*HEADER    TRANSPORT PROTEIN                       25-SEP-01   1K1C              
*TITLE     SOLUTION STRUCTURE OF CRH, THE BACILLUS SUBTILIS CATABOLITE           
*TITLE    2 REPRESSION HPR                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CATABOLITE REPRESSION HPR-LIKE PROTEIN;                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    OPEN-FACED B-SANDWICH, PHOSPHOTRANSFERASE SYSTEM, CARBON              
*KEYWDS   2 CATABOLITE REPRESSION                                                
*EXPDTA    NMR, 24 STRUCTURES                                                    
*AUTHOR    A.FAVIER, B.BRUTSCHER, M.BLACKLEDGE, A.GALINIER,                      
*AUTHOR   2 J.DEUTSCHER, F.PENIN, D.MARION                                       
*REVDAT   1   17-OCT-01 1K1C    0                                                
#chiral 
1:METN_1:CA    S
1:VAL_2:CA    S
1:GLN_3:CA    S
1:GLN_4:CA    S
1:LYX_5:CA    S
1:VAL_6:CA    S
1:GLX_7:CA    S
1:VAL_8:CA    S
1:ARX_9:CA    S
1:LEU_10:CA    S
1:LYX_11:CA    S
1:THR_12:CA    S
1:GLY_13:CA    S
1:LEU_14:CA    S
1:GLN_15:CA    S
1:ALA_16:CA    S
1:ARX_17:CA    S
1:PRO_18:CA    S
1:ALA_19:CA    S
1:ALA_20:CA    S
1:LEU_21:CA    S
1:PHE_22:CA    S
1:VAL_23:CA    S
1:GLN_24:CA    S
1:GLX_25:CA    S
1:ALA_26:CA    S
1:ASN_27:CA    S
1:ARX_28:CA    S
1:PHE_29:CA    S
1:THR_30:CA    S
1:SER_31:CA    S
1:ASX_32:CA    S
1:VAL_33:CA    S
1:PHE_34:CA    S
1:LEU_35:CA    S
1:GLX_36:CA    S
1:LYX_37:CA    S
1:ASX_38:CA    S
1:GLY_39:CA    S
1:LYX_40:CA    S
1:LYX_41:CA    S
1:VAL_42:CA    S
1:ASN_43:CA    S
1:ALA_44:CA    S
1:LYX_45:CA    S
1:SER_46:CA    S
1:ILE_47:CA    S
1:MET_48:CA    S
1:GLY_49:CA    S
1:LEU_50:CA    S
1:MET_51:CA    S
1:SER_52:CA    S
1:LEU_53:CA    S
1:ALA_54:CA    S
1:VAX_55:CA    S
1:SER_56:CA    S
1:THR_57:CA    S
1:GLY_58:CA    S
1:THR_59:CA    S
1:GLX_60:CA    S
1:VAL_61:CA    S
1:THR_62:CA    S
1:LEU_63:CA    S
1:ILE_64:CA    S
1:ALA_65:CA    S
1:GLN_66:CA    S
1:GLY_67:CA    S
1:GLX_68:CA    S
1:ASX_69:CA    S
1:GLX_70:CA    S
1:GLN_71:CA    S
1:GLX_72:CA    S
1:ALA_73:CA    S
1:LEU_74:CA    S
1:GLX_75:CA    S
1:LYX_76:CA    S
1:LEU_77:CA    S
1:ALA_78:CA    S
1:ALA_79:CA    S
1:TYR_80:CA    S
1:VAX_81:CA    S
1:GLN_82:CA    S
1:GLX_83:CA    S
1:GLX_84:CA    S
1:VAX_85:CA    S
1:LEU_86:CA    S
1:GLNC_87:CA    S
1:THR_12:CB    R
1:THR_30:CB    R
1:THR_57:CB    R
1:THR_62:CB    R
#NOE_distance
1:GLN_4:HN          1:ALA_65:HB*           -1.000    5.740    3.646  50.000   50.000 1000.000 
1:LYX_5:HN          1:LEU_74:HB2           -1.000    5.334    4.103  50.000   50.000 1000.000 
1:GLN_4:HN          1:LEU_74:HB2           -1.000    5.056    3.889  50.000   50.000 1000.000 
1:GLX_7:HN          1:GLX_7:HB1           -1.000    3.158    2.429  50.000   50.000 1000.000 
1:GLX_7:HN          1:GLX_7:HB2           -1.000    3.800    2.923  50.000   50.000 1000.000 
1:VAL_8:HN          1:GLX_7:HB2           -1.000    3.758    2.891  50.000   50.000 1000.000 
1:VAL_8:HN          1:VAL_8:HB           -1.000    4.298    3.306  50.000   50.000 1000.000 
1:ARX_9:HN          1:ARX_9:HB*           -1.000    3.817    2.167  50.000   50.000 1000.000 
1:LEU_10:HN          1:LEU_10:HB*           -1.000    4.491    2.685  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLN_82:HG2           -1.000    4.663    3.587  50.000   50.000 1000.000 
1:LYX_11:HN          1:LYX_11:HB2           -1.000    4.293    3.302  50.000   50.000 1000.000 
1:LYX_11:HN          1:LYX_11:HE1           -1.000    5.151    3.962  50.000   50.000 1000.000 
1:THR_12:HN          1:THR_12:HG2*           -1.000    5.021    3.093  50.000   50.000 1000.000 
1:LEU_14:HN          1:LEU_14:HD*           -1.000    6.006    2.774  50.000   50.000 1000.000 
1:GLN_15:HN          1:LEU_50:HD2*           -1.000    4.999    3.076  50.000   50.000 1000.000 
1:GLN_15:HN          1:LEU_14:HD*           -1.000    6.320    3.015  50.000   50.000 1000.000 
1:GLN_15:HN          1:GLN_15:HB*           -1.000    4.922    3.017  50.000   50.000 1000.000 
1:GLN_15:HN          1:GLN_15:HG*           -1.000    4.435    2.642  50.000   50.000 1000.000 
1:ALA_16:HN          1:GLN_15:HB*           -1.000    5.282    3.294  50.000   50.000 1000.000 
1:ALA_16:HN          1:GLN_15:HG*           -1.000    4.770    2.900  50.000   50.000 1000.000 
1:ALA_16:HN          1:ALA_16:HB*           -1.000    4.623    2.787  50.000   50.000 1000.000 
1:ARX_17:HN          1:PRO_18:HG2           -1.000    4.954    3.811  50.000   50.000 1000.000 
1:ALA_19:HN          1:LEU_14:HD*           -1.000    7.012    3.548  50.000   50.000 1000.000 
1:ALA_19:HN          1:PRO_18:HG1           -1.000    4.796    3.689  50.000   50.000 1000.000 
1:ALA_19:HN          1:PRO_18:HD2           -1.000    5.057    3.890  50.000   50.000 1000.000 
1:ALA_19:HN          1:ALA_19:HB*           -1.000    4.320    2.554  50.000   50.000 1000.000 
1:ALA_20:HN          1:ALA_19:HB*           -1.000    4.493    2.687  50.000   50.000 1000.000 
1:ALA_20:HN          1:LEU_14:HD*           -1.000    7.588    3.991  50.000   50.000 1000.000 
1:PHE_22:HN          1:LEU_21:HB1           -1.000    3.358    2.583  50.000   50.000 1000.000 
1:PHE_22:HN          1:LEU_21:HD2*           -1.000    4.348    2.575  50.000   50.000 1000.000 
1:PHE_22:HN          1:PHE_22:HB1           -1.000    3.741    2.878  50.000   50.000 1000.000 
1:PHE_22:HN          1:PHE_22:HB2           -1.000    3.567    2.744  50.000   50.000 1000.000 
1:VAL_23:HN          1:VAL_23:HG1*           -1.000    4.379    2.599  50.000   50.000 1000.000 
1:PHE_22:HN          1:VAL_23:HG1*           -1.000    5.783    3.679  50.000   50.000 1000.000 
1:GLN_24:HN          1:VAL_23:HG1*           -1.000    5.234    3.257  50.000   50.000 1000.000 
