       LYS  40   5.896 -13.440 -19.426
  270   2HG   LYS  40          2HG       LYS  40   6.893 -12.385 -20.393
  271   1HD   LYS  40          1HD       LYS  40   5.265 -12.877 -22.401
  272   2HD   LYS  40          2HD       LYS  40   6.402 -14.079 -21.865
  273   1HE   LYS  40          1HE       LYS  40   4.417 -15.297 -22.273
  274   2HE   LYS  40          2HE       LYS  40   4.586 -15.265 -20.523
  275   1HZ   LYS  40          1HZ       LYS  40   2.937 -13.403 -20.526
  276   2HZ   LYS  40          2HZ       LYS  40   2.324 -14.804 -21.150
  277   3HZ   LYS  40          3HZ       LYS  40   2.755 -13.569 -22.159
  278    H    GLU  41           H        GLU  41   4.624  -8.640 -18.476
  279    HA   GLU  41           HA       GLU  41   7.460  -7.761 -18.595
  280   1HB   GLU  41          1HB       GLU  41   6.603  -5.456 -18.562
  281   2HB   GLU  41          2HB       GLU  41   4.997  -6.014 -18.145
  282   1HG   GLU  41          1HG       GLU  41   6.447  -6.545 -20.813
  283   2HG   GLU  41          2HG       GLU  41   4.908  -7.261 -20.385
  284    H    LEU  42           H        LEU  42   4.851  -7.209 -16.203
  285    HA   LEU  42           HA       LEU  42   6.312  -5.851 -14.156
  286   1HB   LEU  42          1HB       LEU  42   4.228  -7.918 -13.333
  287   2HB   LEU  42          2HB       LEU  42   3.725  -6.578 -14.341
  288    HG   LEU  42           HG       LEU  42   5.088  -5.197 -12.343
  289   1HD1  LEU  42          1HD1      LEU  42   2.814  -4.618 -11.455
  290   2HD1  LEU  42          2HD1      LEU  42   2.836  -4.605 -13.225
  291   3HD1  LEU  42          3HD1      LEU  42   2.099  -5.976 -12.359
  292   1HD2  LEU  42          1HD2      LEU  42   3.725  -7.586 -10.924
  293   2HD2  LEU  42          2HD2      LEU  42   5.473  -7.246 -10.952
  294   3HD2  LEU  42          3HD2      LEU  42   4.371  -6.126 -10.131
  295    H    GLY  43           H        GLY  43   6.069  -9.314 -14.832
  296   1HA   GLY  43          1HA       GLY  43   7.363 -11.222 -14.063
  297   2HA   GLY  43          2HA       GLY  43   7.116 -10.521 -12.458
  298    H    THR  44           H        THR  44   8.942  -9.339 -15.282
  299    HA   THR  44           HA       THR  44  11.590 -10.111 -14.548
  300    HB   THR  44           HB       THR  44  10.691  -7.684 -16.168
  301    HG1  THR  44           HG1      THR  44  10.423  -9.926 -16.844
  302   1HG2  THR  44          1HG2      THR  44  13.021  -7.510 -17.059
  303   2HG2  THR  44          2HG2      THR  44  12.963  -7.105 -15.331
  304   3HG2  THR  44          3HG2      THR  44  13.586  -8.692 -15.852
  305    H    VAL  45           H        VAL  45   9.887  -7.079 -13.766
  306    HA   VAL  45           HA       VAL  45  12.043  -5.717 -12.359
  307    HB   VAL  45           HB       VAL  45   9.192  -5.216 -12.799
  308   1HG1  VAL  45          1HG1      VAL  45  11.426  -3.210 -12.101
  309   2HG1  VAL  45          2HG1      VAL  45  11.189  -3.874 -13.723
  310   3HG1  VAL  45          3HG1      VAL  45   9.908  -2.889 -12.980
  311   1HG2  VAL  45          1HG2      VAL  45   8.622  -3.851 -10.857
  312   2HG2  VAL  45          2HG2      VAL  45   9.092  -5.447 -10.226
  313   3HG2  VAL  45          3HG2      VAL  45  10.227  -4.094 -10.119
  314    H    MET  46           H        MET  46   9.467  -7.916 -11.271
  315    HA   MET  46           HA       MET  46   9.708  -7.750  -8.417
  316   1HB   MET  46          1HB       MET  46   8.901 -10.175  -8.342
  317   2HB   MET  46          2HB       MET  46   9.050 -10.239 -10.089
  318   1HG   MET  46          1HG       MET  46   6.769  -9.741  -9.878
  319   2HG   MET  46          2HG       MET  46   7.422  -8.104 -10.060
  320   1HE   MET  46          1HE       MET  46   7.896 -10.484  -6.862
  321   2HE   MET  46          2HE       MET  46   6.501  -9.986  -5.861
  322   3HE   MET  46          3HE       MET  46   6.229 -10.877  -7.386
  323    NH1  ARG  47           NH1      ARG  47  18.168  -9.541 -13.607
  324    NH2  ARG  47           NH2      ARG  47  16.462  -9.565 -15.109
  325    H    ARG  47           H        ARG  47  11.647  -9.515 -10.782
  326    HA   ARG  47           HA       ARG  47  13.224 -11.204  -8.993
  327   1HB   ARG  47          1HB       ARG  47  13.870 -10.139 -11.801
  328   2HB   ARG  47          2HB       ARG  47  13.128 -11.676 -11.379
  329   1HG   ARG  47          1HG       ARG  47  15.196 -12.602 -11.451
  330   2HG   ARG  47          2HG       ARG  47  15.516 -11.804  -9.910
  331   1HD   ARG  47          1HD       ARG  47  16.587  -9.870 -11.010
  332   2HD   ARG  47          2HD       ARG  47  17.306 -11.349 -11.630
  333    HE   ARG  47           HE       ARG  47  15.097 -10.551 -13.401
  334   1HH1  ARG  47          1HH1      ARG  47  18.486  -9.759 -12.657
  335   2HH1  ARG  47          2HH1      ARG  47  18.723  -9.121 -14.361
  336   1HH2  ARG  47          1HH2      ARG  47  15.483  -9.799 -15.307
  337   2HH2  ARG  47          2HH2      ARG  47  17.136  -9.143 -15.757
  338    H    MET  48           H        MET  48  13.796  -7.971 -10.365
  339    HA   MET  48           HA       MET  48  16.499  -7.461  -9.553
  340   1HB   MET  48          1HB       MET  48  15.377  -4.934  -9.179
  341   2HB   MET  48          2HB       MET  48  14.185  -5.689 -10.221
  342   1HG   MET  48          1HG       MET  48  15.582  -5.712 -12.079
  343   2HG   MET  48          2HG       MET  48  17.036  -6.068 -11.133
  344   1HE   MET  48          1HE       MET  48  14.345  -3.197 -12.010
  345   2HE   MET  48          2HE       MET  48  15.538  -1.955 -12.491
  346   3HE   MET  48          3HE       MET  48  15.493  -3.525 -13.345
  347    H    LEU  49           H        LEU  49  13.496  -7.298  -7.708
  348    HA   LEU  49           HA       LEU  49  14.447  -5.998  -5.276
  349   1HB   LEU  49          1HB       LEU  49  12.499  -7.237  -4.132
  350   2HB   LEU  49          2HB       LEU  49  12.170  -8.028  -5.658
  351    HG   LEU  49           HG       LEU  49  10.971  -6.268  -6.436
  352   1HD1  LEU  49          1HD1      LEU  49  13.119  -4.264  -5.501
  353   2HD1  LEU  49          2HD1      LEU  49  13.157  -5.113  -7.058
  354   3HD1  LEU  49          3HD1      LEU  49  11.834  -3.974  -6.700
  355   1HD2  LEU  49          1HD2      LEU  49  10.033  -4.667  -4.822
  356   2HD2  LEU  49          2HD2      LEU  49  10.276  -6.204  -3.957
  357   3HD2  LEU  49          3HD2      LEU  49  11.418  -4.873  -3.719
  358    H    GLY  50           H        GLY  50  13.545  -9.441  -5.422
  359   1HA   GLY  50          1HA       GLY  50  14.924 -10.536  -3.235
  360   2HA   GLY  50          2HA       GLY  50  16.236 -10.383  -4.412
  361    H    GLN  51           H        GLN  51  12.962 -11.707  -4.037
  362    HA   GLN  51           HA       GLN  51  13.684 -14.311  -5.384
  363   1HB   GLN  51          1HB       GLN  51  10.829 -14.080  -4.859
  364   2HB   GLN  51          2HB       GLN  51  11.695 -13.446  -3.472
  365   1HG   GLN  51          1HG       GLN  51  12.986 -15.945  -4.279
  366   2HG   GLN  51          2HG       GLN  51  11.259 -16.217  -4.217
  367   1HE2  GLN  51          1HE2      GLN  51  11.351 -15.076  -0.553
  368   2HE2  GLN  51          2HE2      GLN  51  10.702 -14.287  -2.077
  369    H    ASN  52           H        ASN  52  12.079 -15.120  -7.046
  370    HA   ASN  52           HA       ASN  52  11.107 -12.961  -8.938
  371   1HB   ASN  52          1HB       ASN  52  12.911 -15.272  -9.871
  372   2HB   ASN  52          2HB       ASN  52  13.486 -13.646  -9.573
  373   1HD2  ASN  52          1HD2      ASN  52  12.795 -13.950 -13.257
  374   2HD2  ASN  52          2HD2      ASN  52  14.033 -14.399 -11.979
  375    HA   PRO  53           HA       PRO  53   7.696 -16.314  -8.396
  376   1HB   PRO  53          1HB       PRO  53   5.687 -15.043  -8.457
  377   2HB   PRO  53          2HB       PRO  53   6.273 -14.035  -9.788
  378   1HG   PRO  53          1HG       PRO  53   6.599 -12.483  -8.082
  379   2HG   PRO  53          2HG       PRO  53   6.868 -13.700  -6.813
  380   1HD   PRO  53          1HD       PRO  53   9.172 -13.215  -7.198
  381   2HD   PRO  53          2HD       PRO  53   8.852 -12.504  -8.807
  382    H    THR  54           H        THR  54   6.366 -17.315 -10.102
  383    HA   THR  54           HA       THR  54   7.813 -17.457 -12.758
  384    HB   THR  54           HB       THR  54   7.200 -19.539 -11.333
  385    HG1  THR  54           HG1      THR  54   6.957 -20.708 -13.226
  386   1HG2  THR  54          1HG2      THR  54   5.056 -20.657 -11.850
  387   2HG2  THR  54          2HG2      THR  54   4.744 -19.122 -11.007
  388   3HG2  THR  54          3HG2      THR  54   4.487 -19.241 -12.767
  389    H    LYS  55           H        LYS  55   6.352 -17.829 -14.692
  390    HA   LYS  55           HA       LYS  55   4.728 -15.429 -15.182
  391   1HB   LYS  55          1HB       LYS  55   5.073 -15.961 -17.353
  392   2HB   LYS  55          2HB       LYS  55   6.007 -17.339 -16.809
  393   1HG   LYS  55          1HG       LYS  55   2.987 -17.555 -17.225
  394   2HG   LYS  55          2HG       LYS  55   4.095 -17.684 -18.580
  395   1HD   LYS  55          1HD       LYS  55   4.049 -19.959 -18.079
  396   2HD   LYS  55          2HD       LYS  55   3.419 -19.664 -16.466
  397   1HE   LYS  55          1HE       LYS  55   6.234 -18.819 -16.580
  398   2HE   LYS  55          2HE       LYS  55   5.463 -19.958 -15.479
  399   1HZ   LYS  55          1HZ       LYS  55   6.070 -20.805 -18.253
  400   2HZ   LYS  55          2HZ       LYS  55   5.959 -21.729 -16.888
  401   3HZ   LYS  55          3HZ       LYS  55   7.279 -20.765 -17.127
  402    H    GLU  56           H        GLU  56   4.042 -18.793 -14.386
  403    HA   GLU  56           HA       GLU  56   1.164 -18.868 -14.818
  404   1HB   GLU  56          1HB       GLU  56   3.002 -20.507 -13.020
  405   2HB   GLU  56          2HB       GLU  56   2.316 -20.949 -14.571
  406   1HG   GLU  56          1HG       GLU  56   0.269 -20.370 -12.429
  407   2HG   GLU  56          2HG       GLU  56   1.333 -21.719 -12.072
  408    H    GLU  57           H        GLU  57   2.979 -18.488 -11.752
  409    HA   GLU  57           HA       GLU  57   0.787 -17.756 -10.018
  410   1HB   GLU  57          1HB       GLU  57   2.635 -16.508  -8.639
  411   2HB   GLU  57          2HB       GLU  57   3.758 -17.158  -9.813
  412   1HG   GLU  57          1HG       GLU  57   2.162 -18.622  -7.670
  413   2HG   GLU  57          2HG       GLU  57   2.512 -19.521  -9.140
  414    H    LEU  58           H        LEU  58   2.725 -15.844 -12.248
  415    HA   LEU  58           HA       LEU  58   2.155 -13.165 -11.368
  416   1HB   LEU  58          1HB       LEU  58   3.133 -14.442 -13.896
  417   2HB   LEU  58          2HB       LEU  58   2.370 -12.883 -14.130
  418    HG   LEU  58           HG       LEU  58   4.526 -13.214 -11.974
  419   1HD1  LEU  58          1HD1      LEU  58   6.283 -12.529 -13.654
  420   2HD1  LEU  58          2HD1      LEU  58   5.613 -14.121 -14.038
  421   3HD1  LEU  58          3HD1      LEU  58   5.098 -12.697 -14.974
  422   1HD2  LEU  58          1HD2      LEU  58   3.673 -10.797 -13.699
  423   2HD2  LEU  58          2HD2      LEU  58   3.218 -11.085 -12.001
  424   3HD2  LEU  58          3HD2      LEU  58   4.915 -10.788 -12.421
  425    H    ASP  59           H        ASP  59   0.362 -15.363 -13.489
  426    HA   ASP  59           HA       ASP  59  -1.701 -13.512 -14.427
  427   1HB   ASP  59          1HB       ASP  59  -1.224 -15.653 -15.601
  428   2HB   ASP  59          2HB       ASP  59  -1.828 -16.573 -14.242
  429    H    ALA  60           H        ALA  60  -1.365 -15.537 -11.570
  430    HA   ALA  60           HA       ALA  60  -4.088 -15.350 -10.507
  431   1HB   ALA  60          1HB       ALA  60  -3.090 -16.104  -8.354
  432   2HB   ALA  60          2HB       ALA  60  -2.490 -17.066  -9.719
  433   3HB   ALA  60          3HB       ALA  60  -1.448 -15.823  -8.980
  434    H    ILE  61           H        ILE  61  -1.125 -13.462  -9.890
  435    HA   ILE  61           HA       ILE  61  -2.129 -11.713  -7.777
  436    HB   ILE  61           HB       ILE  61   0.280 -11.745  -9.525
  437   1HG1  ILE  61          1HG1      ILE  61   1.219 -12.250  -7.520
  438   2HG1  ILE  61          2HG1      ILE  61  -0.336 -12.072  -6.734
  439   1HG2  ILE  61          1HG2      ILE  61   0.982  -9.382  -9.050
  440   2HG2  ILE  61          2HG2      ILE  61  -0.468  -9.408 -10.051
  441   3HG2  ILE  61          3HG2      ILE  61  -0.604  -9.039  -8.317
  442   1HD1  ILE  61          1HD1      ILE  61   0.061  -9.677  -6.225
  443   2HD1  ILE  61          2HD1      ILE  61   1.403 -10.677  -5.630
  444   3HD1  ILE  61          3HD1      ILE  61   1.607  -9.721  -7.116
  445    H    ILE  62           H        ILE  62  -1.724 -11.116 -11.286
  446    HA   ILE  62           HA       ILE  62  -3.007  -8.502 -11.390
  447    HB   ILE  62           HB       ILE  62  -2.129 -10.505 -13.413
  448   1HG1  ILE  62          1HG1      ILE  62  -1.948  -7.434 -13.168
  449   2HG1  ILE  62          2HG1      ILE  62  -0.678  -8.597 -12.851
  450   1HG2  ILE  62          1HG2      ILE  62  -3.364  -9.483 -15.345
  451   2HG2  ILE  62          2HG2      ILE  62  -4.497 -10.231 -14.222
  452   3HG2  ILE  62          3HG2      ILE  62  -4.306  -8.463 -14.230
  453   1HD1  ILE  62          1HD1      ILE  62  -1.811  -7.996 -15.647
  454   2HD1  ILE  62          2HD1      ILE  62  -0.221  -7.545 -14.996
  455   3HD1  ILE  62          3HD1      ILE  62  -0.600  -9.259 -15.288
  456    H    GLU  63           H        GLU  63  -4.222 -11.811 -11.549
  457    HA   GLU  63           HA       GLU  63  -6.921 -11.566 -12.351
  458   1HB   GLU  63          1HB       GLU  63  -6.391 -13.263  -9.897
  459   2HB   GLU  63          2HB       GLU  63  -5.514 -13.638 -11.368
  460   1HG   GLU  63          1HG       GLU  63  -7.875 -13.707 -12.552
  461   2HG   GLU  63          2HG       GLU  63  -7.400 -15.047 -11.524
  462    H    GLU  64           H        GLU  64  -6.023 -11.557  -8.886
  463    HA   GLU  64           HA       GLU  64  -8.478 -10.629  -7.786
  464   1HB   GLU  64          1HB       GLU  64  -7.101 -11.385  -6.128
  465   2HB   GLU  64          2HB       GLU  64  -5.647 -10.681  -6.808
  466   1HG   GLU  64          1HG       GLU  64  -5.816  -8.774  -5.518
  467   2HG   GLU  64          2HG       GLU  64  -7.537  -8.591  -5.813
  468    H    VAL  65           H        VAL  65  -5.673  -8.703  -8.853
  469    HA   VAL  65           HA       VAL  65  -7.124  -6.091  -8.406
  470    HB   VAL  65           HB       VAL  65  -4.815  -5.205  -9.452
  471   1HG1  VAL  65          1HG1      VAL  65  -3.934  -4.969  -7.123
  472   2HG1  VAL  65          2HG1      VAL  65  -5.678  -4.646  -7.173
  473   3HG1  VAL  65          3HG1      VAL  65  -5.083  -6.197  -6.534
  474   1HG2  VAL  65          1HG2      VAL  65  -3.930  -7.931  -8.279
  475   2HG2  VAL  65          2HG2      VAL  65  -3.778  -7.417  -9.976
  476   3HG2  VAL  65          3HG2      VAL  65  -2.850  -6.586  -8.720
  477    H    ASP  66           H        ASP  66  -8.764  -6.717  -9.991
  478    HA   ASP  66           HA       ASP  66  -8.341  -5.403 -12.616
  479   1HB   ASP  66          1HB       ASP  66  -9.120  -7.749 -13.803
  480   2HB   ASP  66          2HB       ASP  66  -8.131  -8.408 -12.521
  481    H    GLU  67           H        GLU  67 -10.023  -5.134 -10.392
  482    HA   GLU  67           HA       GLU  67 -12.788  -6.112 -11.113
  483   1HB   GLU  67          1HB       GLU  67 -13.123  -4.284  -9.031