1:GLN_24:HN          1:VAL_23:HG2*           -1.000    4.653    2.810  50.000   50.000 1000.000 
1:GLN_24:HN          1:GLN_24:HG1           -1.000    4.263    3.279  50.000   50.000 1000.000 
1:GLX_25:HN          1:LEU_77:HD2*           -1.000    5.498    3.460  50.000   50.000 1000.000 
1:GLX_25:HN          1:GLX_25:HB*           -1.000    4.172    2.440  50.000   50.000 1000.000 
1:ALA_26:HN          1:GLX_25:HB*           -1.000    4.415    2.627  50.000   50.000 1000.000 
1:ALA_26:HN          1:GLX_25:HG2           -1.000    4.594    3.534  50.000   50.000 1000.000 
1:ALA_26:HN          1:ALA_26:HB*           -1.000    4.149    2.422  50.000   50.000 1000.000 
1:GLX_25:HN          1:ALA_26:HB*           -1.000    5.248    3.268  50.000   50.000 1000.000 
1:ASN_27:HN          1:ALA_26:HB*           -1.000    4.780    2.908  50.000   50.000 1000.000 
1:ASN_27:HN          1:ASN_27:HB*           -1.000    4.198    2.460  50.000   50.000 1000.000 
1:ALA_26:HN          1:ASN_27:HB*           -1.000    5.430    3.408  50.000   50.000 1000.000 
1:ARX_28:HN          1:ASN_27:HB*           -1.000    5.131    3.178  50.000   50.000 1000.000 
1:ARX_28:HN          1:ALA_26:HB*           -1.000    5.254    3.272  50.000   50.000 1000.000 
1:ARX_28:HN          1:ARX_28:HD*           -1.000    5.492    3.455  50.000   50.000 1000.000 
1:ASN_27:HN          1:VAL_23:HG2*           -1.000    5.124    3.172  50.000   50.000 1000.000 
1:PHE_29:HN          1:ALA_73:HB*           -1.000    5.545    3.496  50.000   50.000 1000.000 
1:PHE_29:HN          1:ARX_28:HB2           -1.000    4.258    3.275  50.000   50.000 1000.000 
1:PHE_29:HN          1:PHE_29:HB1           -1.000    3.836    2.951  50.000   50.000 1000.000 
1:PHE_29:HN          1:PHE_29:HB2           -1.000    3.609    2.776  50.000   50.000 1000.000 
1:ARX_28:HN          1:PHE_29:HB2           -1.000    5.109    3.930  50.000   50.000 1000.000 
1:THR_30:HN          1:PHE_29:HB1           -1.000    4.632    3.563  50.000   50.000 1000.000 
1:THR_30:HN          1:PHE_29:HB2           -1.000    4.203    3.233  50.000   50.000 1000.000 
1:THR_30:HN          1:THR_30:HB           -1.000    4.078    3.137  50.000   50.000 1000.000 
1:THR_30:HN          1:THR_30:HG2*           -1.000    4.857    2.967  50.000   50.000 1000.000 
1:SER_31:HN          1:THR_30:HB           -1.000    4.388    3.375  50.000   50.000 1000.000 
1:SER_31:HN          1:THR_30:HG2*           -1.000    5.172    3.209  50.000   50.000 1000.000 
1:SER_31:HN          1:SER_31:HB1           -1.000    4.098    3.152  50.000   50.000 1000.000 
1:SER_31:HN          1:SER_31:HB2           -1.000    3.797    2.921  50.000   50.000 1000.000 
1:THR_30:HN          1:SER_31:HB1           -1.000    7.011    5.393  50.000   50.000 1000.000 
1:SER_31:HN          1:PHE_29:HB2           -1.000    4.216    3.243  50.000   50.000 1000.000 
1:SER_31:HN          1:ALA_73:HB*           -1.000    5.902    3.771  50.000   50.000 1000.000 
1:VAL_33:HN          1:VAL_33:HG1*           -1.000    5.090    3.146  50.000   50.000 1000.000 
1:VAL_33:HN          1:VAL_33:HG2*           -1.000    4.689    2.838  50.000   50.000 1000.000 
1:PHE_34:HN          1:VAL_33:HB           -1.000    4.512    3.471  50.000   50.000 1000.000 
1:PHE_34:HN          1:PHE_34:HB1           -1.000    4.553    3.502  50.000   50.000 1000.000 
1:PHE_34:HN          1:PHE_34:HB2           -1.000    4.194    3.226  50.000   50.000 1000.000 
1:LEU_35:HN          1:PHE_34:HB1           -1.000    3.637    2.798  50.000   50.000 1000.000 
1:LEU_35:HN          1:PHE_34:HB2           -1.000    4.124    3.172  50.000   50.000 1000.000 
1:PHE_34:HN          1:ILE_64:HB           -1.000    4.168    3.206  50.000   50.000 1000.000 
1:GLX_36:HN          1:GLX_36:HB1           -1.000    4.001    3.078  50.000   50.000 1000.000 
1:GLX_36:HN          1:GLX_36:HB2           -1.000    3.951    3.039  50.000   50.000 1000.000 
1:GLX_36:HN          1:THR_62:HG1           -1.000    4.562    3.509  50.000   50.000 1000.000 
1:ASX_38:HN          1:LYX_37:HG1           -1.000    5.710    4.392  50.000   50.000 1000.000 
1:ASX_38:HN          1:LYX_37:HG2           -1.000    5.941    4.570  50.000   50.000 1000.000 
1:ASX_38:HN          1:ASX_38:HB1           -1.000    6.014    4.626  50.000   50.000 1000.000 
1:ASX_38:HN          1:ASX_38:HB2           -1.000    6.058    4.660  50.000   50.000 1000.000 
1:LYX_40:HN          1:LYX_40:HG2           -1.000    3.797    2.921  50.000   50.000 1000.000 
1:GLY_39:HN          1:LYX_40:HG2           -1.000    4.641    3.570  50.000   50.000 1000.000 
1:GLY_39:HN          1:ASX_38:HB1           -1.000    4.633    3.564  50.000   50.000 1000.000 
1:LYX_40:HN          1:LYX_40:HG1           -1.000    3.610    2.777  50.000   50.000 1000.000 
1:VAL_42:HN          1:LYX_41:HG1           -1.000    3.974    3.057  50.000   50.000 1000.000 
1:VAL_42:HN          1:LYX_41:HG2           -1.000    4.313    3.318  50.000   50.000 1000.000 
1:VAL_42:HN          1:VAL_42:HG2*           -1.000    4.169    2.438  50.000   50.000 1000.000 
1:ASN_43:HN          1:VAL_42:HB           -1.000    3.566    2.743  50.000   50.000 1000.000 
1:ASN_43:HN          1:ASN_43:HB1           -1.000    3.546    2.728  50.000   50.000 1000.000 
1:ASN_43:HN          1:ASN_43:HB2           -1.000    3.588    2.760  50.000   50.000 1000.000 
1:ALA_44:HN          1:ASN_43:HB1           -1.000    4.772    3.671  50.000   50.000 1000.000 
1:ALA_44:HN          1:ASN_43:HB2           -1.000    5.784    4.449  50.000   50.000 1000.000 
1:ALA_44:HN          1:VAL_33:HG1*           -1.000    5.550    3.500  50.000   50.000 1000.000 
1:ALA_44:HN          1:VAL_33:HG2*           -1.000    6.200    4.000  50.000   50.000 1000.000 
1:ALA_44:HN          1:ALA_44:HB*           -1.000    4.424    2.634  50.000   50.000 1000.000 
1:ILE_47:HN          1:SER_46:HB1           -1.000    5.021    3.862  50.000   50.000 1000.000 
1:ILE_47:HN          1:ILE_47:HB           -1.000    4.017    3.090  50.000   50.000 1000.000 
1:MET_48:HN          1:MET_48:HB1           -1.000    4.273    3.287  50.000   50.000 1000.000 
1:MET_48:HN          1:MET_48:HB2           -1.000    3.953    3.041  50.000   50.000 1000.000 
1:LEU_50:HN          1:LEU_50:HB2           -1.000    3.853    2.964  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_50:HB2           -1.000    3.995    3.073  50.000   50.000 1000.000 
1:MET_51:HN          1:ILE_47:HD1*           -1.000    5.787    3.682  50.000   50.000 1000.000 
1:MET_51:HN          1:MET_51:HB1           -1.000    3.917    3.013  50.000   50.000 1000.000 
1:MET_51:HN          1:MET_51:HB2           -1.000    3.894    2.995  50.000   50.000 1000.000 
1:LEU_53:HN          1:LEU_53:HB2           -1.000    3.583    2.756  50.000   50.000 1000.000 
1:ALA_54:HN          1:LEU_53:HB1           -1.000    4.008    3.083  50.000   50.000 1000.000 
1:ALA_54:HN          1:LEU_53:HB2           -1.000    4.588    3.529  50.000   50.000 1000.000 
1:ALA_54:HN          1:ALA_54:HB*           -1.000    4.249    2.499  50.000   50.000 1000.000 
1:LEU_53:HN          1:ALA_54:HB*           -1.000    5.293    3.302  50.000   50.000 1000.000 
1:VAX_55:HN          1:ALA_54:HB*           -1.000    4.607    2.775  50.000   50.000 1000.000 
1:VAX_55:HN          1:VAX_55:HB           -1.000    3.653    2.810  50.000   50.000 1000.000 
1:VAX_55:HN          1:VAX_55:HG*           -1.000    5.569    2.438  50.000   50.000 1000.000 
1:SER_56:HN          1:VAX_55:HG*           -1.000    6.148    2.883  50.000   50.000 1000.000 
1:THR_57:HN          1:THR_57:HG2*           -1.000    5.127    3.175  50.000   50.000 1000.000 
1:GLY_58:HN          1:THR_57:HG2*           -1.000    4.825    2.942  50.000   50.000 1000.000 
1:THR_59:HN          1:THR_59:HB           -1.000    3.424    2.634  50.000   50.000 1000.000 
1:THR_59:HN          1:THR_59:HG2*           -1.000    4.841    2.955  50.000   50.000 1000.000 
1:GLX_60:HN          1:THR_59:HB           -1.000    4.082    3.140  50.000   50.000 1000.000 
1:GLX_60:HN          1:THR_59:HG2*           -1.000    4.396    2.612  50.000   50.000 1000.000 
1:GLX_60:HN          1:GLX_60:HB1           -1.000    4.135    3.181  50.000   50.000 1000.000 
1:LEU_63:HN          1:LEU_63:HB2           -1.000    3.328    2.560  50.000   50.000 1000.000 
1:ILE_64:HN          1:ILE_64:HB           -1.000    3.906    3.005  50.000   50.000 1000.000 
1:ALA_65:HN          1:ILE_64:HB           -1.000    5.235    4.027  50.000   50.000 1000.000 
1:ALA_65:HN          1:ILE_64:HG11           -1.000    5.195    3.996  50.000   50.000 1000.000 
1:ALA_65:HN          1:ALA_65:HB*           -1.000    4.956    3.043  50.000   50.000 1000.000 
1:ALA_65:HN          1:GLN_66:HG*           -1.000    6.151    3.962  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLN_66:HB2           -1.000    4.654    3.580  50.000   50.000 1000.000 
1:GLX_68:HN          1:GLX_68:HB*           -1.000    4.220    2.477  50.000   50.000 1000.000 
1:GLX_68:HN          1:GLX_68:HG*           -1.000    4.659    2.815  50.000   50.000 1000.000 
1:ASX_69:HN          1:SER_31:HB2           -1.000    4.388    3.375  50.000   50.000 1000.000 
1:ASX_69:HN          1:ASX_69:HB2           -1.000    3.818    2.937  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLX_70:HB2           -1.000    3.726    2.866  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLX_70:HB2           -1.000    4.767    3.667  50.000   50.000 1000.000 
1:GLN_71:HN          1:GLX_70:HB2           -1.000    4.147    3.190  50.000   50.000 1000.000 
1:GLX_72:HN          1:GLX_72:HG*           -1.000    4.415    2.627  50.000   50.000 1000.000 
1:ALA_73:HN          1:ALA_73:HB*           -1.000    4.211    2.470  50.000   50.000 1000.000 
1:GLX_72:HN          1:ALA_73:HB*           -1.000    5.072    3.132  50.000   50.000 1000.000 
1:LEU_77:HN          1:LEU_77:HD1*           -1.000    4.758    2.891  50.000   50.000 1000.000 
1:LEU_77:HN          1:LEU_77:HD2*           -1.000    4.813    2.933  50.000   50.000 1000.000 
1:LYX_76:HN          1:LEU_77:HD2*           -1.000    6.329    4.099  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_77:HB1           -1.000    3.827    2.944  50.000   50.000 1000.000 
1:ALA_78:HN          1:VAX_81:HG*           -1.000    6.942    3.494  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_77:HD2*           -1.000    5.506    3.466  50.000   50.000 1000.000 
1:ALA_79:HN          1:ALA_78:HB*           -1.000    4.128    2.406  50.000   50.000 1000.000 
1:ALA_79:HN          1:ALA_79:HB*           -1.000    3.900    2.231  50.000   50.000 1000.000 
1:TYR_80:HN          1:ALA_79:HB*           -1.000    4.392    2.609  50.000   50.000 1000.000 
1:TYR_80:HN          1:TYR_80:HB1           -1.000    3.392    2.609  50.000   50.000 1000.000 
1:TYR_80:HN          1:TYR_80:HB2           -1.000    3.233    2.487  50.000   50.000 1000.000 
1:VAX_81:HN          1:TYR_80:HB1           -1.000    3.999    3.076  50.000   50.000 1000.000 
1:VAX_81:HN          1:TYR_80:HB2           -1.000    4.065    3.127  50.000   50.000 1000.000 
1:VAX_81:HN          1:VAX_81:HB           -1.000    4.667    3.590  50.000   50.000 1000.000 
1:VAX_81:HN          1:VAX_81:HG*           -1.000    5.594    2.457  50.000   50.000 1000.000 
1:TYR_80:HN          1:LEU_77:HD2*           -1.000    5.443    3.418  50.000   50.000 1000.000 
1:TYR_80:HN          1:VAX_81:HG*           -1.000    6.577    3.213  50.000   50.000 1000.000 