  484   2HB   GLU  67          2HB       GLU  67 -11.502  -4.873  -8.719
  485   1HG   GLU  67          1HG       GLU  67 -13.206  -6.188  -7.467
  486   2HG   GLU  67          2HG       GLU  67 -12.312  -7.218  -8.573
  487    H    ASP  68           H        ASP  68 -11.610  -4.625 -13.141
  488    HA   ASP  68           HA       ASP  68 -13.309  -2.099 -13.248
  489   1HB   ASP  68          1HB       ASP  68 -11.628  -0.615 -13.802
  490   2HB   ASP  68          2HB       ASP  68 -10.805  -1.619 -12.630
  491    H    GLY  69           H        GLY  69 -11.022  -4.100 -15.156
  492   1HA   GLY  69          1HA       GLY  69 -12.177  -5.454 -17.132
  493   2HA   GLY  69          2HA       GLY  69 -12.898  -3.898 -17.575
  494    H    SER  70           H        SER  70  -9.669  -5.178 -16.750
  495    HA   SER  70           HA       SER  70  -8.305  -4.402 -19.257
  496   1HB   SER  70          1HB       SER  70  -8.865  -2.112 -18.435
  497   2HB   SER  70          2HB       SER  70  -7.129  -2.385 -18.596
  498    HG   SER  70           HG       SER  70  -6.888  -2.280 -16.515
  499    H    GLY  71           H        GLY  71  -7.699  -6.601 -18.688
  500   1HA   GLY  71          1HA       GLY  71  -6.452  -7.741 -16.423
  501   2HA   GLY  71          2HA       GLY  71  -5.964  -8.162 -18.066
  502    H    THR  72           H        THR  72  -5.095  -5.406 -18.669
  503    HA   THR  72           HA       THR  72  -2.255  -5.662 -17.805
  504    HB   THR  72           HB       THR  72  -1.767  -3.665 -19.138
  505    HG1  THR  72           HG1      THR  72  -4.065  -2.888 -18.602
  506   1HG2  THR  72          1HG2      THR  72  -2.408  -4.399 -21.398
  507   2HG2  THR  72          2HG2      THR  72  -1.942  -5.823 -20.442
  508   3HG2  THR  72          3HG2      THR  72  -3.663  -5.486 -20.764
  509    H    ILE  73           H        ILE  73  -1.366  -3.158 -17.334
  510    HA   ILE  73           HA       ILE  73  -2.923  -1.927 -15.027
  511    HB   ILE  73           HB       ILE  73  -0.043  -2.905 -14.666
  512   1HG1  ILE  73          1HG1      ILE  73  -1.433  -4.205 -12.678
  513   2HG1  ILE  73          2HG1      ILE  73  -2.705  -4.141 -13.879
  514   1HG2  ILE  73          1HG2      ILE  73  -0.219  -2.094 -12.317
  515   2HG2  ILE  73          2HG2      ILE  73  -0.532  -0.754 -13.429
  516   3HG2  ILE  73          3HG2      ILE  73  -1.888  -1.538 -12.583
  517   1HD1  ILE  73          1HD1      ILE  73   0.030  -5.468 -14.335
  518   2HD1  ILE  73          2HD1      ILE  73  -1.540  -6.267 -14.107
  519   3HD1  ILE  73          3HD1      ILE  73  -1.243  -5.305 -15.575
  520    H    ASP  74           H        ASP  74  -3.172  -0.434 -16.829
  521    HA   ASP  74           HA       ASP  74  -0.935   1.058 -18.037
  522   1HB   ASP  74          1HB       ASP  74  -3.935   1.523 -17.900
  523   2HB   ASP  74          2HB       ASP  74  -2.936   1.057 -19.270
  524    H    PHE  75           H        PHE  75  -1.234   3.628 -17.732
  525    HA   PHE  75           HA       PHE  75   0.130   4.190 -15.188
  526   1HB   PHE  75          1HB       PHE  75  -0.973   6.271 -17.170
  527   2HB   PHE  75          2HB       PHE  75   0.507   5.390 -17.435
  528    HD1  PHE  75           HD1      PHE  75   1.061   5.499 -14.164
  529    HD2  PHE  75           HD2      PHE  75   0.379   8.404 -17.265
  530    HE1  PHE  75           HE1      PHE  75   2.286   7.190 -12.864
  531    HE2  PHE  75           HE2      PHE  75   1.615  10.080 -15.951
  532    HZ   PHE  75           HZ       PHE  75   2.543   9.487 -13.740
  533    H    GLU  76           H        GLU  76  -3.147   4.676 -16.401
  534    HA   GLU  76           HA       GLU  76  -4.141   6.497 -14.333
  535   1HB   GLU  76          1HB       GLU  76  -6.242   6.345 -15.278
  536   2HB   GLU  76          2HB       GLU  76  -6.086   4.652 -15.702
  537   1HG   GLU  76          1HG       GLU  76  -4.363   6.700 -17.185
  538   2HG   GLU  76          2HG       GLU  76  -4.885   5.113 -17.710
  539    H    GLU  77           H        GLU  77  -4.281   2.962 -14.701
  540    HA   GLU  77           HA       GLU  77  -5.788   2.481 -12.170
  541   1HB   GLU  77          1HB       GLU  77  -6.288   0.630 -13.291
  542   2HB   GLU  77          2HB       GLU  77  -5.024   0.895 -14.470
  543   1HG   GLU  77          1HG       GLU  77  -4.227  -0.293 -11.772
  544   2HG   GLU  77          2HG       GLU  77  -3.454  -0.504 -13.338
  545    H    PHE  78           H        PHE  78  -2.429   2.613 -13.147
  546    HA   PHE  78           HA       PHE  78  -1.213   1.274 -10.847
  547   1HB   PHE  78          1HB       PHE  78  -0.070   3.370 -12.790
  548   2HB   PHE  78          2HB       PHE  78   0.073   1.636 -12.926
  549    HD1  PHE  78           HD1      PHE  78   2.073   0.606 -12.046
  550    HD2  PHE  78           HD2      PHE  78   0.927   4.469 -10.537
  551    HE1  PHE  78           HE1      PHE  78   4.175   0.745 -10.773
  552    HE2  PHE  78           HE2      PHE  78   3.036   4.592  -9.275
  553    HZ   PHE  78           HZ       PHE  78   4.663   2.737  -9.392
  554    H    LEU  79           H        LEU  79  -2.292   4.567 -11.467
  555    HA   LEU  79           HA       LEU  79  -1.054   5.787  -9.039
  556   1HB   LEU  79          1HB       LEU  79  -3.022   6.805 -11.150
  557   2HB   LEU  79          2HB       LEU  79  -2.749   7.728  -9.688
  558    HG   LEU  79           HG       LEU  79  -0.524   6.944 -11.672
  559   1HD1  LEU  79          1HD1      LEU  79  -0.391   8.946  -9.330
  560   2HD1  LEU  79          2HD1      LEU  79   0.251   7.294  -9.269
  561   3HD1  LEU  79          3HD1      LEU  79   0.944   8.472 -10.411
  562   1HD2  LEU  79          1HD2      LEU  79  -0.563   9.259 -12.498
  563   2HD2  LEU  79          2HD2      LEU  79  -2.228   8.636 -12.609
  564   3HD2  LEU  79          3HD2      LEU  79  -1.788   9.734 -11.294
  565    H    VAL  80           H        VAL  80  -4.205   4.499  -9.976
  566    HA   VAL  80           HA       VAL  80  -5.722   5.371  -7.587
  567    HB   VAL  80           HB       VAL  80  -6.709   4.706  -9.864
  568   1HG1  VAL  80          1HG1      VAL  80  -7.429   2.327 -10.165
  569   2HG1  VAL  80          2HG1      VAL  80  -5.665   2.454 -10.173
  570   3HG1  VAL  80          3HG1      VAL  80  -6.496   1.842  -8.725
  571   1HG2  VAL  80          1HG2      VAL  80  -8.069   3.485  -7.373
  572   2HG2  VAL  80          2HG2      VAL  80  -8.192   5.186  -7.878
  573   3HG2  VAL  80          3HG2      VAL  80  -8.865   3.913  -8.907
  574    H    MET  81           H        MET  81  -3.738   2.603  -8.475
  575    HA   MET  81           HA       MET  81  -4.424   0.744  -6.298
  576   1HB   MET  81          1HB       MET  81  -1.989   0.974  -8.134
  577   2HB   MET  81          2HB       MET  81  -1.976  -0.134  -6.773
  578   1HG   MET  81          1HG       MET  81  -2.768  -0.974  -9.185
  579   2HG   MET  81          2HG       MET  81  -4.327  -0.271  -8.723
  580   1HE   MET  81          1HE       MET  81  -5.780  -2.324  -8.622
  581   2HE   MET  81          2HE       MET  81  -5.908  -3.197  -7.066
  582   3HE   MET  81          3HE       MET  81  -6.060  -1.417  -7.103
  583    H    MET  82           H        MET  82  -1.721   3.053  -6.709
  584    HA   MET  82           HA       MET  82  -0.509   2.586  -4.069
  585   1HB   MET  82          1HB       MET  82   0.557   4.991  -4.658
  586   2HB   MET  82          2HB       MET  82  -0.101   4.662  -6.250
  587   1HG   MET  82          1HG       MET  82   1.162   2.279  -5.938
  588   2HG   MET  82          2HG       MET  82   2.008   3.721  -6.514
  589   1HE   MET  82          1HE       MET  82   4.983   2.980  -4.599
  590   2HE   MET  82          2HE       MET  82   4.440   4.671  -4.807
  591   3HE   MET  82          3HE       MET  82   4.128   3.472  -6.096
  592    H    VAL  83           H        VAL  83  -2.951   4.805  -5.299
  593    HA   VAL  83           HA       VAL  83  -2.927   6.769  -3.101
  594    HB   VAL  83           HB       VAL  83  -4.723   6.256  -5.452
  595   1HG1  VAL  83          1HG1      VAL  83  -6.468   7.871  -4.678
  596   2HG1  VAL  83          2HG1      VAL  83  -6.446   6.436  -3.644
  597   3HG1  VAL  83          3HG1      VAL  83  -5.712   7.950  -3.066
  598   1HG2  VAL  83          1HG2      VAL  83  -3.530   8.862  -4.295
  599   2HG2  VAL  83          2HG2      VAL  83  -2.863   7.929  -5.655
  600   3HG2  VAL  83          3HG2      VAL  83  -4.440   8.715  -5.821
  601    NH1  ARG  84           NH1      ARG  84  -9.916  -0.713  -5.639
  602    NH2  ARG  84           NH2      ARG  84 -11.667  -0.641  -4.195
  603    H    ARG  84           H        ARG  84  -4.754   3.810  -3.807
  604    HA   ARG  84           HA       ARG  84  -6.843   3.910  -1.787
  605   1HB   ARG  84          1HB       ARG  84  -6.017   2.026  -3.726
  606   2HB   ARG  84          2HB       ARG  84  -5.728   1.188  -2.208
  607   1HG   ARG  84          1HG       ARG  84  -8.413   2.582  -2.610
  608   2HG   ARG  84          2HG       ARG  84  -8.018   1.237  -1.537
  609   1HD   ARG  84          1HD       ARG  84  -7.892  -0.358  -3.364
  610   2HD   ARG  84          2HD       ARG  84  -7.828   0.904  -4.596
  611    HE   ARG  84           HE       ARG  84 -10.347   1.223  -3.168
  612   1HH1  ARG  84          1HH1      ARG  84  -8.965  -0.400  -5.865
  613   2HH1  ARG  84          2HH1      ARG  84 -10.509  -1.333  -6.202
  614   1HH2  ARG  84          1HH2      ARG  84 -12.055  -0.270  -3.320
  615   2HH2  ARG  84          2HH2      ARG  84 -12.136  -1.270  -4.857
  616    H    GLN  85           H        GLN  85  -3.686   2.212  -1.640
  617    HA   GLN  85           HA       GLN  85  -3.885   1.354   1.156
  618   1HB   GLN  85          1HB       GLN  85  -1.783   0.426   0.916
  619   2HB   GLN  85          2HB       GLN  85  -2.311   0.497  -0.755
  620   1HG   GLN  85          1HG       GLN  85  -0.706   2.036  -1.379
  621   2HG   GLN  85          2HG       GLN  85  -0.791   2.938   0.118
  622   1HE2  GLN  85          1HE2      GLN  85   1.742  -0.380   0.022
  623   2HE2  GLN  85          2HE2      GLN  85   0.250  -0.316  -1.043
  624    H    MET  86           H        MET  86  -2.648   4.249  -0.431
  625    HA   MET  86           HA       MET  86  -1.034   5.483   1.583
  626   1HB   MET  86          1HB       MET  86  -2.593   7.605   0.374
  627   2HB   MET  86          2HB       MET  86  -2.344   6.381  -0.857
  628   1HG   MET  86          1HG       MET  86  -0.093   6.834  -1.078
  629   2HG   MET  86          2HG       MET  86   0.163   7.004   0.666
  630   1HE   MET  86          1HE       MET  86  -2.505   8.846  -1.744
  631   2HE   MET  86          2HE       MET  86  -1.624  10.366  -2.074
  632   3HE   MET  86          3HE       MET  86  -0.992   8.816  -2.703
  633    H    LYS  87           H        LYS  87  -4.542   5.299   1.279
  634    HA   LYS  87           HA       LYS  87  -5.276   7.034   3.592
  635   1HB   LYS  87          1HB       LYS  87  -6.798   5.959   1.574
  636   2HB   LYS  87          2HB       LYS  87  -7.434   6.596   3.083
  637   1HG   LYS  87          1HG       LYS  87  -7.417   4.283   4.092
  638   2HG   LYS  87          2HG       LYS  87  -6.835   3.615   2.576
  639   1HD   LYS  87          1HD       LYS  87  -9.398   5.278   2.541
  640   2HD   LYS  87          2HD       LYS  87  -8.888   3.984   1.462
  641   1HE   LYS  87          1HE       LYS  87  -9.715   3.506   4.406
  642   2HE   LYS  87          2HE       LYS  87 -10.805   3.316   3.026
  643   1HZ   LYS  87          1HZ       LYS  87  -9.441   1.303   3.945
  644   2HZ   LYS  87          2HZ       LYS  87  -8.242   1.871   2.961
  645   3HZ   LYS  87          3HZ       LYS  87  -9.704   1.446   2.320
  646    H    GLU  88           H        GLU  88  -5.436   6.513   5.673
  647    HA   GLU  88           HA       GLU  88  -5.707   3.924   6.915
  648   1HB   GLU  88          1HB       GLU  88  -3.153   3.882   7.805
  649   2HB   GLU  88          2HB       GLU  88  -3.735   2.938   6.448
  650   1HG   GLU  88          1HG       GLU  88  -2.692   5.702   5.763
  651   2HG   GLU  88          2HG       GLU  88  -2.550   4.201   4.865
  652    H    ASP  89           H        ASP  89  -4.223   7.120   7.002
  653    HA   ASP  89           HA       ASP  89  -5.007   7.481   9.941
  654   1HB   ASP  89          1HB       ASP  89  -3.526   9.778   9.236
  655   2HB   ASP  89          2HB       ASP  89  -2.697   8.499   8.380
  656    H    ALA  90           H        ALA  90  -7.203   7.602   9.218
  657    HA   ALA  90           HA       ALA  90  -8.195  10.387   8.919
  658   1HB   ALA  90          1HB       ALA  90  -9.385  10.121   6.727
  659   2HB   ALA  90          2HB       ALA  90  -7.628  10.003   6.506
  660   3HB   ALA  90          3HB       ALA  90  -8.627   8.529   6.474
   
  Start of MODEL          39
 Raw file had  660 H/Q atoms
  Start of MODEL   39
    1   1H    ALA   1          1H        ALA   1 -20.741   8.964 -18.673
    2   2H    ALA   1          2H        ALA   1 -21.190   8.956 -20.294
    3   3H    ALA   1          3H        ALA   1 -22.182   9.689 -19.151
    4    HA   ALA   1           HA       ALA   1 -23.037   7.801 -18.365
    5   1HB   ALA   1          1HB       ALA   1 -23.904   6.687 -20.220
    6   2HB   ALA   1          2HB       ALA   1 -22.330   6.499 -21.016
    7   3HB   ALA   1          3HB       ALA   1 -23.178   8.065 -21.082
    8    H    SER   2           H        SER   2 -22.656   5.904 -17.342
    9    HA   SER   2           HA       SER   2 -21.385   4.245 -16.147
   10   1HB   SER   2          1HB       SER   2 -19.580   3.709 -18.489
   11   2HB   SER   2          2HB       SER   2 -20.502   2.595 -17.475
   12    HG   SER   2           HG       SER   2 -21.203   2.992 -19.712
   13    H    MET   3           H        MET   3 -20.521   5.948 -14.825
   14    HA   MET   3           HA       MET   3 -17.715   6.956 -15.426
   15   1HB   MET   3          1HB       MET   3 -19.903   7.847 -13.500
   16   2HB   MET   3          2HB       MET   3 -18.240   8.311 -13.192
   17   1HG   MET   3          1HG       MET   3 -18.210   9.266 -15.645
   18   2HG   MET   3          2HG       MET   3 -19.964   9.037 -15.629
   19   1HE   MET   3          1HE       MET   3 -20.613  11.848 -15.790
   20   2HE   MET   3          2HE       MET   3 -18.894  11.703 -16.262
   21   3HE   MET   3          3HE       MET   3 -19.390  12.952 -15.084
   22    H    THR   4           H        THR   4 -16.494   7.222 -13.160
   23    HA   THR   4           HA       THR   4 -16.751   4.963 -11.250
   24    HB   THR   4           HB       THR   4 -15.726   3.898 -13.293
   25    HG1  THR   4           HG1      THR   4 -15.722   3.245 -11.044
   26   1HG2  THR   4          1HG2      THR   4 -13.774   5.823 -13.428
   27   2HG2  THR   4          2HG2      THR   4 -13.534   4.155 -13.996
   28   3HG2  THR   4          3HG2      THR   4 -12.942   4.647 -12.388
   29    H    ASP   5           H        ASP   5 -16.595   6.214  -9.522
   30    HA   ASP   5           HA       ASP   5 -14.705   8.556  -9.349
   31   1HB   ASP   5          1HB       ASP   5 -17.092   8.765  -8.568
   32   2HB   ASP   5          2HB       ASP   5 -15.887   9.274  -7.406
   33    H    GLN   6           H        GLN   6 -13.710   5.735  -9.362
   34    HA   GLN   6           HA       GLN   6 -12.741   5.155  -6.554
   35   1HB   GLN   6          1HB       GLN   6 -13.500   3.452  -8.532
   36   2HB   GLN   6          2HB       GLN   6 -12.431   3.022  -7.211