1:GLN_82:HN          1:VAX_81:HG*           -1.000    6.004    2.772  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HB1           -1.000    3.669    2.822  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HG1           -1.000    4.053    3.118  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HG2           -1.000    4.181    3.216  50.000   50.000 1000.000 
1:VAX_81:HN          1:GLN_82:HB2           -1.000    5.931    4.562  50.000   50.000 1000.000 
1:GLX_83:HN          1:VAX_81:HG*           -1.000    6.708    3.314  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLX_83:HB2           -1.000    4.293    3.302  50.000   50.000 1000.000 
1:VAX_85:HN          1:VAX_85:HG*           -1.000    5.633    2.487  50.000   50.000 1000.000 
1:GLX_84:HN          1:LEU_86:HD2*           -1.000    4.478    2.675  50.000   50.000 1000.000 
1:VAX_85:HN          1:LEU_86:HG           -1.000    4.381    3.370  50.000   50.000 1000.000 
1:GLNC_87:HN          1:LEU_86:HD2*           -1.000    5.601    3.539  50.000   50.000 1000.000 
1:GLNC_87:HN          1:GLNC_87:HG*           -1.000    5.629    3.561  50.000   50.000 1000.000 
1:GLN_4:HN          1:ILE_64:HG12           -1.000    6.592    5.071  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_3:HG2           -1.000    3.532    2.717  50.000   50.000 1000.000 
1:THR_12:HN          1:LEU_14:HD*           -1.000    8.306    4.543  50.000   50.000 1000.000 
1:GLY_13:HN          1:THR_12:HG1           -1.000    3.942    3.032  50.000   50.000 1000.000 
1:GLY_13:HN          1:LEU_14:HD*           -1.000    7.881    4.216  50.000   50.000 1000.000 
1:ALA_16:HN          1:ALA_19:HB*           -1.000    5.450    3.423  50.000   50.000 1000.000 
1:ALA_26:HN          1:LEU_77:HD2*           -1.000    4.917    3.013  50.000   50.000 1000.000 
1:SER_31:HN          1:GLX_68:HB*           -1.000    5.997    3.844  50.000   50.000 1000.000 
1:SER_31:HN          1:PHE_29:HB1           -1.000    4.131    3.178  50.000   50.000 1000.000 
1:GLX_36:HN          1:VAL_61:HB           -1.000    4.710    3.623  50.000   50.000 1000.000 
1:GLY_39:HN          1:ASX_38:HB2           -1.000    5.093    3.918  50.000   50.000 1000.000 
1:ALA_44:HN          1:VAL_33:HB           -1.000    5.537    4.259  50.000   50.000 1000.000 
1:VAX_55:HN          1:LEU_14:HB1           -1.000    4.631    3.562  50.000   50.000 1000.000 
1:VAX_55:HN          1:LEU_53:HB1           -1.000    4.823    3.710  50.000   50.000 1000.000 
1:GLY_58:HN          1:ARX_9:HG1           -1.000    4.963    3.818  50.000   50.000 1000.000 
1:GLY_58:HN          1:LEU_10:HB*           -1.000    5.685    3.604  50.000   50.000 1000.000 
1:THR_59:HN          1:THR_57:HG2*           -1.000    5.810    3.700  50.000   50.000 1000.000 
1:ILE_64:HN          1:PHE_34:HB2           -1.000    5.152    3.963  50.000   50.000 1000.000 
1:ASX_69:HN          1:ASX_69:HB1           -1.000    4.108    3.160  50.000   50.000 1000.000 
1:ASX_69:HN          1:SER_31:HB1           -1.000    4.596    3.535  50.000   50.000 1000.000 
1:GLX_72:HN          1:ASX_69:HB2           -1.000    4.722    3.632  50.000   50.000 1000.000 
1:GLX_72:HN          1:ASX_69:HB1           -1.000    4.645    3.573  50.000   50.000 1000.000 
1:ALA_79:HN          1:VAX_81:HG*           -1.000    6.427    3.098  50.000   50.000 1000.000 
1:ALA_79:HN          1:LEU_77:HB1           -1.000    4.927    3.790  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_3:HA           -1.000    3.480    2.677  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_4:HA           -1.000    4.057    3.121  50.000   50.000 1000.000 
1:LYX_5:HN          1:GLN_4:HA           -1.000    3.286    2.528  50.000   50.000 1000.000 
1:LYX_5:HN          1:LYX_5:HA           -1.000    4.040    3.108  50.000   50.000 1000.000 
1:VAL_6:HN          1:VAL_6:HA           -1.000    4.198    3.229  50.000   50.000 1000.000 
1:GLX_7:HN          1:VAL_6:HA           -1.000    3.176    2.443  50.000   50.000 1000.000 
1:GLX_7:HN          1:GLX_7:HA           -1.000    4.216    3.243  50.000   50.000 1000.000 
1:VAL_8:HN          1:GLX_7:HA           -1.000    3.169    2.438  50.000   50.000 1000.000 
1:VAL_8:HN          1:VAL_8:HA           -1.000    4.030    3.100  50.000   50.000 1000.000 
1:ARX_9:HN          1:VAL_8:HA           -1.000    3.227    2.482  50.000   50.000 1000.000 
1:ARX_9:HN          1:ARX_9:HA           -1.000    3.983    3.064  50.000   50.000 1000.000 
1:LEU_10:HN          1:ARX_9:HA           -1.000    3.465    2.665  50.000   50.000 1000.000 
1:LYX_11:HN          1:LYX_11:HA           -1.000    4.108    3.160  50.000   50.000 1000.000 
1:THR_12:HN          1:LYX_11:HA           -1.000    4.761    3.662  50.000   50.000 1000.000 
1:ALA_16:HN          1:GLN_15:HA           -1.000    3.860    2.969  50.000   50.000 1000.000 
1:ALA_19:HN          1:PRO_18:HA           -1.000    4.471    3.439  50.000   50.000 1000.000 
1:ALA_19:HN          1:ALA_19:HA           -1.000    3.992    3.071  50.000   50.000 1000.000 
1:PHE_22:HN          1:LEU_21:HA           -1.000    4.819    3.707  50.000   50.000 1000.000 
1:PHE_22:HN          1:PHE_22:HA           -1.000    3.930    3.023  50.000   50.000 1000.000 
1:VAL_23:HN          1:PHE_22:HA           -1.000    4.492    3.455  50.000   50.000 1000.000 
1:VAL_23:HN          1:VAL_23:HA           -1.000    4.220    3.246  50.000   50.000 1000.000 
1:GLN_24:HN          1:VAL_23:HA           -1.000    4.833    3.718  50.000   50.000 1000.000 
1:ASN_27:HN          1:ASN_27:HA           -1.000    4.057    3.121  50.000   50.000 1000.000 
1:ARX_28:HN          1:ASN_27:HA           -1.000    4.456    3.428  50.000   50.000 1000.000 
1:PHE_29:HN          1:PHE_29:HA           -1.000    3.695    2.842  50.000   50.000 1000.000 
1:THR_30:HN          1:THR_30:HA           -1.000    3.947    3.036  50.000   50.000 1000.000 
1:SER_31:HN          1:THR_30:HA           -1.000    4.325    3.327  50.000   50.000 1000.000 