   37   1HG   GLN   6          1HG       GLN   6 -11.904   2.772  -9.984
   38   2HG   GLN   6          2HG       GLN   6 -10.920   4.144  -9.526
   39   1HE2  GLN   6          1HE2      GLN   6  -8.410   1.827  -8.476
   40   2HE2  GLN   6          2HE2      GLN   6  -8.879   3.390  -9.315
   41    H    GLN   7           H        GLN   7 -11.586   6.331  -9.672
   42    HA   GLN   7           HA       GLN   7  -8.687   6.485  -8.746
   43   1HB   GLN   7          1HB       GLN   7  -8.385   7.377 -11.217
   44   2HB   GLN   7          2HB       GLN   7  -8.636   5.664 -10.910
   45   1HG   GLN   7          1HG       GLN   7 -10.190   5.791 -12.563
   46   2HG   GLN   7          2HG       GLN   7 -11.265   6.366 -11.298
   47   1HE2  GLN   7          1HE2      GLN   7 -11.777   9.151 -13.557
   48   2HE2  GLN   7          2HE2      GLN   7 -12.463   7.623 -12.806
   49    H    ALA   8           H        ALA   8 -11.452   8.484  -9.663
   50    HA   ALA   8           HA       ALA   8 -10.318  11.108  -9.924
   51   1HB   ALA   8          1HB       ALA   8 -12.553  11.985  -9.264
   52   2HB   ALA   8          2HB       ALA   8 -12.700  10.627 -10.395
   53   3HB   ALA   8          3HB       ALA   8 -13.041  10.382  -8.663
   54    H    GLU   9           H        GLU   9 -10.961   9.175  -7.054
   55    HA   GLU   9           HA       GLU   9 -10.717  11.278  -5.010
   56   1HB   GLU   9          1HB       GLU   9 -10.031   8.386  -4.330
   57   2HB   GLU   9          2HB       GLU   9 -10.817   9.615  -3.349
   58   1HG   GLU   9          1HG       GLU   9 -12.692   9.339  -5.425
   59   2HG   GLU   9          2HG       GLU   9 -12.058   7.702  -5.299
   60    H    ALA  10           H        ALA  10  -8.426   8.880  -6.316
   61    HA   ALA  10           HA       ALA  10  -6.167   9.531  -4.540
   62   1HB   ALA  10          1HB       ALA  10  -4.810   8.136  -6.092
   63   2HB   ALA  10          2HB       ALA  10  -6.336   7.335  -5.671
   64   3HB   ALA  10          3HB       ALA  10  -6.142   8.095  -7.271
   65    NH1  ARG  11           NH1      ARG  11  -3.670  11.987 -13.286
   66    NH2  ARG  11           NH2      ARG  11  -5.157  13.420 -14.232
   67    H    ARG  11           H        ARG  11  -7.275  10.692  -7.675
   68    HA   ARG  11           HA       ARG  11  -4.811  12.123  -8.530
   69   1HB   ARG  11          1HB       ARG  11  -7.648  12.769  -9.512
   70   2HB   ARG  11          2HB       ARG  11  -6.116  13.044 -10.327
   71   1HG   ARG  11          1HG       ARG  11  -6.481  10.166  -9.687
   72   2HG   ARG  11          2HG       ARG  11  -7.803  10.796 -10.672
   73   1HD   ARG  11          1HD       ARG  11  -4.840  10.595 -11.355
   74   2HD   ARG  11          2HD       ARG  11  -6.232  10.127 -12.334
   75    HE   ARG  11           HE       ARG  11  -6.457  12.966 -12.138
   76   1HH1  ARG  11          1HH1      ARG  11  -3.472  11.312 -12.539
   77   2HH1  ARG  11          2HH1      ARG  11  -3.029  12.289 -14.028
   78   1HH2  ARG  11          1HH2      ARG  11  -6.103  13.816 -14.226
   79   2HH2  ARG  11          2HH2      ARG  11  -4.402  13.641 -14.891
   80    H    ALA  12           H        ALA  12  -7.803  12.976  -6.834
   81    HA   ALA  12           HA       ALA  12  -7.313  15.901  -6.605
   82   1HB   ALA  12          1HB       ALA  12  -9.184  15.878  -4.968
   83   2HB   ALA  12          2HB       ALA  12  -9.608  14.985  -6.442
   84   3HB   ALA  12          3HB       ALA  12  -9.192  14.098  -4.954
   85    H    PHE  13           H        PHE  13  -6.467  13.019  -4.768
   86    HA   PHE  13           HA       PHE  13  -5.688  14.228  -2.241
   87   1HB   PHE  13          1HB       PHE  13  -6.092  11.718  -2.884
   88   2HB   PHE  13          2HB       PHE  13  -4.415  11.675  -3.363
   89    HD1  PHE  13           HD1      PHE  13  -3.389  13.631  -1.079
   90    HD2  PHE  13           HD2      PHE  13  -5.982  10.195  -1.015
   91    HE1  PHE  13           HE1      PHE  13  -2.795  13.211   1.272
   92    HE2  PHE  13           HE2      PHE  13  -5.376   9.795   1.335
   93    HZ   PHE  13           HZ       PHE  13  -3.782  11.294   2.481
   94    H    LEU  14           H        LEU  14  -3.773  13.287  -5.108
   95    HA   LEU  14           HA       LEU  14  -1.534  15.225  -4.291
   96   1HB   LEU  14          1HB       LEU  14  -0.094  13.443  -5.740
   97   2HB   LEU  14          2HB       LEU  14  -0.234  13.387  -3.996
   98    HG   LEU  14           HG       LEU  14  -2.314  11.756  -4.470
   99   1HD1  LEU  14          1HD1      LEU  14   0.575  10.751  -4.863
  100   2HD1  LEU  14          2HD1      LEU  14  -0.130  11.174  -3.292
  101   3HD1  LEU  14          3HD1      LEU  14  -0.807   9.820  -4.230
  102   1HD2  LEU  14          1HD2      LEU  14  -2.129  10.389  -6.507
  103   2HD2  LEU  14          2HD2      LEU  14  -2.215  12.092  -7.021
  104   3HD2  LEU  14          3HD2      LEU  14  -0.658  11.250  -7.026
  105    H    SER  15           H        SER  15  -1.297  16.748  -5.716
  106    HA   SER  15           HA       SER  15  -2.671  16.783  -8.364
  107   1HB   SER  15          1HB       SER  15  -0.778  18.986  -8.048
  108   2HB   SER  15          2HB       SER  15  -1.671  18.750  -6.543
  109    HG   SER  15           HG       SER  15  -2.652  20.096  -8.187
  110    H    GLU  16           H        GLU  16  -0.721  18.252  -9.816
  111    HA   GLU  16           HA       GLU  16   0.828  16.028 -11.055
  112   1HB   GLU  16          1HB       GLU  16   0.525  18.985 -11.761
  113   2HB   GLU  16          2HB       GLU  16  -0.220  17.604 -12.543
  114   1HG   GLU  16          1HG       GLU  16   1.456  17.874 -14.091
  115   2HG   GLU  16          2HG       GLU  16   2.434  16.956 -12.959
  116    H    GLU  17           H        GLU  17   1.453  18.814  -9.018
  117    HA   GLU  17           HA       GLU  17   4.356  19.010  -9.295
  118   1HB   GLU  17          1HB       GLU  17   3.709  20.904  -8.251
  119   2HB   GLU  17          2HB       GLU  17   4.179  20.012  -6.817
  120   1HG   GLU  17          1HG       GLU  17   2.122  20.681  -6.031
  121   2HG   GLU  17          2HG       GLU  17   1.522  19.284  -6.907
  122    H    MET  18           H        MET  18   2.288  17.171  -7.066
  123    HA   MET  18           HA       MET  18   4.563  15.968  -5.522
  124   1HB   MET  18          1HB       MET  18   2.557  14.487  -4.584
  125   2HB   MET  18          2HB       MET  18   1.533  15.658  -5.394
  126   1HG   MET  18          1HG       MET  18   1.635  16.652  -3.290
  127   2HG   MET  18          2HG       MET  18   3.023  17.464  -4.033
  128   1HE   MET  18          1HE       MET  18   3.891  17.974  -1.495
  129   2HE   MET  18          2HE       MET  18   5.327  16.975  -1.123
  130   3HE   MET  18          3HE       MET  18   5.150  17.714  -2.743
  131    H    ILE  19           H        ILE  19   2.373  15.095  -8.137
  132    HA   ILE  19           HA       ILE  19   2.884  12.201  -8.194
  133    HB   ILE  19           HB       ILE  19   1.558  14.140 -10.095
  134   1HG1  ILE  19          1HG1      ILE  19   0.485  11.433  -9.110
  135   2HG1  ILE  19          2HG1      ILE  19   0.452  12.834  -8.061
  136   1HG2  ILE  19          1HG2      ILE  19   1.183  12.366 -11.827
  137   2HG2  ILE  19          2HG2      ILE  19   2.904  12.710 -11.673
  138   3HG2  ILE  19          3HG2      ILE  19   2.233  11.239 -10.934
  139   1HD1  ILE  19          1HD1      ILE  19  -1.009  12.665 -10.763
  140   2HD1  ILE  19          2HD1      ILE  19  -1.722  12.645  -9.137
  141   3HD1  ILE  19          3HD1      ILE  19  -0.933  14.123  -9.736
  142    H    ALA  20           H        ALA  20   4.581  15.006  -9.427
  143    HA   ALA  20           HA       ALA  20   6.101  13.934 -11.616
  144   1HB   ALA  20          1HB       ALA  20   7.691  15.815 -11.230
  145   2HB   ALA  20          2HB       ALA  20   6.005  16.355 -11.098
  146   3HB   ALA  20          3HB       ALA  20   6.985  16.125  -9.627
  147    H    GLU  21           H        GLU  21   6.994  14.083  -8.152
  148    HA   GLU  21           HA       GLU  21   9.630  12.804  -8.406
  149   1HB   GLU  21          1HB       GLU  21   9.478  14.037  -6.462
  150   2HB   GLU  21          2HB       GLU  21   9.350  12.398  -5.856
  151   1HG   GLU  21          1HG       GLU  21   7.131  14.508  -6.095
  152   2HG   GLU  21          2HG       GLU  21   6.716  12.809  -5.937
  153    H    PHE  22           H        PHE  22   6.339  11.640  -7.978
  154    HA   PHE  22           HA       PHE  22   7.111   8.783  -7.459
  155   1HB   PHE  22          1HB       PHE  22   5.158   9.420  -6.275
  156   2HB   PHE  22          2HB       PHE  22   4.494  10.321  -7.611
  157    HD1  PHE  22           HD1      PHE  22   5.154   6.765  -6.511
  158    HD2  PHE  22           HD2      PHE  22   2.963   9.327  -9.188
  159    HE1  PHE  22           HE1      PHE  22   3.616   4.919  -7.035
  160    HE2  PHE  22           HE2      PHE  22   1.442   7.463  -9.708
  161    HZ   PHE  22           HZ       PHE  22   1.737   5.273  -8.602
  162    H    LYS  23           H        LYS  23   6.738  10.760 -10.219
  163    HA   LYS  23           HA       LYS  23   5.485   8.818 -12.116
  164   1HB   LYS  23          1HB       LYS  23   6.541  11.615 -12.270
  165   2HB   LYS  23          2HB       LYS  23   6.866  10.675 -13.710
  166   1HG   LYS  23          1HG       LYS  23   4.590  10.477 -14.295
  167   2HG   LYS  23          2HG       LYS  23   4.040  10.588 -12.632
  168   1HD   LYS  23          1HD       LYS  23   5.255  13.129 -13.112
  169   2HD   LYS  23          2HD       LYS  23   3.530  12.778 -12.953
  170   1HE   LYS  23          1HE       LYS  23   5.103  12.643 -15.614
  171   2HE   LYS  23          2HE       LYS  23   3.370  12.326 -15.440
  172   1HZ   LYS  23          1HZ       LYS  23   4.803  14.881 -15.276
  173   2HZ   LYS  23          2HZ       LYS  23   3.447  14.720 -14.346
  174   3HZ   LYS  23          3HZ       LYS  23   3.352  14.530 -15.984
  175    H    ALA  24           H        ALA  24   8.748   9.825 -11.197
  176    HA   ALA  24           HA       ALA  24  10.306   8.695 -13.364
  177   1HB   ALA  24          1HB       ALA  24  12.242   8.792 -11.805
  178   2HB   ALA  24          2HB       ALA  24  11.273  10.275 -11.719
  179   3HB   ALA  24          3HB       ALA  24  11.155   9.059 -10.421
  180    H    ALA  25           H        ALA  25   9.339   7.292 -10.225
  181    HA   ALA  25           HA       ALA  25  10.747   4.735 -10.488
  182   1HB   ALA  25          1HB       ALA  25   9.399   4.016  -8.524
  183   2HB   ALA  25          2HB       ALA  25  10.063   5.644  -8.285
  184   3HB   ALA  25          3HB       ALA  25   8.339   5.437  -8.689
  185    H    PHE  26           H        PHE  26   7.636   5.889 -11.590
  186    HA   PHE  26           HA       PHE  26   6.118   3.439 -11.867
  187   1HB   PHE  26          1HB       PHE  26   4.923   5.497 -12.188
  188   2HB   PHE  26          2HB       PHE  26   5.967   6.043 -13.472
  189    HD1  PHE  26           HD1      PHE  26   3.682   3.094 -12.686
  190    HD2  PHE  26           HD2      PHE  26   5.167   5.766 -15.713
  191    HE1  PHE  26           HE1      PHE  26   2.056   2.189 -14.298
  192    HE2  PHE  26           HE2      PHE  26   3.543   4.838 -17.315
  193    HZ   PHE  26           HZ       PHE  26   1.968   3.073 -16.604
  194    H    ASP  27           H        ASP  27   8.465   4.991 -14.037
  195    HA   ASP  27           HA       ASP  27   8.203   3.134 -16.306
  196   1HB   ASP  27          1HB       ASP  27  10.210   4.128 -17.250
  197   2HB   ASP  27          2HB       ASP  27   9.160   5.381 -16.630
  198    H    MET  28           H        MET  28  10.117   3.188 -13.360
  199    HA   MET  28           HA       MET  28  12.129   1.180 -13.926
  200   1HB   MET  28          1HB       MET  28  11.694   2.697 -11.721
  201   2HB   MET  28          2HB       MET  28  10.944   1.222 -11.139
  202   1HG   MET  28          1HG       MET  28  13.161  -0.021 -11.748
  203   2HG   MET  28          2HG       MET  28  13.204   1.089 -10.369
  204   1HE   MET  28          1HE       MET  28  14.971   2.838 -10.063
  205   2HE   MET  28          2HE       MET  28  15.467   3.967 -11.360
  206   3HE   MET  28          3HE       MET  28  13.751   3.880 -10.863
  207    H    PHE  29           H        PHE  29   8.803   0.867 -12.706
  208    HA   PHE  29           HA       PHE  29   8.900  -2.072 -12.287
  209   1HB   PHE  29          1HB       PHE  29   6.452  -0.211 -12.462
  210   2HB   PHE  29          2HB       PHE  29   6.382  -1.896 -12.019
  211    HD1  PHE  29           HD1      PHE  29   6.075  -2.218  -9.704
  212    HD2  PHE  29           HD2      PHE  29   8.625   1.014 -10.965
  213    HE1  PHE  29           HE1      PHE  29   6.484  -1.607  -7.355
  214    HE2  PHE  29           HE2      PHE  29   9.014   1.610  -8.610
  215    HZ   PHE  29           HZ       PHE  29   7.938   0.314  -6.805
  216    H    ASP  30           H        ASP  30   7.860   0.119 -14.858
  217    HA   ASP  30           HA       ASP  30   6.414  -1.777 -16.546
  218   1HB   ASP  30          1HB       ASP  30   7.873   0.575 -17.812
  219   2HB   ASP  30          2HB       ASP  30   6.589   0.893 -16.668
  220    H    ALA  31           H        ALA  31   9.527  -0.291 -17.460
  221    HA   ALA  31           HA       ALA  31  11.575  -1.217 -18.340
  222   1HB   ALA  31          1HB       ALA  31  12.127  -3.597 -17.836
  223   2HB   ALA  31          2HB       ALA  31  11.543  -2.740 -16.397
  224   3HB   ALA  31          3HB       ALA  31  10.474  -3.887 -17.245
  225    H    ASP  32           H        ASP  32   8.940  -1.005 -19.769
  226    HA   ASP  32           HA       ASP  32   9.504  -2.879 -22.124
  227   1HB   ASP  32          1HB       ASP  32   7.014  -2.662 -20.602
  228   2HB   ASP  32          2HB       ASP  32   7.497  -3.827 -21.812
  229    H    GLY  33           H        GLY  33   7.868   0.150 -21.138
  230   1HA   GLY  33          1HA       GLY  33   8.358   2.412 -22.065
  231   2HA   GLY  33          2HA       GLY  33   9.184   1.644 -23.401
  232    H    GLY  34           H        GLY  34   5.905   1.647 -21.949
  233   1HA   GLY  34          1HA       GLY  34   4.689   2.409 -24.668
  234   2HA   GLY  34          2HA       GLY  34   3.959   1.117 -23.706
  235    H    GLY  35           H        GLY  35   2.763   1.563 -21.924
  236   1HA   GLY  35          1HA       GLY  35   2.703   4.048 -20.375
  237   2HA   GLY  35          2HA       GLY  35   1.421   4.154 -21.590
  238    H    ASP  36           H        ASP  36   2.622   1.270 -19.905
  239    HA   ASP  36           HA       ASP  36   0.706   1.053 -17.758
  240   1HB   ASP  36          1HB       ASP  36  -1.258   0.719 -18.831
  241   2HB   ASP  36          2HB       ASP  36  -0.693  -0.929 -18.980
  242    H    ILE  37           H        ILE  37   1.267  -0.588 -16.484
  243    HA   ILE  37           HA       ILE  37   3.459  -2.494 -17.392
  244    HB   ILE  37           HB       ILE  37   2.634  -2.580 -14.527
  245   1HG1  ILE  37          1HG1      ILE  37   4.515  -0.278 -15.225
  246   2HG1  ILE  37          2HG1      ILE  37   2.784  -0.003 -15.283
  247   1HG2  ILE  37          1HG2      ILE  37   5.036  -2.979 -14.149
  248   2HG2  ILE  37          2HG2      ILE  37   4.457  -4.018 -15.458
  249   3HG2  ILE  37          3HG2      ILE  37   5.419  -2.570 -15.838
  250   1HD1  ILE  37          1HD1      ILE  37   4.320  -0.903 -12.772
  251   2HD1  ILE  37          2HD1      ILE  37   3.599   0.690 -13.091
  252   3HD1  ILE  37          3HD1      ILE  37   2.547  -0.727 -12.870
  253    H    SER  38           H        SER  38   3.260  -4.694 -16.120
  254    HA   SER  38           HA       SER  38   0.457  -5.852 -16.499
  255   1HB   SER  38          1HB       SER  38   0.975  -7.304 -18.194
  256   2HB   SER  38          2HB       SER  38   2.092  -6.006 -18.621
  257    HG   SER  38           HG       SER  38   3.023  -8.097 -18.552
  258    H    THR  39           H        THR  39   1.069  -8.477 -16.176
  259    HA   THR  39           HA       THR  39   1.795  -8.655 -13.257
  260    HB   THR  39           HB       THR  39   1.267 -11.280 -14.060
  261    HG1  THR  39           HG1      THR  39   0.551 -10.760 -16.019
  262   1HG2  THR  39          1HG2      THR  39  -0.903 -11.058 -12.932
  263   2HG2  THR  39          2HG2      THR  39   0.313 -10.143 -12.011
  264   3HG2  THR  39          3HG2      THR  39  -0.854  -9.284 -13.051
  265    H    LYS  40           H        LYS  40   2.895  -9.959 -16.388
  266    HA   LYS  40           HA       LYS  40   5.070 -11.656 -15.447
  267   1HB   LYS  40          1HB       LYS  40   4.978 -10.174 -18.123
  268   2HB   LYS  40          2HB       LYS  40   4.005 -11.589 -17.814
  269   1HG   LYS  40          1HG       LYS  40   7.087 -11.497 -17.586
  270   2HG   LYS  40          2HG       LYS  40   6.108 -12.940 -17.539
  271   1HD   LYS  40          1HD       LYS  40   6.006 -11.263 -20.099
  272   2HD   LYS  40          2HD       LYS  40   7.465 -12.124 -19.704
  273   1HE   LYS  40          1HE       LYS  40   5.572 -14.145 -19.321
  274   2HE   LYS  40          2HE       LYS  40   4.905 -13.276 -20.696
  275   1HZ   LYS  40          1HZ       LYS  40   7.390 -13.469 -21.534
  276   2HZ   LYS  40          2HZ       LYS  40   6.347 -14.740 -21.698
  277   3HZ   LYS  40          3HZ       LYS  40   7.454 -14.732 -20.471
  278    H    GLU  41           H        GLU  41   5.137  -8.339 -16.810
  279    HA   GLU  41           HA       GLU  41   7.969  -7.790 -16.423
  280   1HB   GLU  41          1HB       GLU  41   7.597  -5.591 -17.071
  281   2HB   GLU  41          2HB       GLU  41   6.017  -5.494 -16.325
  282   1HG   GLU  41          1HG       GLU  41   6.759  -6.719 -19.027
  283   2HG   GLU  41          2HG       GLU  41   5.307  -7.257 -18.212
  284    H    LEU  42           H        LEU  42   5.131  -6.921 -14.434
  285    HA   LEU  42           HA       LEU  42   6.421  -5.356 -12.373
  286   1HB   LEU  42          1HB       LEU  42   4.070  -5.253 -12.334
  287   2HB   LEU  42          2HB       LEU  42   3.859  -6.986 -12.464
  288    HG   LEU  42           HG       LEU  42   4.975  -6.996  -9.994
  289   1HD1  LEU  42          1HD1      LEU  42   4.269  -4.994  -8.657
  290   2HD1  LEU  42          2HD1      LEU  42   5.459  -4.556  -9.892
  291   3HD1  LEU  42          3HD1      LEU  42   3.739  -4.169 -10.145
  292   1HD2  LEU  42          1HD2      LEU  42   2.020  -6.222 -10.487
  293   2HD2  LEU  42          2HD2      LEU  42   2.684  -7.874 -10.507
  294   3HD2  LEU  42          3HD2      LEU  42   2.679  -6.945  -8.997
  295    H    GLY  43           H        GLY  43   5.991  -8.852 -12.727
  296   1HA   GLY  43          1HA       GLY  43   7.061 -10.744 -11.639
  297   2HA   GLY  43          2HA       GLY  43   6.668  -9.870 -10.153
  298    H    THR  44           H        THR  44   8.930  -9.144 -12.815
  299    HA   THR  44           HA       THR  44  11.388  -9.992 -11.649
  300    HB   THR  44           HB       THR  44  10.695  -8.103 -13.838
  301    HG1  THR  44           HG1      THR  44  11.258 -10.010 -14.479
  302   1HG2  THR  44          1HG2      THR  44  13.026  -7.252 -14.153
  303   2HG2  THR  44          2HG2      THR  44  12.288  -6.574 -12.687
  304   3HG2  THR  44          3HG2      THR  44  13.488  -7.885 -12.553
  305    H    VAL  45           H        VAL  45  10.065  -6.669 -11.592
  306    HA   VAL  45           HA       VAL  45  12.064  -5.385  -9.985
  307    HB   VAL  45           HB       VAL  45   9.335  -4.698 -10.835
  308   1HG1  VAL  45          1HG1      VAL  45  11.701  -2.831 -10.186
  309   2HG1  VAL  45          2HG1      VAL  45  11.543  -3.703 -11.716
  310   3HG1  VAL  45          3HG1      VAL  45  10.314  -2.502 -11.258
  311   1HG2  VAL  45          1HG2      VAL  45   8.740  -3.012  -9.173
  312   2HG2  VAL  45          2HG2      VAL  45   8.973  -4.533  -8.280
  313   3HG2  VAL  45          3HG2      VAL  45  10.234  -3.292  -8.240
  314    H    MET  46           H        MET  46   9.108  -7.117  -8.993
  315    HA   MET  46           HA       MET  46   9.094  -6.624  -6.163
  316   1HB   MET  46          1HB       MET  46   8.143  -9.090  -7.717
  317   2HB   MET  46          2HB       MET  46   8.024  -8.999  -5.970
  318   1HG   MET  46          1HG       MET  46   6.836  -6.711  -7.619
  319   2HG   MET  46          2HG       MET  46   5.967  -8.250  -7.496
  320   1HE   MET  46          1HE       MET  46   4.178  -6.176  -6.432
  321   2HE   MET  46          2HE       MET  46   4.495  -5.447  -4.831
  322   3HE   MET  46          3HE       MET  46   5.497  -4.979  -6.236
  323    NH1  ARG  47           NH1      ARG  47   7.895 -12.159  -3.465
  324    NH2  ARG  47           NH2      ARG  47   6.601 -13.447  -4.819
  325    H    ARG  47           H        ARG  47  10.381  -9.573  -7.732
  326    HA   ARG  47           HA       ARG  47  12.270 -10.144  -5.442
  327   1HB   ARG  47          1HB       ARG  47  12.905 -12.162  -6.970
  328   2HB   ARG  47          2HB       ARG  47  11.579 -11.656  -8.010
  329   1HG   ARG  47          1HG       ARG  47  10.648 -13.349  -6.592
  330   2HG   ARG  47          2HG       ARG  47  11.412 -12.699  -5.141
  331   1HD   ARG  47          1HD       ARG  47   9.764 -11.049  -4.809
  332   2HD   ARG  47          2HD       ARG  47   9.514 -10.805  -6.531
  333    HE   ARG  47           HE       ARG  47   8.109 -12.914  -6.607
  334   1HH1  ARG  47          1HH1      ARG  47   8.721 -11.558  -3.374
  335   2HH1  ARG  47          2HH1      ARG  47   7.231 -12.408  -2.723
  336   1HH2  ARG  47          1HH2      ARG  47   6.439 -13.830  -5.757
  337   2HH2  ARG  47          2HH2      ARG  47   6.028 -13.605  -3.983
  338    H    MET  48           H        MET  48  12.852  -7.729  -6.653
  339    HA   MET  48           HA       MET  48  14.895  -7.733  -8.738
  340   1HB   MET  48          1HB       MET  48  15.723  -5.591  -7.201
  341   2HB   MET  48          2HB       MET  48  14.075  -5.758  -6.625
  342   1HG   MET  48          1HG       MET  48  13.901  -5.913  -9.511
  343   2HG   MET  48          2HG       MET  48  13.322  -4.623  -8.443
  344   1HE   MET  48          1HE       MET  48  14.351  -4.081 -11.476
  345   2HE   MET  48          2HE       MET  48  16.098  -3.739 -11.649
  346   3HE   MET  48          3HE       MET  48  15.540  -5.417 -11.381
  347    H    LEU  49           H        LEU  49  15.008  -8.291  -5.257
  348    HA   LEU  49           HA       LEU  49  17.792  -8.097  -4.642
  349   1HB   LEU  49          1HB       LEU  49  16.969  -8.673  -2.640
  350   2HB   LEU  49          2HB       LEU  49  17.084 -10.346  -3.147
  351    HG   LEU  49           HG       LEU  49  14.912 -10.141  -2.224
  352   1HD1  LEU  49          1HD1      LEU  49  13.272  -8.342  -2.741
  353   2HD1  LEU  49          2HD1      LEU  49  14.782  -7.645  -2.126
  354   3HD1  LEU  49          3HD1      LEU  49  14.418  -7.572  -3.868
  355   1HD2  LEU  49          1HD2      LEU  49  14.458  -9.869  -5.272
  356   2HD2  LEU  49          2HD2      LEU  49  14.777 -11.383  -4.391
  357   3HD2  LEU  49          3HD2      LEU  49  13.278 -10.491  -4.091
  358    H    GLY  50           H        GLY  50  16.471 -11.370  -4.785
  359   1HA   GLY  50          1HA       GLY  50  18.035 -12.274  -7.181
  360   2HA   GLY  50          2HA       GLY  50  18.789 -12.784  -5.664
  361    H    GLN  51           H        GLN  51  15.513 -12.647  -7.080
  362    HA   GLN  51           HA       GLN  51  15.120 -15.623  -6.552
  363   1HB   GLN  51          1HB       GLN  51  13.019 -13.557  -5.679
  364   2HB   GLN  51          2HB       GLN  51  14.144 -14.343  -4.588
  365   1HG   GLN  51          1HG       GLN  51  11.744 -15.518  -6.026
  366   2HG   GLN  51          2HG       GLN  51  13.083 -16.601  -5.718
  367   1HE2  GLN  51          1HE2      GLN  51  10.505 -16.127  -2.746
  368   2HE2  GLN  51          2HE2      GLN  51  10.224 -16.057  -4.558
  369    H    ASN  52           H        ASN  52  12.979 -16.266  -7.652
  370    HA   ASN  52           HA       ASN  52  12.233 -14.680 -10.074
  371   1HB   ASN  52          1HB       ASN  52  13.444 -17.427 -10.647
  372   2HB   ASN  52          2HB       ASN  52  14.483 -16.024 -10.518
  373   1HD2  ASN  52          1HD2      ASN  52  13.407 -16.569 -14.138
  374   2HD2  ASN  52          2HD2      ASN  52  14.207 -17.587 -12.838
  375    HA   PRO  53           HA       PRO  53   8.811 -17.568  -8.535
  376   1HB   PRO  53          1HB       PRO  53   6.667 -15.845  -8.740
  377   2HB   PRO  53          2HB       PRO  53   7.854 -15.799  -7.428
  378   1HG   PRO  53          1HG       PRO  53   7.729 -14.011  -9.899
  379   2HG   PRO  53          2HG       PRO  53   8.023 -13.531  -8.212
  380   1HD   PRO  53          1HD       PRO  53  10.342 -14.112  -8.367
  381   2HD   PRO  53          2HD       PRO  53  10.060 -13.958 -10.126
  382    H    THR  54           H        THR  54   6.506 -17.962  -9.625
  383    HA   THR  54           HA       THR  54   7.001 -18.571 -12.551
  384    HB   THR  54           HB       THR  54   6.096 -20.259 -10.684
  385    HG1  THR  54           HG1      THR  54   6.570 -20.691 -12.842
  386   1HG2  THR  54          1HG2      THR  54   3.664 -20.679 -10.852
  387   2HG2  THR  54          2HG2      THR  54   3.948 -19.061 -10.169
  388   3HG2  THR  54          3HG2      THR  54   3.440 -19.235 -11.868
  389    H    LYS  55           H        LYS  55   5.000 -18.429 -13.964
  390    HA   LYS  55           HA       LYS  55   4.202 -15.544 -14.040
  391   1HB   LYS  55          1HB       LYS  55   3.686 -17.865 -16.002
  392   2HB   LYS  55          2HB       LYS  55   4.947 -16.656 -16.126
  393   1HG   LYS  55          1HG       LYS  55   2.968 -14.905 -16.241
  394   2HG   LYS  55          2HG       LYS  55   3.447 -15.809 -17.667
  395   1HD   LYS  55          1HD       LYS  55   0.973 -15.791 -17.518
  396   2HD   LYS  55          2HD       LYS  55   1.020 -16.317 -15.842
  397   1HE   LYS  55          1HE       LYS  55   2.283 -18.472 -16.884
  398   2HE   LYS  55          2HE       LYS  55   0.527 -18.378 -16.779
  399   1HZ   LYS  55          1HZ       LYS  55   0.370 -17.953 -19.061
  400   2HZ   LYS  55          2HZ       LYS  55   1.639 -19.009 -19.008
  401   3HZ   LYS  55          3HZ       LYS  55   1.916 -17.392 -19.209
  402    H    GLU  56           H        GLU  56   2.722 -18.705 -13.529
  403    HA   GLU  56           HA       GLU  56  -0.099 -17.915 -13.670
  404   1HB   GLU  56          1HB       GLU  56  -0.113 -20.167 -12.029
  405   2HB   GLU  56          2HB       GLU  56   1.405 -20.369 -12.882
  406   1HG   GLU  56          1HG       GLU  56  -1.319 -19.932 -14.272
  407   2HG   GLU  56          2HG       GLU  56   0.203 -20.226 -15.094
  408    H    GLU  57           H        GLU  57   2.317 -18.014 -11.106
  409    HA   GLU  57           HA       GLU  57   0.544 -17.732  -8.773
  410   1HB   GLU  57          1HB       GLU  57   3.374 -16.676  -8.660
  411   2HB   GLU  57          2HB       GLU  57   3.132 -18.383  -8.962
  412   1HG   GLU  57          1HG       GLU  57   3.445 -17.416  -6.463
  413   2HG   GLU  57          2HG       GLU  57   1.714 -17.113  -6.553
  414    H    LEU  58           H        LEU  58   2.398 -15.402 -10.735
  415    HA   LEU  58           HA       LEU  58   1.730 -13.012  -9.163
  416   1HB   LEU  58          1HB       LEU  58   3.203 -13.638 -11.677
  417   2HB   LEU  58          2HB       LEU  58   2.390 -12.087 -11.734
  418    HG   LEU  58           HG       LEU  58   3.998 -12.672  -9.225
  419   1HD1  LEU  58          1HD1      LEU  58   6.161 -11.971 -10.322
  420   2HD1  LEU  58          2HD1      LEU  58   5.591 -13.520 -10.960
  421   3HD1  LEU  58          3HD1      LEU  58   5.381 -12.037 -11.923
  422   1HD2  LEU  58          1HD2      LEU  58   3.700 -10.151 -10.984
  423   2HD2  LEU  58          2HD2      LEU  58   2.790 -10.502  -9.493
  424   3HD2  LEU  58          3HD2      LEU  58   4.543 -10.243  -9.417
  425    H    ASP  59           H        ASP  59   0.307 -14.663 -11.930
  426    HA   ASP  59           HA       ASP  59  -1.540 -12.622 -12.876
  427   1HB   ASP  59          1HB       ASP  59  -0.942 -14.674 -14.200
  428   2HB   ASP  59          2HB       ASP  59  -1.879 -15.665 -13.105
  429    H    ALA  60           H        ALA  60  -1.753 -15.046 -10.324
  430    HA   ALA  60           HA       ALA  60  -4.628 -14.597  -9.678
  431   1HB   ALA  60          1HB       ALA  60  -4.204 -16.123  -7.757
  432   2HB   ALA  60          2HB       ALA  60  -3.577 -16.800  -9.272
  433   3HB   ALA  60          3HB       ALA  60  -2.455 -16.097  -8.080
  434    H    ILE  61           H        ILE  61  -1.511 -13.409  -8.564
  435    HA   ILE  61           HA       ILE  61  -2.326 -12.231  -6.003
  436    HB   ILE  61           HB       ILE  61   0.122 -12.091  -7.716
  437   1HG1  ILE  61          1HG1      ILE  61  -0.634 -13.258  -5.195
  438   2HG1  ILE  61          2HG1      ILE  61   0.905 -13.376  -6.023
  439   1HG2  ILE  61          1HG2      ILE  61   1.148 -10.165  -6.473
  440   2HG2  ILE  61          2HG2      ILE  61  -0.251  -9.629  -7.400
  441   3HG2  ILE  61          3HG2      ILE  61  -0.396  -9.855  -5.641
  442   1HD1  ILE  61          1HD1      ILE  61   0.227 -11.218  -3.937
  443   2HD1  ILE  61          2HD1      ILE  61   1.322 -12.605  -3.752
  444   3HD1  ILE  61          3HD1      ILE  61   1.746 -11.291  -4.873
  445    H    ILE  62           H        ILE  62  -2.226 -11.085  -9.345
  446    HA   ILE  62           HA       ILE  62  -2.923  -8.244  -8.721
  447    HB   ILE  62           HB       ILE  62  -2.409  -9.798 -11.253
  448   1HG1  ILE  62          1HG1      ILE  62  -0.488  -8.652 -10.249
  449   2HG1  ILE  62          2HG1      ILE  62  -1.377  -7.157 -10.056
  450   1HG2  ILE  62          1HG2      ILE  62  -3.224  -7.934 -12.725
  451   2HG2  ILE  62          2HG2      ILE  62  -4.568  -8.639 -11.830
  452   3HG2  ILE  62          3HG2      ILE  62  -3.888  -7.081 -11.310
  453   1HD1  ILE  62          1HD1      ILE  62  -1.424  -6.726 -12.497
  454   2HD1  ILE  62          2HD1      ILE  62   0.238  -7.017 -11.944
  455   3HD1  ILE  62          3HD1      ILE  62  -0.639  -8.298 -12.813
  456    H    GLU  63           H        GLU  63  -4.542 -11.211  -9.758
  457    HA   GLU  63           HA       GLU  63  -7.179 -10.359 -10.398
  458   1HB   GLU  63          1HB       GLU  63  -6.022 -12.884  -9.318
  459   2HB   GLU  63          2HB       GLU  63  -7.053 -12.609 -10.708
  460   1HG   GLU  63          1HG       GLU  63  -7.837 -13.129  -7.806
  461   2HG   GLU  63          2HG       GLU  63  -8.941 -12.181  -8.787
  462    H    GLU  64           H        GLU  64  -5.608 -10.621  -7.254
  463    HA   GLU  64           HA       GLU  64  -7.870 -10.101  -5.492
  464   1HB   GLU  64          1HB       GLU  64  -5.378 -10.841  -4.965