1:SER_31:HN          1:SER_31:HA           -1.000    4.278    3.291  50.000   50.000 1000.000 
1:THR_30:HN          1:SER_31:HA           -1.000    6.603    5.079  50.000   50.000 1000.000 
1:VAL_33:HN          1:VAL_33:HA           -1.000    4.477    3.444  50.000   50.000 1000.000 
1:PHE_34:HN          1:VAL_33:HA           -1.000    3.446    2.651  50.000   50.000 1000.000 
1:PHE_34:HN          1:PHE_34:HA           -1.000    4.430    3.408  50.000   50.000 1000.000 
1:LEU_35:HN          1:PHE_34:HA           -1.000    3.548    2.729  50.000   50.000 1000.000 
1:LEU_35:HN          1:LEU_35:HA           -1.000    4.330    3.331  50.000   50.000 1000.000 
1:GLX_36:HN          1:LEU_35:HA           -1.000    3.425    2.635  50.000   50.000 1000.000 
1:GLX_36:HN          1:GLX_36:HA           -1.000    4.450    3.423  50.000   50.000 1000.000 
1:LYX_37:HN          1:GLX_36:HA           -1.000    3.446    2.651  50.000   50.000 1000.000 
1:LYX_37:HN          1:LYX_37:HA           -1.000    4.406    3.389  50.000   50.000 1000.000 
1:ASX_38:HN          1:LYX_37:HA           -1.000    4.341    3.339  50.000   50.000 1000.000 
1:ASX_38:HN          1:ASX_38:HA           -1.000    4.697    3.613  50.000   50.000 1000.000 
1:LYX_40:HN          1:LYX_40:HA           -1.000    3.760    2.892  50.000   50.000 1000.000 
1:LYX_41:HN          1:LYX_40:HA           -1.000    3.201    2.462  50.000   50.000 1000.000 
1:LYX_41:HN          1:LYX_41:HA           -1.000    4.352    3.348  50.000   50.000 1000.000 
1:VAL_42:HN          1:LYX_41:HA           -1.000    3.446    2.651  50.000   50.000 1000.000 
1:ALA_44:HN          1:ASN_43:HA           -1.000    3.494    2.688  50.000   50.000 1000.000 
1:ALA_44:HN          1:ALA_44:HA           -1.000    4.177    3.213  50.000   50.000 1000.000 
1:SER_46:HN          1:SER_46:HA           -1.000    3.683    2.833  50.000   50.000 1000.000 
1:LYX_45:HN          1:SER_46:HA           -1.000    5.243    4.033  50.000   50.000 1000.000 
1:ILE_47:HN          1:SER_46:HA           -1.000    3.715    2.858  50.000   50.000 1000.000 
1:MET_48:HN          1:MET_48:HA           -1.000    4.094    3.149  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_50:HA           -1.000    3.825    2.942  50.000   50.000 1000.000 
1:ALA_54:HN          1:ALA_54:HA           -1.000    3.112    2.394  50.000   50.000 1000.000 
1:VAX_55:HN          1:ALA_54:HA           -1.000    3.520    2.708  50.000   50.000 1000.000 
1:VAX_55:HN          1:VAX_55:HA           -1.000    4.203    3.233  50.000   50.000 1000.000 
1:SER_56:HN          1:VAX_55:HA           -1.000    3.653    2.810  50.000   50.000 1000.000 
1:SER_56:HN          1:SER_56:HA           -1.000    4.108    3.160  50.000   50.000 1000.000 
1:THR_57:HN          1:SER_56:HA           -1.000    3.970    3.054  50.000   50.000 1000.000 
1:GLX_60:HN          1:THR_59:HA           -1.000    3.211    2.470  50.000   50.000 1000.000 
1:GLX_60:HN          1:GLX_60:HA           -1.000    4.243    3.264  50.000   50.000 1000.000 
1:VAL_61:HN          1:GLX_60:HA           -1.000    3.176    2.443  50.000   50.000 1000.000 
1:LEU_63:HN          1:LEU_63:HA           -1.000    3.856    2.966  50.000   50.000 1000.000 
1:ILE_64:HN          1:LEU_63:HA           -1.000    3.679    2.830  50.000   50.000 1000.000 
1:ILE_64:HN          1:ILE_64:HA           -1.000    4.562    3.509  50.000   50.000 1000.000 
1:ALA_65:HN          1:ILE_64:HA           -1.000    3.475    2.673  50.000   50.000 1000.000 
1:ILE_64:HN          1:LYX_5:HA           -1.000    5.659    4.353  50.000   50.000 1000.000 
1:GLN_66:HN          1:GLN_66:HA           -1.000    4.978    3.829  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLN_66:HA           -1.000    3.762    2.894  50.000   50.000 1000.000 
1:GLX_68:HN          1:GLX_68:HA           -1.000    3.754    2.888  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLX_68:HA           -1.000    4.177    3.213  50.000   50.000 1000.000 
1:ASX_69:HN          1:ASX_69:HA           -1.000    3.868    2.975  50.000   50.000 1000.000 
1:GLX_70:HN          1:ASX_69:HA           -1.000    4.376    3.366  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLX_70:HA           -1.000    4.072    3.132  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLX_70:HA           -1.000    4.893    3.764  50.000   50.000 1000.000 
1:GLN_71:HN          1:GLX_70:HA           -1.000    5.122    3.940  50.000   50.000 1000.000 
1:GLN_71:HN          1:GLN_71:HA           -1.000    3.870    2.977  50.000   50.000 1000.000 
1:ALA_73:HN          1:GLX_72:HA           -1.000    4.172    3.209  50.000   50.000 1000.000 
1:ALA_73:HN          1:ALA_73:HA           -1.000    3.570    2.746  50.000   50.000 1000.000 
1:LYX_76:HN          1:GLX_75:HA           -1.000    4.037    3.105  50.000   50.000 1000.000 
1:LYX_76:HN          1:LYX_76:HA           -1.000    3.762    2.894  50.000   50.000 1000.000 
1:ALA_79:HN          1:ALA_78:HA           -1.000    3.708    2.852  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HA           -1.000    4.160    3.200  50.000   50.000 1000.000 
1:GLX_83:HN          1:GLX_83:HA           -1.000    3.401    2.616  50.000   50.000 1000.000 
1:GLX_84:HN          1:GLX_84:HA           -1.000    3.553    2.733  50.000   50.000 1000.000 
1:VAX_85:HN          1:VAX_85:HA           -1.000    3.574    2.749  50.000   50.000 1000.000 
1:PHE_29:HN          1:ASN_27:HA           -1.000    4.537    3.490  50.000   50.000 1000.000 
1:LYX_37:HN          1:LYX_41:HA           -1.000    4.347    3.344  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_66:HA           -1.000    4.612    3.548  50.000   50.000 1000.000 
1:ALA_20:HN          1:PRO_18:HA           -1.000    4.246    3.266  50.000   50.000 1000.000 
1:ASX_32:HN          1:GLY_67:HA1           -1.000    4.320    3.323  50.000   50.000 1000.000 
1:LEU_35:HN          1:LYX_41:HA           -1.000    5.036    3.874  50.000   50.000 1000.000 
1:GLX_36:HN          1:LYX_41:HA           -1.000    6.143    4.725  50.000   50.000 1000.000 
1:GLX_36:HN          1:LEU_63:HA           -1.000    5.074    3.903  50.000   50.000 1000.000 
1:LYX_40:HN          1:GLX_36:HA           -1.000    4.477    3.444  50.000   50.000 1000.000 
1:LYX_40:HN          1:GLY_39:HA1           -1.000    3.836    2.951  50.000   50.000 1000.000 
1:LYX_40:HN          1:GLY_39:HA2           -1.000    3.917    3.013  50.000   50.000 1000.000 
1:ALA_44:HN          1:PHE_34:HA           -1.000    3.728    2.868  50.000   50.000 1000.000 
1:THR_57:HN          1:GLY_13:HA2           -1.000    5.859    4.507  50.000   50.000 1000.000 
1:THR_62:HN          1:THR_62:HA           -1.000    3.769    2.899  50.000   50.000 1000.000 
1:THR_62:HN          1:LYX_37:HA           -1.000    5.143    3.956  50.000   50.000 1000.000 
1:THR_62:HN          1:LEU_35:HA           -1.000    5.136    3.951  50.000   50.000 1000.000 
1:ILE_64:HN          1:LEU_35:HA           -1.000    5.023    3.864  50.000   50.000 1000.000 
1:ALA_65:HN          1:GLN_3:HA           -1.000    5.710    4.392  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLN_3:HA           -1.000    5.372    4.132  50.000   50.000 1000.000 
1:GLY_67:HN          1:SER_31:HA           -1.000    6.293    4.841  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLY_67:HA2           -1.000    4.376    3.366  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLX_70:HA           -1.000    4.685    3.604  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLN_66:HA           -1.000    4.957    3.813  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLX_68:HA           -1.000    5.308    4.083  50.000   50.000 1000.000 
1:GLN_71:HN          1:ASX_69:HA           -1.000    5.149    3.961  50.000   50.000 1000.000 
1:GLX_72:HN          1:ASX_69:HA           -1.000    4.887    3.759  50.000   50.000 1000.000 
1:ALA_73:HN          1:GLX_70:HA           -1.000    4.562    3.509  50.000   50.000 1000.000 
1:LEU_77:HN          1:LEU_74:HA           -1.000    5.041    3.878  50.000   50.000 1000.000 
1:VAX_81:HN          1:ALA_78:HA           -1.000    5.082    3.909  50.000   50.000 1000.000 
1:GLX_83:HN          1:GLN_82:HA           -1.000    4.443    3.418  50.000   50.000 1000.000 
1:GLN_4:HN          1:LYX_5:HN           -1.000    4.978    3.829  50.000   50.000 1000.000 
1:VAL_6:HN          1:LYX_5:HN           -1.000    5.807    4.467  50.000   50.000 1000.000 
1:VAL_6:HN          1:GLX_7:HN           -1.000    4.885    3.758  50.000   50.000 1000.000 
1:GLX_7:HN          1:VAL_8:HN           -1.000    4.788    3.683  50.000   50.000 1000.000 
1:ARX_9:HN          1:VAL_8:HN           -1.000    4.883    3.756  50.000   50.000 1000.000 
1:LYX_11:HN          1:THR_12:HN           -1.000    4.155    3.196  50.000   50.000 1000.000 
1:LEU_14:HN          1:GLY_13:HN           -1.000    5.981    4.601  50.000   50.000 1000.000 
1:LEU_14:HN          1:GLN_15:HN           -1.000    5.061    3.893  50.000   50.000 1000.000 
1:GLN_15:HN          1:ALA_16:HN           -1.000    6.118    4.706  50.000   50.000 1000.000 
1:ALA_20:HN          1:ALA_19:HN           -1.000    3.758    2.891  50.000   50.000 1000.000 
1:GLX_25:HN          1:GLN_24:HN           -1.000    3.784    2.911  50.000   50.000 1000.000 
1:ALA_26:HN          1:GLX_25:HN           -1.000    3.906    3.005  50.000   50.000 1000.000 
1:ASN_27:HN          1:ALA_26:HN           -1.000    3.979    3.061  50.000   50.000 1000.000 
1:PHE_29:HN          1:ASN_27:HN           -1.000    5.235    4.027  50.000   50.000 1000.000 
1:ASN_27:HN          1:ARX_28:HN           -1.000    3.914    3.011  50.000   50.000 1000.000 
1:PHE_29:HN          1:ARX_28:HN           -1.000    3.679    2.830  50.000   50.000 1000.000 
1:PHE_29:HN          1:THR_30:HN           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:THR_30:HN          1:SER_31:HN           -1.000    3.894    2.995  50.000   50.000 1000.000 
1:ASX_32:HN          1:SER_31:HN           -1.000    5.025    3.865  50.000   50.000 1000.000 
1:VAL_33:HN          1:ASX_32:HN           -1.000    5.459    4.199  50.000   50.000 1000.000 
1:PHE_34:HN          1:VAL_33:HN           -1.000    5.140    3.954  50.000   50.000 1000.000 
1:LEU_35:HN          1:PHE_34:HN           -1.000    5.156    3.966  50.000   50.000 1000.000 
1:GLX_36:HN          1:LEU_35:HN           -1.000    5.112    3.932  50.000   50.000 1000.000 
1:LYX_37:HN          1:GLX_36:HN           -1.000    4.901    3.770  50.000   50.000 1000.000 
1:ASX_38:HN          1:LYX_37:HN           -1.000    6.657    5.121  50.000   50.000 1000.000 
1:GLY_39:HN          1:ASX_38:HN           -1.000    5.187    3.990  50.000   50.000 1000.000 
1:LYX_40:HN          1:GLY_39:HN           -1.000    3.640    2.800  50.000   50.000 1000.000 
1:LYX_41:HN          1:LYX_40:HN           -1.000    4.706    3.620  50.000   50.000 1000.000 
1:VAL_42:HN          1:LYX_41:HN           -1.000    5.251    4.039  50.000   50.000 1000.000 
1:ASN_43:HN          1:VAL_42:HN           -1.000    5.379    4.138  50.000   50.000 1000.000 
1:ASN_43:HN          1:ALA_44:HN           -1.000    5.343    4.110  50.000   50.000 1000.000 
1:LYX_45:HN          1:ALA_44:HN           -1.000    4.263    3.279  50.000   50.000 1000.000 
1:SER_46:HN          1:LYX_45:HN           -1.000    3.535    2.719  50.000   50.000 1000.000 
1:ILE_47:HN          1:SER_46:HN           -1.000    6.053    4.656  50.000   50.000 1000.000 
1:MET_48:HN          1:ILE_47:HN           -1.000    4.388    3.375  50.000   50.000 1000.000 