  465   2HB   GLU  64          2HB       GLU  64  -5.068  -9.123  -4.808
  466   1HG   GLU  64          1HG       GLU  64  -7.441 -10.239  -3.257
  467   2HG   GLU  64          2HG       GLU  64  -5.841 -10.727  -2.728
  468    H    VAL  65           H        VAL  65  -5.322  -7.836  -6.601
  469    HA   VAL  65           HA       VAL  65  -7.190  -5.475  -6.094
  470    HB   VAL  65           HB       VAL  65  -5.116  -5.359  -4.824
  471   1HG1  VAL  65          1HG1      VAL  65  -4.985  -3.202  -7.028
  472   2HG1  VAL  65          2HG1      VAL  65  -6.198  -3.214  -5.734
  473   3HG1  VAL  65          3HG1      VAL  65  -4.473  -3.052  -5.329
  474   1HG2  VAL  65          1HG2      VAL  65  -2.861  -5.197  -5.756
  475   2HG2  VAL  65          2HG2      VAL  65  -3.595  -6.653  -6.469
  476   3HG2  VAL  65          3HG2      VAL  65  -3.470  -5.173  -7.429
  477    H    ASP  66           H        ASP  66  -8.284  -6.196  -8.090
  478    HA   ASP  66           HA       ASP  66  -7.574  -4.497 -10.400
  479   1HB   ASP  66          1HB       ASP  66  -5.938  -6.574 -10.562
  480   2HB   ASP  66          2HB       ASP  66  -7.346  -7.455 -11.110
  481    H    GLU  67           H        GLU  67  -9.741  -4.731  -8.760
  482    HA   GLU  67           HA       GLU  67 -11.919  -6.373 -10.038
  483   1HB   GLU  67          1HB       GLU  67 -11.507  -5.803  -7.459
  484   2HB   GLU  67          2HB       GLU  67 -12.435  -4.359  -7.818
  485   1HG   GLU  67          1HG       GLU  67 -14.170  -6.186  -8.889
  486   2HG   GLU  67          2HG       GLU  67 -14.209  -5.703  -7.202
  487    H    ASP  68           H        ASP  68 -10.569  -4.156 -11.529
  488    HA   ASP  68           HA       ASP  68 -12.829  -2.132 -11.891
  489   1HB   ASP  68          1HB       ASP  68 -10.509  -1.216 -11.372
  490   2HB   ASP  68          2HB       ASP  68 -11.321  -0.547 -12.768
  491    H    GLY  69           H        GLY  69 -10.647  -4.374 -13.579
  492   1HA   GLY  69          1HA       GLY  69 -11.496  -5.892 -15.408
  493   2HA   GLY  69          2HA       GLY  69 -12.689  -4.656 -15.829
  494    H    SER  70           H        SER  70  -9.139  -4.765 -15.444
  495    HA   SER  70           HA       SER  70  -8.803  -3.397 -18.173
  496   1HB   SER  70          1HB       SER  70  -8.453  -1.793 -16.279
  497   2HB   SER  70          2HB       SER  70  -7.032  -1.993 -17.307
  498    HG   SER  70           HG       SER  70  -7.365  -3.619 -15.035
  499    H    GLY  71           H        GLY  71  -7.390  -5.477 -15.654
  500   1HA   GLY  71          1HA       GLY  71  -6.176  -7.418 -17.547
  501   2HA   GLY  71          2HA       GLY  71  -5.933  -7.399 -15.796
  502    H    THR  72           H        THR  72  -5.096  -4.552 -15.830
  503    HA   THR  72           HA       THR  72  -2.175  -5.034 -16.131
  504    HB   THR  72           HB       THR  72  -1.673  -3.091 -17.615
  505    HG1  THR  72           HG1      THR  72  -4.162  -3.150 -18.757
  506   1HG2  THR  72          1HG2      THR  72  -2.152  -4.116 -19.800
  507   2HG2  THR  72          2HG2      THR  72  -1.655  -5.390 -18.664
  508   3HG2  THR  72          3HG2      THR  72  -3.374  -5.201 -19.099
  509    H    ILE  73           H        ILE  73  -0.940  -3.385 -15.109
  510    HA   ILE  73           HA       ILE  73  -2.489  -1.737 -13.056
  511    HB   ILE  73           HB       ILE  73   0.415  -2.700 -13.019
  512   1HG1  ILE  73          1HG1      ILE  73  -1.538  -4.398 -12.535
  513   2HG1  ILE  73          2HG1      ILE  73  -1.833  -3.485 -11.070
  514   1HG2  ILE  73          1HG2      ILE  73   0.632  -1.695 -10.749
  515   2HG2  ILE  73          2HG2      ILE  73   0.209  -0.434 -11.915
  516   3HG2  ILE  73          3HG2      ILE  73  -1.034  -1.074 -10.813
  517   1HD1  ILE  73          1HD1      ILE  73   0.424  -3.979 -10.168
  518   2HD1  ILE  73          2HD1      ILE  73  -0.420  -5.476 -10.617
  519   3HD1  ILE  73          3HD1      ILE  73   0.863  -4.835 -11.671
  520    H    ASP  74           H        ASP  74  -2.991  -0.277 -14.850
  521    HA   ASP  74           HA       ASP  74  -1.000   1.333 -16.263
  522   1HB   ASP  74          1HB       ASP  74  -3.612   2.698 -15.688
  523   2HB   ASP  74          2HB       ASP  74  -2.716   2.546 -17.181
  524    H    PHE  75           H        PHE  75  -1.177   3.877 -15.895
  525    HA   PHE  75           HA       PHE  75   0.147   4.524 -13.329
  526   1HB   PHE  75          1HB       PHE  75  -0.997   6.532 -15.362
  527   2HB   PHE  75          2HB       PHE  75   0.523   5.709 -15.592
  528    HD1  PHE  75           HD1      PHE  75  -1.222   8.351 -13.672
  529    HD2  PHE  75           HD2      PHE  75   2.508   6.251 -14.123
  530    HE1  PHE  75           HE1      PHE  75  -0.099  10.017 -12.252
  531    HE2  PHE  75           HE2      PHE  75   3.611   7.927 -12.694
  532    HZ   PHE  75           HZ       PHE  75   2.310   9.799 -11.745
  533    H    GLU  76           H        GLU  76  -3.105   4.791 -14.652
  534    HA   GLU  76           HA       GLU  76  -4.312   6.587 -12.693
  535   1HB   GLU  76          1HB       GLU  76  -6.343   6.227 -13.688
  536   2HB   GLU  76          2HB       GLU  76  -5.235   5.859 -14.992
  537   1HG   GLU  76          1HG       GLU  76  -6.516   3.992 -15.302
  538   2HG   GLU  76          2HG       GLU  76  -5.595   3.313 -13.977
  539    H    GLU  77           H        GLU  77  -4.230   3.029 -12.903
  540    HA   GLU  77           HA       GLU  77  -5.675   2.525 -10.366
  541   1HB   GLU  77          1HB       GLU  77  -5.755   0.835 -12.091
  542   2HB   GLU  77          2HB       GLU  77  -4.014   0.684 -12.141
  543   1HG   GLU  77          1HG       GLU  77  -3.922  -0.463  -9.992
  544   2HG   GLU  77          2HG       GLU  77  -5.571  -0.006  -9.580
  545    H    PHE  78           H        PHE  78  -2.276   2.704 -11.326
  546    HA   PHE  78           HA       PHE  78  -0.998   1.733  -8.905
  547   1HB   PHE  78          1HB       PHE  78   0.059   3.883 -10.846
  548   2HB   PHE  78          2HB       PHE  78   0.187   2.164 -11.113
  549    HD1  PHE  78           HD1      PHE  78   0.660   2.067  -7.727
  550    HD2  PHE  78           HD2      PHE  78   2.624   3.772 -11.155
  551    HE1  PHE  78           HE1      PHE  78   2.816   1.997  -6.541
  552    HE2  PHE  78           HE2      PHE  78   4.771   3.691  -9.954
  553    HZ   PHE  78           HZ       PHE  78   4.874   2.794  -7.655
  554    H    LEU  79           H        LEU  79  -2.438   4.819  -9.763
  555    HA   LEU  79           HA       LEU  79  -1.345   6.432  -7.534
  556   1HB   LEU  79          1HB       LEU  79  -3.660   6.863  -9.493
  557   2HB   LEU  79          2HB       LEU  79  -3.413   7.963  -8.154
  558    HG   LEU  79           HG       LEU  79  -2.319   8.286 -10.662
  559   1HD1  LEU  79          1HD1      LEU  79  -0.886  10.062  -9.652
  560   2HD1  LEU  79          2HD1      LEU  79  -2.489  10.048  -8.895
  561   3HD1  LEU  79          3HD1      LEU  79  -1.096   9.350  -8.032
  562   1HD2  LEU  79          1HD2      LEU  79  -0.029   7.067  -8.976
  563   2HD2  LEU  79          2HD2      LEU  79  -0.704   6.387 -10.478
  564   3HD2  LEU  79          3HD2      LEU  79   0.167   7.927 -10.524
  565    H    VAL  80           H        VAL  80  -4.262   4.510  -8.064
  566    HA   VAL  80           HA       VAL  80  -5.733   5.313  -5.624
  567    HB   VAL  80           HB       VAL  80  -6.087   3.088  -7.647
  568   1HG1  VAL  80          1HG1      VAL  80  -8.040   2.164  -6.382
  569   2HG1  VAL  80          2HG1      VAL  80  -6.537   1.912  -5.485
  570   3HG1  VAL  80          3HG1      VAL  80  -7.653   3.204  -4.987
  571   1HG2  VAL  80          1HG2      VAL  80  -8.049   5.244  -6.625
  572   2HG2  VAL  80          2HG2      VAL  80  -7.125   5.335  -8.143
  573   3HG2  VAL  80          3HG2      VAL  80  -8.353   4.077  -7.935
  574    H    MET  81           H        MET  81  -3.331   2.879  -6.468
  575    HA   MET  81           HA       MET  81  -3.455   1.156  -4.086
  576   1HB   MET  81          1HB       MET  81  -0.982   1.700  -5.832
  577   2HB   MET  81          2HB       MET  81  -2.258   0.571  -6.250
  578   1HG   MET  81          1HG       MET  81  -0.832   0.235  -3.560
  579   2HG   MET  81          2HG       MET  81  -1.667  -0.983  -4.539
  580   1HE   MET  81          1HE       MET  81   0.312  -2.664  -4.308
  581   2HE   MET  81          2HE       MET  81   1.997  -2.336  -4.813
  582   3HE   MET  81          3HE       MET  81   1.328  -1.528  -3.366
  583    H    MET  82           H        MET  82  -1.152   3.755  -4.952
  584    HA   MET  82           HA       MET  82   0.270   3.841  -2.413
  585   1HB   MET  82          1HB       MET  82   0.729   6.369  -3.282
  586   2HB   MET  82          2HB       MET  82   0.070   5.730  -4.775
  587   1HG   MET  82          1HG       MET  82   2.105   4.832  -5.270
  588   2HG   MET  82          2HG       MET  82   1.979   3.760  -3.870
  589   1HE   MET  82          1HE       MET  82   4.310   4.859  -1.335
  590   2HE   MET  82          2HE       MET  82   2.838   3.942  -1.773
  591   3HE   MET  82          3HE       MET  82   2.689   5.548  -1.001
  592    H    VAL  83           H        VAL  83  -2.668   5.413  -3.547
  593    HA   VAL  83           HA       VAL  83  -2.888   7.468  -1.442
  594    HB   VAL  83           HB       VAL  83  -4.569   6.586  -3.727
  595   1HG1  VAL  83          1HG1      VAL  83  -6.689   7.639  -2.920
  596   2HG1  VAL  83          2HG1      VAL  83  -6.286   6.222  -1.941
  597   3HG1  VAL  83          3HG1      VAL  83  -5.990   7.852  -1.294
  598   1HG2  VAL  83          1HG2      VAL  83  -4.128   9.368  -2.453
  599   2HG2  VAL  83          2HG2      VAL  83  -3.228   8.704  -3.836
  600   3HG2  VAL  83          3HG2      VAL  83  -4.957   9.044  -3.997
  601    NH1  ARG  84           NH1      ARG  84  -5.567  -2.208  -2.969
  602    NH2  ARG  84           NH2      ARG  84  -7.044  -2.918  -1.397
  603    H    ARG  84           H        ARG  84  -3.991   4.144  -1.848
  604    HA   ARG  84           HA       ARG  84  -6.048   3.842   0.136
  605   1HB   ARG  84          1HB       ARG  84  -4.180   2.003  -1.270
  606   2HB   ARG  84          2HB       ARG  84  -4.546   1.457   0.360
  607   1HG   ARG  84          1HG       ARG  84  -6.770   1.009  -0.077
  608   2HG   ARG  84          2HG       ARG  84  -6.962   2.355  -1.203
  609   1HD   ARG  84          1HD       ARG  84  -6.453   1.079  -3.048
  610   2HD   ARG  84          2HD       ARG  84  -5.081   0.288  -2.271
  611    HE   ARG  84           HE       ARG  84  -7.960  -0.592  -1.681
  612   1HH1  ARG  84          1HH1      ARG  84  -7.781  -2.673  -0.726
  613   2HH1  ARG  84          2HH1      ARG  84  -6.668  -3.854  -1.582
  614   1HH2  ARG  84          1HH2      ARG  84  -5.136  -1.415  -3.457
  615   2HH2  ARG  84          2HH2      ARG  84  -5.341  -3.202  -3.091
  616    H    GLN  85           H        GLN  85  -2.596   3.005   0.631
  617    HA   GLN  85           HA       GLN  85  -2.765   2.618   3.521
  618   1HB   GLN  85          1HB       GLN  85  -0.881   1.955   1.718
  619   2HB   GLN  85          2HB       GLN  85  -0.579   2.039   3.443
  620   1HG   GLN  85          1HG       GLN  85   0.779   3.446   1.338
  621   2HG   GLN  85          2HG       GLN  85  -0.082   4.685   2.224
  622   1HE2  GLN  85          1HE2      GLN  85   1.787   3.583   5.376
  623   2HE2  GLN  85          2HE2      GLN  85   0.042   3.808   4.855
  624    H    MET  86           H        MET  86  -2.111   5.427   1.498
  625    HA   MET  86           HA       MET  86  -0.990   7.271   3.437
  626   1HB   MET  86          1HB       MET  86  -2.600   8.837   1.628
  627   2HB   MET  86          2HB       MET  86  -2.012   7.465   0.706
  628   1HG   MET  86          1HG       MET  86   0.151   8.718   2.355
  629   2HG   MET  86          2HG       MET  86   0.152   8.239   0.650
  630   1HE   MET  86          1HE       MET  86  -2.674   9.764  -0.284
  631   2HE   MET  86          2HE       MET  86  -1.991  11.274  -0.956
  632   3HE   MET  86          3HE       MET  86  -1.216   9.706  -1.323
  633    H    LYS  87           H        LYS  87  -4.309   6.359   2.681
  634    HA   LYS  87           HA       LYS  87  -5.756   8.478   4.097
  635   1HB   LYS  87          1HB       LYS  87  -6.671   6.595   2.427
  636   2HB   LYS  87          2HB       LYS  87  -7.700   7.359   3.629
  637   1HG   LYS  87          1HG       LYS  87  -7.652   5.464   5.108
  638   2HG   LYS  87          2HG       LYS  87  -6.283   4.722   4.297
  639   1HD   LYS  87          1HD       LYS  87  -7.625   3.987   2.438
  640   2HD   LYS  87          2HD       LYS  87  -8.562   3.657   3.891
  641   1HE   LYS  87          1HE       LYS  87  -9.649   6.103   3.363
  642   2HE   LYS  87          2HE       LYS  87  -9.105   5.738   1.720
  643   1HZ   LYS  87          1HZ       LYS  87 -11.412   4.863   2.802
  644   2HZ   LYS  87          2HZ       LYS  87 -10.462   3.527   3.005
  645   3HZ   LYS  87          3HZ       LYS  87 -10.676   4.166   1.497
  646    H    GLU  88           H        GLU  88  -4.637   5.245   5.086
  647    HA   GLU  88           HA       GLU  88  -5.398   5.835   7.992
  648   1HB   GLU  88          1HB       GLU  88  -4.815   3.212   8.146
  649   2HB   GLU  88          2HB       GLU  88  -5.184   3.245   6.433
  650   1HG   GLU  88          1HG       GLU  88  -7.467   4.341   7.059
  651   2HG   GLU  88          2HG       GLU  88  -7.244   2.649   7.469
  652    H    ASP  89           H        ASP  89  -3.044   3.444   6.984
  653    HA   ASP  89           HA       ASP  89  -0.510   4.747   7.222
  654   1HB   ASP  89          1HB       ASP  89  -0.756   5.701   9.317
  655   2HB   ASP  89          2HB       ASP  89  -1.838   4.462   9.909
  656    H    ALA  90           H        ALA  90  -2.236   2.043   8.800
  657    HA   ALA  90           HA       ALA  90  -1.340  -0.138   7.133
  658   1HB   ALA  90          1HB       ALA  90   0.552  -1.137   8.443
  659   2HB   ALA  90          2HB       ALA  90   1.004   0.454   7.801
  660   3HB   ALA  90          3HB       ALA  90   0.590   0.279   9.524
   
  Start of MODEL          40
 Raw file had  660 H/Q atoms
  Start of MODEL   40
    1   1H    ALA   1          1H        ALA   1 -19.955   8.839 -22.630
    2   2H    ALA   1          2H        ALA   1 -19.211   7.330 -22.627
    3   3H    ALA   1          3H        ALA   1 -20.889   7.441 -22.684
    4    HA   ALA   1           HA       ALA   1 -19.037   7.833 -20.458
    5   1HB   ALA   1          1HB       ALA   1 -20.022   9.969 -20.280
    6   2HB   ALA   1          2HB       ALA   1 -21.122   9.009 -19.273
    7   3HB   ALA   1          3HB       ALA   1 -21.595   9.453 -20.933
    8    H    SER   2           H        SER   2 -19.059   5.680 -20.062
    9    HA   SER   2           HA       SER   2 -21.629   4.364 -19.120
   10   1HB   SER   2          1HB       SER   2 -21.202   2.311 -20.541
   11   2HB   SER   2          2HB       SER   2 -21.727   3.741 -21.435
   12    HG   SER   2           HG       SER   2 -19.775   2.382 -22.079
   13    H    MET   3           H        MET   3 -19.935   5.087 -17.342
   14    HA   MET   3           HA       MET   3 -18.690   4.299 -15.440
   15   1HB   MET   3          1HB       MET   3 -18.416   1.492 -16.501
   16   2HB   MET   3          2HB       MET   3 -18.787   2.055 -14.881
   17   1HG   MET   3          1HG       MET   3 -21.105   2.849 -16.214
   18   2HG   MET   3          2HG       MET   3 -20.642   1.433 -17.167