1:LEU_50:HN          1:GLY_49:HN           -1.000    3.561    2.739  50.000   50.000 1000.000 
1:LEU_50:HN          1:MET_51:HN           -1.000    4.139    3.184  50.000   50.000 1000.000 
1:SER_52:HN          1:MET_51:HN           -1.000    4.004    3.080  50.000   50.000 1000.000 
1:LEU_53:HN          1:SER_52:HN           -1.000    4.021    3.093  50.000   50.000 1000.000 
1:ALA_54:HN          1:LEU_53:HN           -1.000    3.834    2.949  50.000   50.000 1000.000 
1:VAX_55:HN          1:ALA_54:HN           -1.000    4.424    3.403  50.000   50.000 1000.000 
1:SER_56:HN          1:VAX_55:HN           -1.000    5.745    4.419  50.000   50.000 1000.000 
1:THR_57:HN          1:GLY_58:HN           -1.000    5.955    4.581  50.000   50.000 1000.000 
1:THR_59:HN          1:GLY_58:HN           -1.000    3.983    3.064  50.000   50.000 1000.000 
1:GLX_60:HN          1:THR_59:HN           -1.000    5.169    3.976  50.000   50.000 1000.000 
1:VAL_61:HN          1:GLX_60:HN           -1.000    4.763    3.664  50.000   50.000 1000.000 
1:ILE_64:HN          1:LEU_63:HN           -1.000    4.528    3.483  50.000   50.000 1000.000 
1:ALA_65:HN          1:ILE_64:HN           -1.000    6.592    5.071  50.000   50.000 1000.000 
1:GLN_66:HN          1:ALA_65:HN           -1.000    4.381    3.370  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLN_66:HN           -1.000    5.032    3.871  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLX_68:HN           -1.000    5.492    4.225  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLX_68:HN           -1.000    4.143    3.187  50.000   50.000 1000.000 
1:GLX_70:HN          1:ASX_69:HN           -1.000    3.930    3.023  50.000   50.000 1000.000 
1:GLN_71:HN          1:GLX_70:HN           -1.000    4.559    3.507  50.000   50.000 1000.000 
1:GLN_71:HN          1:GLX_72:HN           -1.000    3.909    3.007  50.000   50.000 1000.000 
1:ALA_73:HN          1:GLX_72:HN           -1.000    3.912    3.009  50.000   50.000 1000.000 
1:LEU_74:HN          1:ALA_73:HN           -1.000    3.780    2.908  50.000   50.000 1000.000 
1:LYX_76:HN          1:GLX_75:HN           -1.000    4.011    3.085  50.000   50.000 1000.000 
1:LEU_77:HN          1:LYX_76:HN           -1.000    3.986    3.066  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_77:HN           -1.000    4.024    3.095  50.000   50.000 1000.000 
1:ALA_79:HN          1:ALA_78:HN           -1.000    3.764    2.895  50.000   50.000 1000.000 
1:TYR_80:HN          1:ALA_79:HN           -1.000    3.992    3.071  50.000   50.000 1000.000 
1:VAX_81:HN          1:TYR_80:HN           -1.000    3.480    2.677  50.000   50.000 1000.000 
1:VAX_81:HN          1:GLN_82:HN           -1.000    4.021    3.093  50.000   50.000 1000.000 
1:GLX_83:HN          1:GLN_82:HN           -1.000    3.770    2.900  50.000   50.000 1000.000 
1:GLX_84:HN          1:GLX_83:HN           -1.000    3.888    2.991  50.000   50.000 1000.000 
1:GLX_84:HN          1:VAX_85:HN           -1.000    3.797    2.921  50.000   50.000 1000.000 
1:LEU_86:HN          1:VAX_85:HN           -1.000    4.471    3.439  50.000   50.000 1000.000 
1:GLNC_87:HN          1:LEU_86:HN           -1.000    4.923    3.787  50.000   50.000 1000.000 
1:LYX_5:HN          1:ALA_65:HN           -1.000    5.916    4.551  50.000   50.000 1000.000 
1:LEU_10:HN          1:VAL_61:HN           -1.000    4.913    3.779  50.000   50.000 1000.000 
1:LEU_10:HN          1:THR_59:HN           -1.000    5.326    4.097  50.000   50.000 1000.000 
1:GLY_13:HN          1:THR_57:HN           -1.000    7.598    5.845  50.000   50.000 1000.000 
1:GLN_15:HN          1:ALA_19:HN           -1.000    5.226    4.020  50.000   50.000 1000.000 
1:ALA_19:HN          1:ALA_16:HN           -1.000    6.448    4.960  50.000   50.000 1000.000 
1:ALA_20:HN          1:PHE_22:HN           -1.000    5.091    3.916  50.000   50.000 1000.000 
1:VAL_23:HN          1:ALA_26:HN           -1.000    5.429    4.176  50.000   50.000 1000.000 
1:GLN_24:HN          1:ALA_26:HN           -1.000    5.703    4.387  50.000   50.000 1000.000 
1:ASN_27:HN          1:GLX_25:HN           -1.000    7.129    5.484  50.000   50.000 1000.000 
1:ARX_28:HN          1:ALA_26:HN           -1.000    5.260    4.046  50.000   50.000 1000.000 
1:PHE_29:HN          1:SER_31:HN           -1.000    6.100    4.692  50.000   50.000 1000.000 
1:LYX_40:HN          1:ASX_38:HN           -1.000    6.194    4.765  50.000   50.000 1000.000 
1:LEU_50:HN          1:ILE_47:HN           -1.000    6.405    4.927  50.000   50.000 1000.000 
1:LEU_50:HN          1:SER_46:HN           -1.000    6.746    5.189  50.000   50.000 1000.000 
1:SER_52:HN          1:LEU_50:HN           -1.000    5.308    4.083  50.000   50.000 1000.000 
1:SER_52:HN          1:ALA_54:HN           -1.000    5.798    4.460  50.000   50.000 1000.000 
1:LEU_53:HN          1:VAX_55:HN           -1.000    5.971    4.593  50.000   50.000 1000.000 
1:GLY_67:HN          1:ASX_69:HN           -1.000    5.987    4.605  50.000   50.000 1000.000 
1:GLX_68:HN          1:SER_31:HN           -1.000    5.725    4.404  50.000   50.000 1000.000 
1:ASX_69:HN          1:SER_31:HN           -1.000    4.419    3.399  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLX_72:HN           -1.000    6.287    4.836  50.000   50.000 1000.000 
1:LEU_77:HN          1:GLX_75:HN           -1.000    5.737    4.413  50.000   50.000 1000.000 
1:LEU_77:HN          1:ALA_79:HN           -1.000    5.195    3.996  50.000   50.000 1000.000 
1:ALA_78:HN          1:LYX_76:HN           -1.000    6.162    4.740  50.000   50.000 1000.000 
1:ALA_78:HN          1:TYR_80:HN           -1.000    6.046    4.651  50.000   50.000 1000.000 
1:TYR_80:HN          1:GLN_82:HN           -1.000    6.228    4.791  50.000   50.000 1000.000 