   19   1HE   MET   3          1HE       MET   3 -23.564   0.967 -15.114
   20   2HE   MET   3          2HE       MET   3 -22.964  -0.699 -15.364
   21   3HE   MET   3          3HE       MET   3 -22.779   0.517 -16.661
   22    H    THR   4           H        THR   4 -16.896   5.493 -15.914
   23    HA   THR   4           HA       THR   4 -14.447   4.048 -16.809
   24    HB   THR   4           HB       THR   4 -14.675   6.475 -18.477
   25    HG1  THR   4           HG1      THR   4 -16.008   4.365 -19.566
   26   1HG2  THR   4          1HG2      THR   4 -14.042   4.678 -20.310
   27   2HG2  THR   4          2HG2      THR   4 -13.657   3.623 -18.932
   28   3HG2  THR   4          3HG2      THR   4 -12.799   5.172 -19.141
   29    H    ASP   5           H        ASP   5 -15.492   5.425 -14.457
   30    HA   ASP   5           HA       ASP   5 -13.782   7.875 -14.066
   31   1HB   ASP   5          1HB       ASP   5 -15.044   6.730 -11.620
   32   2HB   ASP   5          2HB       ASP   5 -15.021   8.371 -12.227
   33    H    GLN   6           H        GLN   6 -12.626   5.129 -14.595
   34    HA   GLN   6           HA       GLN   6 -11.037   4.489 -12.099
   35   1HB   GLN   6          1HB       GLN   6 -10.271   3.214 -14.713
   36   2HB   GLN   6          2HB       GLN   6 -11.922   2.921 -14.200
   37   1HG   GLN   6          1HG       GLN   6 -11.247   1.328 -12.750
   38   2HG   GLN   6          2HG       GLN   6 -10.283   2.483 -11.857
   39   1HE2  GLN   6          1HE2      GLN   6  -7.219   1.021 -12.953
   40   2HE2  GLN   6          2HE2      GLN   6  -8.079   2.270 -11.920
   41    H    GLN   7           H        GLN   7 -10.677   7.104 -12.822
   42    HA   GLN   7           HA       GLN   7  -7.760   7.388 -13.311
   43   1HB   GLN   7          1HB       GLN   7  -8.151   8.920 -15.432
   44   2HB   GLN   7          2HB       GLN   7  -7.968   7.180 -15.606
   45   1HG   GLN   7          1HG       GLN   7 -10.234   6.799 -16.148
   46   2HG   GLN   7          2HG       GLN   7 -10.807   8.269 -15.374
   47   1HE2  GLN   7          1HE2      GLN   7  -8.863   8.779 -19.048
   48   2HE2  GLN   7          2HE2      GLN   7  -8.197   7.618 -17.793
   49    H    ALA   8           H        ALA   8 -10.931   9.010 -13.637
   50    HA   ALA   8           HA       ALA   8 -10.358  11.719 -13.094
   51   1HB   ALA   8          1HB       ALA   8 -12.650  11.924 -12.142
   52   2HB   ALA   8          2HB       ALA   8 -12.641  10.908 -13.596
   53   3HB   ALA   8          3HB       ALA   8 -12.778  10.156 -11.987
   54    H    GLU   9           H        GLU   9 -10.973   9.186 -10.644
   55    HA   GLU   9           HA       GLU   9 -10.694  10.782  -8.243
   56   1HB   GLU   9          1HB       GLU   9  -9.683   8.026  -7.820
   57   2HB   GLU   9          2HB       GLU   9 -11.015   8.886  -7.062
   58   1HG   GLU   9          1HG       GLU   9 -12.256   8.417  -9.448
   59   2HG   GLU   9          2HG       GLU   9 -11.095   7.096  -9.522
   60    H    ALA  10           H        ALA  10  -8.278   8.998 -10.138
   61    HA   ALA  10           HA       ALA  10  -6.017   9.438  -8.257
   62   1HB   ALA  10          1HB       ALA  10  -4.629   8.377 -10.030
   63   2HB   ALA  10          2HB       ALA  10  -6.101   7.437  -9.720
   64   3HB   ALA  10          3HB       ALA  10  -5.984   8.449 -11.183
   65    NH1  ARG  11           NH1      ARG  11  -4.151  15.762 -16.399
   66    NH2  ARG  11           NH2      ARG  11  -2.698  14.036 -16.656
   67    H    ARG  11           H        ARG  11  -7.471  11.262 -10.824
   68    HA   ARG  11           HA       ARG  11  -5.059  12.826 -11.699
   69   1HB   ARG  11          1HB       ARG  11  -7.980  12.730 -12.454
   70   2HB   ARG  11          2HB       ARG  11  -7.210  14.304 -12.593
   71   1HG   ARG  11          1HG       ARG  11  -5.574  12.079 -13.764
   72   2HG   ARG  11          2HG       ARG  11  -7.132  12.327 -14.556
   73   1HD   ARG  11          1HD       ARG  11  -6.624  14.565 -15.216
   74   2HD   ARG  11          2HD       ARG  11  -5.379  14.779 -13.984
   75    HE   ARG  11           HE       ARG  11  -4.717  12.668 -16.023
   76   1HH1  ARG  11          1HH1      ARG  11  -5.079  16.076 -16.093
   77   2HH1  ARG  11          2HH1      ARG  11  -3.409  16.343 -16.805
   78   1HH2  ARG  11          1HH2      ARG  11  -2.519  13.031 -16.554
   79   2HH2  ARG  11          2HH2      ARG  11  -2.058  14.738 -17.044
   80    H    ALA  12           H        ALA  12  -7.851  13.239  -9.556
   81    HA   ALA  12           HA       ALA  12  -7.385  16.116  -8.926
   82   1HB   ALA  12          1HB       ALA  12  -9.181  15.815  -7.231
   83   2HB   ALA  12          2HB       ALA  12  -9.664  15.155  -8.806
   84   3HB   ALA  12          3HB       ALA  12  -9.176  14.054  -7.494
   85    H    PHE  13           H        PHE  13  -6.548  12.985  -7.514
   86    HA   PHE  13           HA       PHE  13  -5.476  14.020  -4.960
   87   1HB   PHE  13          1HB       PHE  13  -6.426  11.712  -5.295
   88   2HB   PHE  13          2HB       PHE  13  -5.052  11.270  -6.274
   89    HD1  PHE  13           HD1      PHE  13  -3.617  13.411  -3.880
   90    HD2  PHE  13           HD2      PHE  13  -5.401   9.502  -4.127
   91    HE1  PHE  13           HE1      PHE  13  -2.457  12.739  -1.816
   92    HE2  PHE  13           HE2      PHE  13  -4.236   8.851  -2.061
   93    HZ   PHE  13           HZ       PHE  13  -2.766  10.463  -0.902
   94    H    LEU  14           H        LEU  14  -4.151  13.103  -8.109
   95    HA   LEU  14           HA       LEU  14  -1.328  13.998  -7.280
   96   1HB   LEU  14          1HB       LEU  14  -1.733  12.158  -9.657
   97   2HB   LEU  14          2HB       LEU  14  -0.331  12.357  -8.629
   98    HG   LEU  14           HG       LEU  14  -2.765  11.180  -7.272
   99   1HD1  LEU  14          1HD1      LEU  14  -2.394   8.906  -8.233
  100   2HD1  LEU  14          2HD1      LEU  14  -2.885  10.048  -9.497
  101   3HD1  LEU  14          3HD1      LEU  14  -1.179   9.552  -9.365
  102   1HD2  LEU  14          1HD2      LEU  14   0.232  10.408  -7.235
  103   2HD2  LEU  14          2HD2      LEU  14  -0.616  11.380  -6.007
  104   3HD2  LEU  14          3HD2      LEU  14  -1.042   9.676  -6.226
  105    H    SER  15           H        SER  15  -1.029  15.947  -8.024
  106    HA   SER  15           HA       SER  15  -2.439  17.291 -10.203
  107   1HB   SER  15          1HB       SER  15  -0.951  18.219  -8.166
  108   2HB   SER  15          2HB       SER  15   0.320  18.243  -9.391
  109    HG   SER  15           HG       SER  15  -1.992  19.727  -9.171
  110    H    GLU  16           H        GLU  16  -0.740  18.446 -11.870
  111    HA   GLU  16           HA       GLU  16  -0.016  16.288 -13.808
  112   1HB   GLU  16          1HB       GLU  16  -0.083  19.328 -13.968
  113   2HB   GLU  16          2HB       GLU  16  -1.117  18.162 -14.769
  114   1HG   GLU  16          1HG       GLU  16   1.105  17.407 -16.045
  115   2HG   GLU  16          2HG       GLU  16   0.238  18.848 -16.550
  116    H    GLU  17           H        GLU  17   1.599  18.592 -11.707
  117    HA   GLU  17           HA       GLU  17   4.326  18.369 -12.842
  118   1HB   GLU  17          1HB       GLU  17   4.229  19.085  -9.952
  119   2HB   GLU  17          2HB       GLU  17   3.165  20.058 -10.949
  120   1HG   GLU  17          1HG       GLU  17   5.332  20.379 -12.502
  121   2HG   GLU  17          2HG       GLU  17   5.112  21.341 -11.051
  122    H    MET  18           H        MET  18   2.551  16.747 -10.238
  123    HA   MET  18           HA       MET  18   4.840  15.077  -9.265
  124   1HB   MET  18          1HB       MET  18   3.524  14.809  -7.468
  125   2HB   MET  18          2HB       MET  18   2.251  15.724  -8.255
  126   1HG   MET  18          1HG       MET  18   2.495  12.732  -8.865
  127   2HG   MET  18          2HG       MET  18   1.069  13.778  -8.967
  128   1HE   MET  18          1HE       MET  18  -0.057  14.983  -6.739
  129   2HE   MET  18          2HE       MET  18   0.467  14.603  -5.072
  130   3HE   MET  18          3HE       MET  18   1.553  15.517  -6.161
  131    H    ILE  19           H        ILE  19   2.112  14.783 -11.484
  132    HA   ILE  19           HA       ILE  19   2.100  11.914 -11.948
  133    HB   ILE  19           HB       ILE  19   0.791  14.215 -13.130
  134   1HG1  ILE  19          1HG1      ILE  19  -0.711  12.066 -13.985
  135   2HG1  ILE  19          2HG1      ILE  19   0.233  11.255 -12.754
  136   1HG2  ILE  19          1HG2      ILE  19   0.520  13.462 -15.506
  137   2HG2  ILE  19          2HG2      ILE  19   2.209  13.845 -15.180
  138   3HG2  ILE  19          3HG2      ILE  19   1.691  12.145 -15.247
  139   1HD1  ILE  19          1HD1      ILE  19  -1.581  13.682 -12.221
  140   2HD1  ILE  19          2HD1      ILE  19  -1.853  11.994 -11.743
  141   3HD1  ILE  19          3HD1      ILE  19  -0.523  12.916 -11.005
  142    H    ALA  20           H        ALA  20   4.020  14.568 -13.282
  143    HA   ALA  20           HA       ALA  20   5.330  13.259 -15.498
  144   1HB   ALA  20          1HB       ALA  20   7.062  15.042 -15.315
  145   2HB   ALA  20          2HB       ALA  20   5.425  15.708 -15.158
  146   3HB   ALA  20          3HB       ALA  20   6.449  15.513 -13.713
  147    H    GLU  21           H        GLU  21   6.209  13.428 -12.054
  148    HA   GLU  21           HA       GLU  21   8.887  12.325 -12.148
  149   1HB   GLU  21          1HB       GLU  21   8.387  13.339 -10.122
  150   2HB   GLU  21          2HB       GLU  21   6.805  12.600  -9.974
  151   1HG   GLU  21          1HG       GLU  21   9.536  11.291  -9.417
  152   2HG   GLU  21          2HG       GLU  21   8.073  10.332  -9.560
  153    H    PHE  22           H        PHE  22   5.697  10.827 -12.090
  154    HA   PHE  22           HA       PHE  22   6.641   8.013 -11.747
  155   1HB   PHE  22          1HB       PHE  22   3.876   9.087 -12.583
  156   2HB   PHE  22          2HB       PHE  22   4.244   7.405 -12.313
  157    HD1  PHE  22           HD1      PHE  22   3.919   6.450 -10.167
  158    HD2  PHE  22           HD2      PHE  22   4.471  10.709 -10.459
  159    HE1  PHE  22           HE1      PHE  22   3.489   6.682  -7.757
  160    HE2  PHE  22           HE2      PHE  22   4.038  10.919  -8.045
  161    HZ   PHE  22           HZ       PHE  22   3.579   8.908  -6.685
  162    H    LYS  23           H        LYS  23   5.757  10.181 -14.380
  163    HA   LYS  23           HA       LYS  23   5.494   8.420 -16.644
  164   1HB   LYS  23          1HB       LYS  23   5.746  11.249 -16.295
  165   2HB   LYS  23          2HB       LYS  23   7.060  10.822 -17.369
  166   1HG   LYS  23          1HG       LYS  23   4.619   9.481 -18.300
  167   2HG   LYS  23          2HG       LYS  23   5.689  10.595 -19.135
  168   1HD   LYS  23          1HD       LYS  23   3.526  11.562 -17.168
  169   2HD   LYS  23          2HD       LYS  23   3.222  11.350 -18.896
  170   1HE   LYS  23          1HE       LYS  23   3.776  13.672 -18.729
  171   2HE   LYS  23          2HE       LYS  23   5.048  13.401 -17.530
  172   1HZ   LYS  23          1HZ       LYS  23   6.505  12.635 -19.175
  173   2HZ   LYS  23          2HZ       LYS  23   5.725  13.875 -19.938
  174   3HZ   LYS  23          3HZ       LYS  23   5.316  12.310 -20.274
  175    H    ALA  24           H        ALA  24   8.422   9.832 -15.187
  176    HA   ALA  24           HA       ALA  24  10.415   8.983 -17.105
  177   1HB   ALA  24          1HB       ALA  24  12.076   9.299 -15.282
  178   2HB   ALA  24          2HB       ALA  24  10.908  10.633 -15.326
  179   3HB   ALA  24          3HB       ALA  24  10.776   9.377 -14.069
  180    H    ALA  25           H        ALA  25   9.410   7.415 -14.046
  181    HA   ALA  25           HA       ALA  25  11.092   4.986 -14.446
  182   1HB   ALA  25          1HB       ALA  25  10.067   4.200 -12.320
  183   2HB   ALA  25          2HB       ALA  25  10.647   5.870 -12.170
  184   3HB   ALA  25          3HB       ALA  25   8.903   5.547 -12.341
  185    H    PHE  26           H        PHE  26   8.023   5.971 -15.593
  186    HA   PHE  26           HA       PHE  26   6.526   3.413 -15.477
  187   1HB   PHE  26          1HB       PHE  26   5.149   5.340 -15.628
  188   2HB   PHE  26          2HB       PHE  26   6.058   6.056 -16.932
  189    HD1  PHE  26           HD1      PHE  26   5.071   5.926 -19.110
  190    HD2  PHE  26           HD2      PHE  26   4.079   2.872 -16.247
  191    HE1  PHE  26           HE1      PHE  26   3.372   5.022 -20.646
  192    HE2  PHE  26           HE2      PHE  26   2.384   1.983 -17.796
  193    HZ   PHE  26           HZ       PHE  26   2.051   3.034 -20.007
  194    H    ASP  27           H        ASP  27   8.655   5.027 -17.788
  195    HA   ASP  27           HA       ASP  27   8.229   3.197 -20.063
  196   1HB   ASP  27          1HB       ASP  27  10.714   4.946 -19.632
  197   2HB   ASP  27          2HB       ASP  27   9.187   5.578 -20.205
  198    H    MET  28           H        MET  28  10.396   3.280 -17.296
  199    HA   MET  28           HA       MET  28  12.299   1.158 -18.085
  200   1HB   MET  28          1HB       MET  28  11.586   2.462 -15.443
  201   2HB   MET  28          2HB       MET  28  13.123   2.380 -16.285
  202   1HG   MET  28          1HG       MET  28  11.830   0.215 -14.542
  203   2HG   MET  28          2HG       MET  28  13.096  -0.208 -15.707
  204   1HE   MET  28          1HE       MET  28  12.235   2.554 -12.899
  205   2HE   MET  28          2HE       MET  28  13.868   3.240 -12.645
  206   3HE   MET  28          3HE       MET  28  13.050   3.447 -14.222
  207    H    PHE  29           H        PHE  29   9.494   1.100 -15.861
  208    HA   PHE  29           HA       PHE  29   9.208  -1.722 -15.470
  209   1HB   PHE  29          1HB       PHE  29   7.805   0.336 -14.482
  210   2HB   PHE  29          2HB       PHE  29   6.695  -0.015 -15.779
  211    HD1  PHE  29           HD1      PHE  29   5.276  -0.320 -13.494
  212    HD2  PHE  29           HD2      PHE  29   8.232  -3.127 -14.877
  213    HE1  PHE  29           HE1      PHE  29   4.214  -2.107 -12.175
  214    HE2  PHE  29           HE2      PHE  29   7.159  -4.896 -13.545
  215    HZ   PHE  29           HZ       PHE  29   5.140  -4.398 -12.214
  216    H    ASP  30           H        ASP  30   8.162   0.329 -18.150
  217    HA   ASP  30           HA       ASP  30   6.668  -1.825 -19.595
  218   1HB   ASP  30          1HB       ASP  30   6.194   0.766 -19.682
  219   2HB   ASP  30          2HB       ASP  30   7.484   0.833 -20.860
  220    H    ALA  31           H        ALA  31   7.258  -2.520 -21.749
  221    HA   ALA  31           HA       ALA  31  10.289  -2.747 -22.205
  222   1HB   ALA  31          1HB       ALA  31   9.890  -5.062 -23.050
  223   2HB   ALA  31          2HB       ALA  31   9.364  -4.877 -21.365
  224   3HB   ALA  31          3HB       ALA  31   8.155  -4.931 -22.674
  225    H    ASP  32           H        ASP  32   7.062  -2.763 -23.705
  226    HA   ASP  32           HA       ASP  32   8.172  -2.206 -26.466
  227   1HB   ASP  32          1HB       ASP  32   6.163  -2.855 -27.384
  228   2HB   ASP  32          2HB       ASP  32   5.193  -2.194 -26.087
  229    H    GLY  33           H        GLY  33   8.930  -0.226 -24.904
  230   1HA   GLY  33          1HA       GLY  33   9.092   2.204 -25.435
  231   2HA   GLY  33          2HA       GLY  33   7.480   2.125 -26.110
  232    H    GLY  34           H        GLY  34   5.835   2.842 -24.887
  233   1HA   GLY  34          1HA       GLY  34   5.732   2.886 -21.913
  234   2HA   GLY  34          2HA       GLY  34   6.193   4.475 -22.538
  235    H    GLY  35           H        GLY  35   4.019   2.090 -24.020
  236   1HA   GLY  35          1HA       GLY  35   1.779   4.157 -24.194
  237   2HA   GLY  35          2HA       GLY  35   1.872   2.665 -25.139
  238    H    ASP  36           H        ASP  36   2.281   0.714 -23.360
  239    HA   ASP  36           HA       ASP  36   0.642   0.878 -20.882
  240   1HB   ASP  36          1HB       ASP  36  -1.392   0.312 -21.620
  241   2HB   ASP  36          2HB       ASP  36  -0.760  -1.254 -22.075
  242    H    ILE  37           H        ILE  37   0.994  -0.860 -19.554
  243    HA   ILE  37           HA       ILE  37   3.423  -2.547 -20.273
  244    HB   ILE  37           HB       ILE  37   2.319  -2.290 -17.457
  245   1HG1  ILE  37          1HG1      ILE  37   4.512  -0.439 -18.580
  246   2HG1  ILE  37          2HG1      ILE  37   2.847   0.054 -18.337
  247   1HG2  ILE  37          1HG2      ILE  37   4.557  -3.032 -16.740
  248   2HG2  ILE  37          2HG2      ILE  37   3.896  -4.176 -17.917
  249   3HG2  ILE  37          3HG2      ILE  37   5.150  -3.017 -18.419
  250   1HD1  ILE  37          1HD1      ILE  37   4.755  -0.803 -16.079
  251   2HD1  ILE  37          2HD1      ILE  37   4.163   0.834 -16.438
  252   3HD1  ILE  37          3HD1      ILE  37   3.030  -0.407 -15.855
  253    H    SER  38           H        SER  38   3.155  -4.529 -20.882
  254    HA   SER  38           HA       SER  38   0.611  -6.077 -20.480
  255   1HB   SER  38          1HB       SER  38   3.198  -6.562 -21.988
  256   2HB   SER  38          2HB       SER  38   2.187  -7.950 -21.575
  257    HG   SER  38           HG       SER  38   1.226  -5.586 -22.819
  258    H    THR  39           H        THR  39   0.974  -8.432 -19.746
  259    HA   THR  39           HA       THR  39   1.779  -8.426 -16.894
  260    HB   THR  39           HB       THR  39   1.414 -11.076 -17.282
  261    HG1  THR  39           HG1      THR  39   0.212 -11.518 -18.937
  262   1HG2  THR  39          1HG2      THR  39  -0.952 -10.833 -16.671
  263   2HG2  THR  39          2HG2      THR  39  -0.006  -9.623 -15.773
  264   3HG2  THR  39          3HG2      THR  39  -0.975  -9.132 -17.187
  265    H    LYS  40           H        LYS  40   3.209  -9.487 -19.926
  266    HA   LYS  40           HA       LYS  40   5.333 -11.189 -19.152
  267   1HB   LYS  40          1HB       LYS  40   5.475  -8.977 -21.267
  268   2HB   LYS  40          2HB       LYS  40   4.754 -10.542 -21.530
  269   1HG   LYS  40          1HG       LYS  40   7.270 -11.346 -20.781
  270   2HG   LYS  40          2HG       LYS  40   7.678  -9.706 -21.210
  271   1HD   LYS  40          1HD       LYS  40   8.125 -10.638 -23.285
  272   2HD   LYS  40          2HD       LYS  40   7.166 -12.040 -22.912
  273   1HE   LYS  40          1HE       LYS  40   5.114 -10.245 -23.317
  274   2HE   LYS  40          2HE       LYS  40   6.304  -9.608 -24.443
  275   1HZ   LYS  40          1HZ       LYS  40   4.739 -12.002 -24.606
  276   2HZ   LYS  40          2HZ       LYS  40   6.337 -12.337 -24.860
  277   3HZ   LYS  40          3HZ       LYS  40   5.567 -11.218 -25.801
  278    H    GLU  41           H        GLU  41   5.763  -7.663 -19.661
  279    HA   GLU  41           HA       GLU  41   8.364  -7.545 -18.253
  280   1HB   GLU  41          1HB       GLU  41   8.588  -5.402 -18.983
  281   2HB   GLU  41          2HB       GLU  41   6.923  -4.966 -18.665
  282   1HG   GLU  41          1HG       GLU  41   8.075  -5.407 -21.200
  283   2HG   GLU  41          2HG       GLU  41   7.197  -6.897 -20.928
  284    H    LEU  42           H        LEU  42   5.011  -6.942 -17.388
  285    HA   LEU  42           HA       LEU  42   5.212  -5.294 -15.050
  286   1HB   LEU  42          1HB       LEU  42   3.037  -5.906 -16.063
  287   2HB   LEU  42          2HB       LEU  42   3.235  -7.583 -15.604
  288    HG   LEU  42           HG       LEU  42   3.304  -6.677 -13.104
  289   1HD1  LEU  42          1HD1      LEU  42   1.985  -4.573 -12.747
  290   2HD1  LEU  42          2HD1      LEU  42   3.488  -4.250 -13.625
  291   3HD1  LEU  42          3HD1      LEU  42   1.940  -4.286 -14.505
  292   1HD2  LEU  42          1HD2      LEU  42   0.654  -6.653 -14.703
  293   2HD2  LEU  42          2HD2      LEU  42   1.436  -8.089 -13.998
  294   3HD2  LEU  42          3HD2      LEU  42   0.809  -6.817 -12.934
  295    H    GLY  43           H        GLY  43   5.834  -8.739 -15.462
  296   1HA   GLY  43          1HA       GLY  43   6.236 -10.488 -13.766
  297   2HA   GLY  43          2HA       GLY  43   6.149  -9.253 -12.507
  298    H    THR  44           H        THR  44   8.146  -8.726 -15.323
  299    HA   THR  44           HA       THR  44  10.620  -9.983 -14.390
  300    HB   THR  44           HB       THR  44  10.562  -7.672 -16.383
  301    HG1  THR  44           HG1      THR  44   9.462 -10.172 -16.518
  302   1HG2  THR  44          1HG2      THR  44  12.424  -8.923 -17.489
  303   2HG2  THR  44          2HG2      THR  44  12.857  -8.463 -15.829
  304   3HG2  THR  44          3HG2      THR  44  12.392 -10.145 -16.193
  305    H    VAL  45           H        VAL  45   9.795  -6.512 -14.651
  306    HA   VAL  45           HA       VAL  45  12.097  -5.366 -13.422
  307    HB   VAL  45           HB       VAL  45   9.394  -4.390 -14.046
  308   1HG1  VAL  45          1HG1      VAL  45   9.374  -2.396 -12.543
  309   2HG1  VAL  45          2HG1      VAL  45   9.237  -3.882 -11.596
  310   3HG1  VAL  45          3HG1      VAL  45  10.789  -3.018 -11.655
  311   1HG2  VAL  45          1HG2      VAL  45  12.118  -2.930 -13.960
  312   2HG2  VAL  45          2HG2      VAL  45  11.408  -3.723 -15.385
  313   3HG2  VAL  45          3HG2      VAL  45  10.617  -2.302 -14.688
  314    H    MET  46           H        MET  46   9.095  -6.521 -11.879
  315    HA   MET  46           HA       MET  46   9.675  -5.681  -9.142
  316   1HB   MET  46          1HB       MET  46   8.044  -7.900  -8.751
  317   2HB   MET  46          2HB       MET  46   7.673  -7.506 -10.420
  318   1HG   MET  46          1HG       MET  46   6.223  -5.911  -9.688
  319   2HG   MET  46          2HG       MET  46   7.592  -4.977  -9.062
  320   1HE   MET  46          1HE       MET  46   6.460  -3.876  -6.995
  321   2HE   MET  46          2HE       MET  46   6.684  -4.751  -5.451
  322   3HE   MET  46          3HE       MET  46   8.070  -4.530  -6.559
  323    NH1  ARG  47           NH1      ARG  47   7.745 -13.405  -7.344
  324    NH2  ARG  47           NH2      ARG  47   8.859 -13.660  -5.379
  325    H    ARG  47           H        ARG  47   9.993  -8.894 -10.692
  326    HA   ARG  47           HA       ARG  47  11.481 -10.035  -8.329
  327   1HB   ARG  47          1HB       ARG  47  11.506 -12.162  -9.791
  328   2HB   ARG  47          2HB       ARG  47  10.566 -11.270 -10.980
  329   1HG   ARG  47          1HG       ARG  47   8.607 -11.498  -9.832
  330   2HG   ARG  47          2HG       ARG  47   9.450 -12.781  -8.965
  331   1HD   ARG  47          1HD       ARG  47  10.004 -10.099  -7.756
  332   2HD   ARG  47          2HD       ARG  47   8.285 -10.456  -7.821
  333    HE   ARG  47           HE       ARG  47  10.038 -11.636  -5.895
  334   1HH1  ARG  47          1HH1      ARG  47   7.602 -12.844  -8.191
  335   2HH1  ARG  47          2HH1      ARG  47   7.261 -14.274  -7.093
  336   1HH2  ARG  47          1HH2      ARG  47   9.564 -13.298  -4.727
  337   2HH2  ARG  47          2HH2      ARG  47   8.295 -14.509  -5.265
  338    H    MET  48           H        MET  48  12.544  -7.971 -10.515
  339    HA   MET  48           HA       MET  48  14.800  -9.132 -11.968
  340   1HB   MET  48          1HB       MET  48  14.082  -6.340 -11.112
  341   2HB   MET  48          2HB       MET  48  15.799  -6.639 -11.309
  342   1HG   MET  48          1HG       MET  48  14.488  -7.790 -13.642
  343   2HG   MET  48          2HG       MET  48  13.816  -6.172 -13.381
  344   1HE   MET  48          1HE       MET  48  16.566  -5.067 -11.614
  345   2HE   MET  48          2HE       MET  48  17.340  -4.132 -12.927
  346   3HE   MET  48          3HE       MET  48  15.576  -4.010 -12.667
  347    H    LEU  49           H        LEU  49  14.320  -8.135  -8.623
  348    HA   LEU  49           HA       LEU  49  17.142  -8.998  -7.832
  349   1HB   LEU  49          1HB       LEU  49  16.994  -7.097  -6.615
  350   2HB   LEU  49          2HB       LEU  49  16.069  -8.065  -5.489
  351    HG   LEU  49           HG       LEU  49  13.968  -7.233  -6.995
  352   1HD1  LEU  49          1HD1      LEU  49  15.947  -4.896  -7.353
  353   2HD1  LEU  49          2HD1      LEU  49  15.472  -6.009  -8.649
  354   3HD1  LEU  49          3HD1      LEU  49  14.250  -4.956  -7.894
  355   1HD2  LEU  49          1HD2      LEU  49  13.537  -5.458  -5.347
  356   2HD2  LEU  49          2HD2      LEU  49  14.369  -6.780  -4.491
  357   3HD2  LEU  49          3HD2      LEU  49  15.268  -5.325  -4.946
  358    H    GLY  50           H        GLY  50  16.470 -11.212  -8.336
  359   1HA   GLY  50          1HA       GLY  50  14.622 -12.654  -6.407
  360   2HA   GLY  50          2HA       GLY  50  16.343 -12.902  -6.109
  361    H    GLN  51           H        GLN  51  13.830 -13.233  -8.572
  362    HA   GLN  51           HA       GLN  51  15.413 -15.316 -10.150
  363   1HB   GLN  51          1HB       GLN  51  13.937 -17.126  -9.762
  364   2HB   GLN  51          2HB       GLN  51  14.315 -16.476  -8.179
  365   1HG   GLN  51          1HG       GLN  51  12.007 -15.081  -8.594
  366   2HG   GLN  51          2HG       GLN  51  11.676 -16.407  -9.687
  367   1HE2  GLN  51          1HE2      GLN  51  10.269 -17.502  -6.417
  368   2HE2  GLN  51          2HE2      GLN  51   9.906 -16.440  -7.868
  369    H    ASN  52           H        ASN  52  13.252 -16.323 -11.549
  370    HA   ASN  52           HA       ASN  52  11.832 -13.920 -12.757
  371   1HB   ASN  52          1HB       ASN  52  13.028 -16.146 -14.495
  372   2HB   ASN  52          2HB       ASN  52  13.877 -14.602 -14.137
  373   1HD2  ASN  52          1HD2      ASN  52  10.531 -13.466 -16.069
  374   2HD2  ASN  52          2HD2      ASN  52  10.695 -13.844 -14.275
  375    HA   PRO  53           HA       PRO  53   8.552 -17.232 -11.534
  376   1HB   PRO  53          1HB       PRO  53   6.843 -14.773 -12.085
  377   2HB   PRO  53          2HB       PRO  53   6.796 -15.959 -10.772
  378   1HG   PRO  53          1HG       PRO  53   7.883 -13.470 -10.409
  379   2HG   PRO  53          2HG       PRO  53   8.450 -14.876  -9.478
  380   1HD   PRO  53          1HD       PRO  53  10.548 -14.378 -10.523
  381   2HD   PRO  53          2HD       PRO  53   9.775 -13.440 -11.834
  382    H    THR  54           H        THR  54   6.642 -17.917 -12.822
  383    HA   THR  54           HA       THR  54   7.306 -18.039 -15.763
  384    HB   THR  54           HB       THR  54   6.401 -19.998 -14.113
  385    HG1  THR  54           HG1      THR  54   7.140 -19.874 -16.408
  386   1HG2  THR  54          1HG2      THR  54   4.083 -20.642 -14.687
  387   2HG2  THR  54          2HG2      THR  54   4.080 -19.076 -13.845
  388   3HG2  THR  54          3HG2      THR  54   3.847 -19.139 -15.611
  389    H    LYS  55           H        LYS  55   5.593 -17.710 -17.351
  390    HA   LYS  55           HA       LYS  55   4.471 -14.984 -17.070
  391   1HB   LYS  55          1HB       LYS  55   4.906 -16.930 -19.277
  392   2HB   LYS  55          2HB       LYS  55   5.032 -15.183 -19.279
  393   1HG   LYS  55          1HG       LYS  55   2.227 -15.709 -19.145
  394   2HG   LYS  55          2HG       LYS  55   3.135 -15.025 -20.482
  395   1HD   LYS  55          1HD       LYS  55   3.644 -17.507 -21.218
  396   2HD   LYS  55          2HD       LYS  55   2.019 -16.883 -21.454
  397   1HE   LYS  55          1HE       LYS  55   2.981 -18.970 -19.481
  398   2HE   LYS  55          2HE       LYS  55   1.615 -17.978 -18.978
  399   1HZ   LYS  55          1HZ       LYS  55   1.491 -19.164 -21.669
  400   2HZ   LYS  55          2HZ       LYS  55   0.279 -18.922 -20.573
  401   3HZ   LYS  55          3HZ       LYS  55   1.323 -20.188 -20.383
  402    H    GLU  56           H        GLU  56   3.225 -18.280 -17.037
  403    HA   GLU  56           HA       GLU  56   0.387 -17.810 -17.336
  404   1HB   GLU  56          1HB       GLU  56   2.005 -20.065 -16.122
  405   2HB   GLU  56          2HB       GLU  56   0.278 -20.037 -15.825
  406   1HG   GLU  56          1HG       GLU  56   1.751 -20.355 -18.493
  407   2HG   GLU  56          2HG       GLU  56   0.096 -19.769 -18.497
  408    H    GLU  57           H        GLU  57   2.410 -18.018 -14.402
  409    HA   GLU  57           HA       GLU  57   0.215 -17.585 -12.461
  410   1HB   GLU  57          1HB       GLU  57   3.236 -17.659 -12.204
  411   2HB   GLU  57          2HB       GLU  57   2.039 -18.793 -11.615
  412   1HG   GLU  57          1HG       GLU  57   1.268 -16.707 -10.054
  413   2HG   GLU  57          2HG       GLU  57   2.567 -17.795  -9.583
  414    H    LEU  58           H        LEU  58   2.564 -15.541 -14.122
  415    HA   LEU  58           HA       LEU  58   2.219 -13.038 -12.721
  416   1HB   LEU  58          1HB       LEU  58   3.576 -13.967 -15.073
  417   2HB   LEU  58          2HB       LEU  58   2.600 -12.610 -15.598
  418    HG   LEU  58           HG       LEU  58   5.060 -12.187 -14.785
  419   1HD1  LEU  58          1HD1      LEU  58   4.500  -9.938 -13.783
  420   2HD1  LEU  58          2HD1      LEU  58   3.524 -10.260 -15.223
  421   3HD1  LEU  58          3HD1      LEU  58   2.797 -10.431 -13.607
  422   1HD2  LEU  58          1HD2      LEU  58   3.715 -12.400 -12.013
  423   2HD2  LEU  58          2HD2      LEU  58   4.940 -13.513 -12.672
  424   3HD2  LEU  58          3HD2      LEU  58   5.372 -11.827 -12.335
  425    H    ASP  59           H        ASP  59   0.339 -14.622 -15.249
  426    HA   ASP  59           HA       ASP  59  -1.433 -12.404 -15.984
  427   1HB   ASP  59          1HB       ASP  59  -1.938 -15.420 -16.294
  428   2HB   ASP  59          2HB       ASP  59  -1.111 -14.396 -17.445
  429    H    ALA  60           H        ALA  60  -1.498 -14.858 -13.465
  430    HA   ALA  60           HA       ALA  60  -4.238 -14.485 -12.488
  431   1HB   ALA  60          1HB       ALA  60  -3.460 -15.672 -10.442
  432   2HB   ALA  60          2HB       ALA  60  -2.909 -16.492 -11.916
  433   3HB   ALA  60          3HB       ALA  60  -1.764 -15.519 -10.959
  434    H    ILE  61           H        ILE  61  -1.147 -12.924 -11.775
  435    HA   ILE  61           HA       ILE  61  -1.880 -11.473  -9.344
  436    HB   ILE  61           HB       ILE  61   0.413 -11.419 -11.229
  437   1HG1  ILE  61          1HG1      ILE  61   1.378 -12.275  -9.358
  438   2HG1  ILE  61          2HG1      ILE  61  -0.086 -12.004  -8.438
  439   1HG2  ILE  61          1HG2      ILE  61   1.320  -9.189 -10.515
  440   2HG2  ILE  61          2HG2      ILE  61  -0.179  -8.987 -11.419
  441   3HG2  ILE  61          3HG2      ILE  61  -0.193  -8.831  -9.647
  442   1HD1  ILE  61          1HD1      ILE  61   0.634  -9.737  -7.734
  443   2HD1  ILE  61          2HD1      ILE  61   1.881 -10.941  -7.347
  444   3HD1  ILE  61          3HD1      ILE  61   2.099  -9.864  -8.746
  445    H    ILE  62           H        ILE  62  -1.960 -10.624 -12.802
  446    HA   ILE  62           HA       ILE  62  -2.954  -7.855 -12.444
  447    HB   ILE  62           HB       ILE  62  -2.724  -9.660 -14.889
  448   1HG1  ILE  62          1HG1      ILE  62  -0.562  -8.820 -14.439
  449   2HG1  ILE  62          2HG1      ILE  62  -1.147  -7.320 -13.751
  450   1HG2  ILE  62          1HG2      ILE  62  -3.474  -7.760 -16.349
  451   2HG2  ILE  62          2HG2      ILE  62  -4.780  -8.259 -15.276
  452   3HG2  ILE  62          3HG2      ILE  62  -3.860  -6.782 -14.912
  453   1HD1  ILE  62          1HD1      ILE  62  -1.670  -6.362 -15.978
  454   2HD1  ILE  62          2HD1      ILE  62   0.010  -6.936 -15.921
  455   3HD1  ILE  62          3HD1      ILE  62  -1.222  -7.898 -16.770
  456    H    GLU  63           H        GLU  63  -4.369 -11.047 -12.993
  457    HA   GLU  63           HA       GLU  63  -7.123 -10.455 -13.493
  458   1HB   GLU  63          1HB       GLU  63  -7.240 -12.669 -11.734
  459   2HB   GLU  63          2HB       GLU  63  -5.650 -12.802 -12.457
  460   1HG   GLU  63          1HG       GLU  63  -7.978 -12.279 -14.351
  461   2HG   GLU  63          2HG       GLU  63  -6.503 -13.189 -14.629
  462    H    GLU  64           H        GLU  64  -5.368 -10.619 -10.403
  463    HA   GLU  64           HA       GLU  64  -7.484 -10.349  -8.498
  464   1HB   GLU  64          1HB       GLU  64  -4.974  -8.804  -7.886
  465   2HB   GLU  64          2HB       GLU  64  -4.756 -10.494  -8.296
  466   1HG   GLU  64          1HG       GLU  64  -6.770 -10.783  -6.438
  467   2HG   GLU  64          2HG       GLU  64  -5.061 -10.817  -6.041
  468    H    VAL  65           H        VAL  65  -5.648  -7.789 -10.176
  469    HA   VAL  65           HA       VAL  65  -7.805  -5.735  -9.484
  470    HB   VAL  65           HB       VAL  65  -5.244  -5.315  -9.030
  471   1HG1  VAL  65          1HG1      VAL  65  -4.027  -4.132 -10.867
  472   2HG1  VAL  65          2HG1      VAL  65  -4.380  -5.809 -11.323
  473   3HG1  VAL  65          3HG1      VAL  65  -5.349  -4.482 -12.008
  474   1HG2  VAL  65          1HG2      VAL  65  -6.990  -3.113 -10.331
  475   2HG2  VAL  65          2HG2      VAL  65  -6.986  -3.573  -8.611
  476   3HG2  VAL  65          3HG2      VAL  65  -5.544  -2.839  -9.328
  477    H    ASP  66           H        ASP  66  -7.033  -4.085 -11.777
  478    HA   ASP  66           HA       ASP  66  -7.593  -3.719 -14.081
  479   1HB   ASP  66          1HB       ASP  66  -6.220  -6.188 -14.117
  480   2HB   ASP  66          2HB       ASP  66  -7.706  -6.548 -14.966
  481    H    GLU  67           H        GLU  67  -9.547  -3.520 -12.400
  482    HA   GLU  67           HA       GLU  67 -11.910  -5.285 -13.024
  483   1HB   GLU  67          1HB       GLU  67 -11.521  -4.567 -10.703
  484   2HB   GLU  67          2HB       GLU  67 -13.098  -4.075 -11.292
  485   1HG   GLU  67          1HG       GLU  67 -12.622  -2.001 -10.460
  486   2HG   GLU  67          2HG       GLU  67 -11.546  -1.783 -11.829
  487    H    ASP  68           H        ASP  68 -10.819  -3.892 -15.253
  488    HA   ASP  68           HA       ASP  68 -13.067  -1.953 -15.987
  489   1HB   ASP  68          1HB       ASP  68 -10.666  -0.893 -15.550
  490   2HB   ASP  68          2HB       ASP  68 -11.710  -0.323 -16.832
  491    H    GLY  69           H        GLY  69 -10.496  -4.135 -17.160
  492   1HA   GLY  69          1HA       GLY  69 -12.401  -5.202 -19.322
  493   2HA   GLY  69          2HA       GLY  69 -11.077  -6.133 -18.610
  494    H    SER  70           H        SER  70  -9.099  -6.049 -19.447
  495    HA   SER  70           HA       SER  70  -8.594  -4.913 -22.140
  496   1HB   SER  70          1HB       SER  70  -8.243  -2.772 -21.401
  497   2HB   SER  70          2HB       SER  70  -6.609  -3.395 -21.161
  498    HG   SER  70           HG       SER  70  -7.650  -2.250 -19.381
  499    H    GLY  71           H        GLY  71  -6.790  -5.577 -19.105
  500   1HA   GLY  71          1HA       GLY  71  -5.252  -7.843 -20.501
  501   2HA   GLY  71          2HA       GLY  71  -5.590  -7.794 -18.765
  502    H    THR  72           H        THR  72  -4.582  -4.994 -20.637
  503    HA   THR  72           HA       THR  72  -1.733  -5.086 -19.619
  504    HB   THR  72           HB       THR  72  -1.663  -2.764 -20.917
  505    HG1  THR  72           HG1      THR  72  -4.077  -3.223 -21.249
  506   1HG2  THR  72          1HG2      THR  72  -1.028  -3.861 -23.026
  507   2HG2  THR  72          2HG2      THR  72  -0.349  -4.788 -21.671
  508   3HG2  THR  72          3HG2      THR  72  -1.785  -5.394 -22.537
  509    H    ILE  73           H        ILE  73  -1.095  -2.545 -19.117
  510    HA   ILE  73           HA       ILE  73  -3.008  -1.369 -17.072
  511    HB   ILE  73           HB       ILE  73  -0.181  -2.260 -16.301
  512   1HG1  ILE  73          1HG1      ILE  73  -2.944  -3.397 -15.698
  513   2HG1  ILE  73          2HG1      ILE  73  -1.452  -4.235 -16.065
  514   1HG2  ILE  73          1HG2      ILE  73  -0.601  -1.279 -14.050
  515   2HG2  ILE  73          2HG2      ILE  73  -0.763  -0.020 -15.282
  516   3HG2  ILE  73          3HG2      ILE  73  -2.219  -0.726 -14.539
  517   1HD1  ILE  73          1HD1      ILE  73  -2.071  -2.928 -13.352
  518   2HD1  ILE  73          2HD1      ILE  73  -2.018  -4.662 -13.735
  519   3HD1  ILE  73          3HD1      ILE  73  -0.521  -3.702 -13.782
  520    H    ASP  74           H        ASP  74  -3.150   0.173 -18.761
  521    HA   ASP  74           HA       ASP  74  -0.962   1.704 -19.907
  522   1HB   ASP  74          1HB       ASP  74  -2.773   2.252 -21.152
  523   2HB   ASP  74          2HB       ASP  74  -2.909   3.585 -20.028
  524    H    PHE  75           H        PHE  75  -0.802   4.165 -19.481
  525    HA   PHE  75           HA       PHE  75   0.343   4.606 -16.810
  526   1HB   PHE  75          1HB       PHE  75   1.120   5.782 -18.914
  527   2HB   PHE  75          2HB       PHE  75  -0.363   6.698 -18.957
  528    HD1  PHE  75           HD1      PHE  75   1.272   5.952 -15.673
  529    HD2  PHE  75           HD2      PHE  75   0.816   8.868 -18.805
  530    HE1  PHE  75           HE1      PHE  75   2.252   7.680 -14.221
  531    HE2  PHE  75           HE2      PHE  75   1.805  10.581 -17.338
  532    HZ   PHE  75           HZ       PHE  75   2.521   9.994 -15.049
  533    H    GLU  76           H        GLU  76  -2.762   5.273 -18.317
  534    HA   GLU  76           HA       GLU  76  -3.871   7.243 -16.510
  535   1HB   GLU  76          1HB       GLU  76  -5.960   5.429 -17.476
  536   2HB   GLU  76          2HB       GLU  76  -5.731   7.146 -17.723
  537   1HG   GLU  76          1HG       GLU  76  -4.061   5.156 -19.349
  538   2HG   GLU  76          2HG       GLU  76  -5.731   5.462 -19.775
  539    H    GLU  77           H        GLU  77  -4.461   3.715 -16.548
  540    HA   GLU  77           HA       GLU  77  -5.819   3.656 -13.910
  541   1HB   GLU  77          1HB       GLU  77  -6.330   1.482 -14.309
  542   2HB   GLU  77          2HB       GLU  77  -6.054   2.007 -15.954
  543   1HG   GLU  77          1HG       GLU  77  -3.852   0.615 -14.308
  544   2HG   GLU  77          2HG       GLU  77  -3.848   0.909 -16.043
  545    H    PHE  78           H        PHE  78  -2.523   3.289 -15.007
  546    HA   PHE  78           HA       PHE  78  -1.288   1.784 -12.865
  547   1HB   PHE  78          1HB       PHE  78  -0.140   2.495 -15.016
  548   2HB   PHE  78          2HB       PHE  78  -0.039   4.136 -14.430
  549    HD1  PHE  78           HD1      PHE  78   0.406   1.435 -11.916
  550    HD2  PHE  78           HD2      PHE  78   2.478   3.920 -14.753
  551    HE1  PHE  78           HE1      PHE  78   2.565   0.784 -10.927
  552    HE2  PHE  78           HE2      PHE  78   4.626   3.262 -13.747
  553    HZ   PHE  78           HZ       PHE  78   4.676   1.684 -11.846
  554    H    LEU  79           H        LEU  79  -1.886   5.284 -13.196
  555    HA   LEU  79           HA       LEU  79  -0.715   6.119 -10.639
  556   1HB   LEU  79          1HB       LEU  79  -2.943   7.629 -12.115
  557   2HB   LEU  79          2HB       LEU  79  -1.777   8.289 -10.989
  558    HG   LEU  79           HG       LEU  79  -0.752   7.015 -13.571
  559   1HD1  LEU  79          1HD1      LEU  79  -1.007   9.185 -14.778
  560   2HD1  LEU  79          2HD1      LEU  79  -2.592   8.537 -14.316
  561   3HD1  LEU  79          3HD1      LEU  79  -1.882   9.885 -13.392
  562   1HD2  LEU  79          1HD2      LEU  79   0.278   9.383 -11.867
  563   2HD2  LEU  79          2HD2      LEU  79   0.967   7.741 -11.907
  564   3HD2  LEU  79          3HD2      LEU  79   1.045   8.762 -13.351
  565    H    VAL  80           H        VAL  80  -3.896   4.965 -11.595
  566    HA   VAL  80           HA       VAL  80  -5.390   5.671  -9.172
  567    HB   VAL  80           HB       VAL  80  -5.910   3.709 -11.424
  568   1HG1  VAL  80          1HG1      VAL  80  -7.655   6.033 -10.400
  569   2HG1  VAL  80          2HG1      VAL  80  -6.414   6.235 -11.644
  570   3HG1  VAL  80          3HG1      VAL  80  -7.796   5.156 -11.946
  571   1HG2  VAL  80          1HG2      VAL  80  -8.047   2.969 -10.478
  572   2HG2  VAL  80          2HG2      VAL  80  -6.786   2.570  -9.288
  573   3HG2  VAL  80          3HG2      VAL  80  -7.830   3.974  -9.024
  574    H    MET  81           H        MET  81  -3.341   2.960 -10.113
  575    HA   MET  81           HA       MET  81  -3.934   1.105  -7.884
  576   1HB   MET  81          1HB       MET  81  -1.176   1.020  -9.093
  577   2HB   MET  81          2HB       MET  81  -2.505   0.846 -10.225
  578   1HG   MET  81          1HG       MET  81  -3.392  -0.998  -8.448
  579   2HG   MET  81          2HG       MET  81  -1.688  -1.023  -7.966
  580   1HE   MET  81          1HE       MET  81  -0.426  -2.950  -8.759
  581   2HE   MET  81          2HE       MET  81  -0.013  -3.194 -10.482
  582   3HE   MET  81          3HE       MET  81   0.392  -1.649  -9.681
  583    H    MET  82           H        MET  82  -1.398   3.535  -8.495
  584    HA   MET  82           HA       MET  82   0.080   3.117  -5.977
  585   1HB   MET  82          1HB       MET  82   0.182   5.215  -8.175
  586   2HB   MET  82          2HB       MET  82   0.971   5.570  -6.650
  587   1HG   MET  82          1HG       MET  82   1.571   2.897  -8.017
  588   2HG   MET  82          2HG       MET  82   2.294   4.382  -8.648
  589   1HE   MET  82          1HE       MET  82   4.807   3.690  -8.178
  590   2HE   MET  82          2HE       MET  82   4.209   2.089  -7.652
  591   3HE   MET  82          3HE       MET  82   5.366   2.987  -6.627
  592    H    VAL  83           H        VAL  83  -2.664   5.080  -6.923
  593    HA   VAL  83           HA       VAL  83  -2.557   7.077  -4.756
  594    HB   VAL  83           HB       VAL  83  -4.301   6.556  -7.046
  595   1HG1  VAL  83          1HG1      VAL  83  -6.429   7.515  -6.149
  596   2HG1  VAL  83          2HG1      VAL  83  -6.066   5.968  -5.371
  597   3HG1  VAL  83          3HG1      VAL  83  -5.770   7.486  -4.493
  598   1HG2  VAL  83          1HG2      VAL  83  -3.863   9.123  -5.381
  599   2HG2  VAL  83          2HG2      VAL  83  -2.934   8.649  -6.822
  600   3HG2  VAL  83          3HG2      VAL  83  -4.655   9.032  -6.975
  601    NH1  ARG  84           NH1      ARG  84 -10.150   1.034  -4.882
  602    NH2  ARG  84           NH2      ARG  84  -9.465  -0.688  -3.568
  603    H    ARG  84           H        ARG  84  -4.524   4.142  -5.320
  604    HA   ARG  84           HA       ARG  84  -6.231   4.141  -2.992
  605   1HB   ARG  84          1HB       ARG  84  -5.069   1.838  -4.649
  606   2HB   ARG  84          2HB       ARG  84  -6.042   1.523  -3.219
  607   1HG   ARG  84          1HG       ARG  84  -8.023   2.486  -4.134
  608   2HG   ARG  84          2HG       ARG  84  -7.150   3.402  -5.365
  609   1HD   ARG  84          1HD       ARG  84  -7.991   1.654  -6.681
  610   2HD   ARG  84          2HD       ARG  84  -6.403   0.992  -6.288
  611    HE   ARG  84           HE       ARG  84  -7.605  -0.812  -5.249
  612   1HH1  ARG  84          1HH1      ARG  84  -9.936   1.669  -5.659
  613   2HH1  ARG  84          2HH1      ARG  84 -11.020   0.995  -4.341
  614   1HH2  ARG  84          1HH2      ARG  84  -8.727  -1.364  -3.340
  615   2HH2  ARG  84          2HH2      ARG  84 -10.381  -0.602  -3.116
  616    H    GLN  85           H        GLN  85  -2.936   2.842  -3.415
  617    HA   GLN  85           HA       GLN  85  -2.716   1.738  -0.647
  618   1HB   GLN  85          1HB       GLN  85  -0.483   2.183  -2.712
  619   2HB   GLN  85          2HB       GLN  85  -0.364   1.242  -1.236
  620   1HG   GLN  85          1HG       GLN  85  -2.633   0.192  -2.718
  621   2HG   GLN  85          2HG       GLN  85  -1.332   0.414  -3.867
  622   1HE2  GLN  85          1HE2      GLN  85   0.771  -1.859  -1.528
  623   2HE2  GLN  85          2HE2      GLN  85   0.860  -0.084  -1.985
  624    H    MET  86           H        MET  86  -1.828   4.686  -2.350
  625    HA   MET  86           HA       MET  86   0.152   5.898  -0.700
  626   1HB   MET  86          1HB       MET  86  -1.725   8.001  -1.433
  627   2HB   MET  86          2HB       MET  86  -1.667   6.841  -2.748
  628   1HG   MET  86          1HG       MET  86   0.428   7.504  -3.416
  629   2HG   MET  86          2HG       MET  86   1.070   7.497  -1.766
  630   1HE   MET  86          1HE       MET  86  -2.020   9.462  -3.496
  631   2HE   MET  86          2HE       MET  86  -1.244  11.053  -3.747
  632   3HE   MET  86          3HE       MET  86  -0.647   9.621  -4.636
  633    H    LYS  87           H        LYS  87  -3.316   5.587  -0.173
  634    HA   LYS  87           HA       LYS  87  -3.893   7.435   1.926
  635   1HB   LYS  87          1HB       LYS  87  -5.371   5.340   2.869
  636   2HB   LYS  87          2HB       LYS  87  -4.992   4.686   1.283
  637   1HG   LYS  87          1HG       LYS  87  -6.088   6.480   0.108
  638   2HG   LYS  87          2HG       LYS  87  -6.179   7.504   1.531
  639   1HD   LYS  87          1HD       LYS  87  -7.846   5.034   0.822
  640   2HD   LYS  87          2HD       LYS  87  -7.664   5.498   2.510
  641   1HE   LYS  87          1HE       LYS  87  -8.397   7.964   1.464
  642   2HE   LYS  87          2HE       LYS  87  -9.222   6.900   0.317
  643   1HZ   LYS  87          1HZ       LYS  87  -9.481   6.476   3.241
  644   2HZ   LYS  87          2HZ       LYS  87 -10.469   5.930   2.035
  645   3HZ   LYS  87          3HZ       LYS  87 -10.455   7.534   2.429
  646    H    GLU  88           H        GLU  88  -3.630   7.492   4.100
  647    HA   GLU  88           HA       GLU  88  -1.597   5.559   5.332
  648   1HB   GLU  88          1HB       GLU  88  -1.286   7.568   7.017
  649   2HB   GLU  88          2HB       GLU  88  -0.445   7.527   5.479
  650   1HG   GLU  88          1HG       GLU  88  -1.839   9.247   4.522
  651   2HG   GLU  88          2HG       GLU  88  -3.127   8.999   5.689
  652    H    ASP  89           H        ASP  89  -3.550   4.210   5.599
  653    HA   ASP  89           HA       ASP  89  -4.918   4.724   8.262
  654   1HB   ASP  89          1HB       ASP  89  -6.422   4.448   5.633
  655   2HB   ASP  89          2HB       ASP  89  -7.114   3.741   7.074
  656    H    ALA  90           H        ALA  90  -4.416   3.052   9.424
  657    HA   ALA  90           HA       ALA  90  -5.045   0.251   8.570
  658   1HB   ALA  90          1HB       ALA  90  -2.772  -0.712   9.016
  659   2HB   ALA  90          2HB       ALA  90  -2.718   0.417   7.648
  660   3HB   ALA  90          3HB       ALA  90  -2.092   0.919   9.238
   
   
  No H/Q in entry =         660