1:VAX_81:HN          1:GLX_83:HN           -1.000    6.100    4.692  50.000   50.000 1000.000 
1:GLX_84:HN          1:GLN_82:HN           -1.000    5.498    4.229  50.000   50.000 1000.000 
1:LEU_10:HN          1:GLY_58:HN           -1.000    5.311    4.085  50.000   50.000 1000.000 
1:GLX_25:HN          1:VAL_23:HN           -1.000    5.753    4.425  50.000   50.000 1000.000 
1:GLY_39:HN          1:LYX_37:HN           -1.000    5.502    4.232  50.000   50.000 1000.000 
1:SER_52:HN          1:GLY_49:HN           -1.000    5.925    4.558  50.000   50.000 1000.000 
1:GLX_68:HN          1:GLX_70:HN           -1.000    5.385    4.142  50.000   50.000 1000.000 
1:GLN_82:HN          1:LYX_11:HN           -1.000    7.094    5.457  50.000   50.000 1000.000 
1:GLN_4:HN          1:ILE_64:HG2*           -1.000    4.363    2.587  50.000   50.000 1000.000 
1:LYX_5:HN          1:LYX_5:HB1           -1.000    4.124    3.172  50.000   50.000 1000.000 
1:LYX_5:HN          1:LEU_74:HD*           -1.000    5.819    2.630  50.000   50.000 1000.000 
1:GLX_7:HN          1:THR_62:HG2*           -1.000    5.937    3.798  50.000   50.000 1000.000 
1:GLN_4:HN          1:LYX_5:HA           -1.000    5.651    4.347  50.000   50.000 1000.000 
1:GLX_7:HN          1:THR_62:HA           -1.000    5.360    4.123  50.000   50.000 1000.000 
1:VAL_61:HN          1:ARX_9:HA           -1.000    4.078    3.137  50.000   50.000 1000.000 
1:LEU_63:HN          1:VAL_8:HN           -1.000    4.492    3.455  50.000   50.000 1000.000 
1:GLY_67:HN          1:GLX_70:HN           -1.000    4.967    3.821  50.000   50.000 1000.000 
1:VAL_33:HN          1:ALA_44:HN           -1.000    6.552    5.040  50.000   50.000 1000.000 
1:VAL_33:HN          1:GLN_66:HN           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:GLN_71:HN          1:LEU_74:HN           -1.000    6.340    4.877  50.000   50.000 1000.000 
1:GLN_71:HN          1:ASX_69:HN           -1.000    6.356    4.889  50.000   50.000 1000.000 
1:GLN_71:HN          1:LEU_74:HD*           -1.000    6.504    3.157  50.000   50.000 1000.000 
1:GLN_71:HN          1:ALA_65:HB*           -1.000    8.800    6.000  50.000   50.000 1000.000 
1:GLX_72:HN          1:LEU_74:HN           -1.000    4.685    3.604  50.000   50.000 1000.000 
1:GLX_72:HN          1:LEU_74:HD*           -1.000    7.033    3.564  50.000   50.000 1000.000 
1:ALA_73:HN          1:ASX_69:HB1           -1.000    4.320    3.323  50.000   50.000 1000.000 
1:ALA_73:HN          1:GLX_72:HG*           -1.000    4.756    2.889  50.000   50.000 1000.000 
1:ALA_73:HN          1:GLX_72:HB*           -1.000    4.175    2.442  50.000   50.000 1000.000 
1:ALA_73:HN          1:ALA_65:HB*           -1.000    5.412    3.394  50.000   50.000 1000.000 
1:GLX_75:HN          1:GLX_75:HA           -1.000    3.202    2.463  50.000   50.000 1000.000 
1:GLX_75:HN          1:GLX_75:HG1           -1.000    3.834    2.949  50.000   50.000 1000.000 
1:GLX_75:HN          1:GLX_75:HG2           -1.000    4.520    3.477  50.000   50.000 1000.000 
1:GLX_75:HN          1:ALA_78:HN           -1.000    5.794    4.457  50.000   50.000 1000.000 
1:LYX_76:HN          1:TYR_80:HN           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:LYX_76:HN          1:LEU_74:HA           -1.000    5.447    4.190  50.000   50.000 1000.000 
1:LYX_76:HN          1:GLX_75:HG1           -1.000    5.537    4.259  50.000   50.000 1000.000 
1:LYX_76:HN          1:GLX_75:HG2           -1.000    5.773    4.441  50.000   50.000 1000.000 
1:LYX_76:HN          1:LYX_76:HG2           -1.000    3.549    2.730  50.000   50.000 1000.000 
1:LYX_76:HN          1:ALA_73:HB*           -1.000    5.800    3.692  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_74:HN           -1.000    6.613    5.087  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_74:HA           -1.000    4.901    3.770  50.000   50.000 1000.000 
1:ALA_78:HN          1:ALA_78:HA           -1.000    3.713    2.856  50.000   50.000 1000.000 
1:ALA_79:HN          1:LYX_76:HN           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:ALA_79:HN          1:ALA_79:HA           -1.000    3.166    2.435  50.000   50.000 1000.000 
1:ALA_79:HN          1:TYR_80:HB2           -1.000    4.857    3.736  50.000   50.000 1000.000 
1:ALA_79:HN          1:TYR_80:HB1           -1.000    4.759    3.661  50.000   50.000 1000.000 
1:ALA_79:HN          1:LEU_77:HD2*           -1.000    6.509    4.238  50.000   50.000 1000.000 
1:TYR_80:HN          1:ALA_78:HA           -1.000    5.002    3.848  50.000   50.000 1000.000 
1:VAX_81:HN          1:ALA_79:HN           -1.000    5.773    4.441  50.000   50.000 1000.000 
1:VAX_81:HN          1:ALA_79:HB*           -1.000    7.093    4.687  50.000   50.000 1000.000 
1:VAX_81:HN          1:LEU_14:HD*           -1.000    8.644    4.803  50.000   50.000 1000.000 
1:VAX_81:HN          1:LEU_77:HD2*           -1.000    7.201    4.770  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HE21           -1.000    4.892    3.763  50.000   50.000 1000.000 
1:GLN_82:HN          1:VAL_8:HG2*           -1.000    4.965    3.050  50.000   50.000 1000.000 
1:GLX_83:HN          1:GLN_82:HB1           -1.000    4.818    3.706  50.000   50.000 1000.000 
1:GLX_84:HN          1:VAX_81:HG*           -1.000    8.717    4.859  50.000   50.000 1000.000 
1:ALA_16:HN          1:PRO_18:HG2           -1.000    4.298    3.306  50.000   50.000 1000.000 
1:ALA_19:HN          1:PHE_22:HN           -1.000    4.817    3.705  50.000   50.000 1000.000 
1:ALA_19:HN          1:LEU_14:HA           -1.000    5.326    4.097  50.000   50.000 1000.000 
1:ALA_20:HN          1:ALA_16:HN           -1.000    5.777    4.444  50.000   50.000 1000.000 
1:PHE_22:HN          1:VAL_23:HN           -1.000    3.345    2.573  50.000   50.000 1000.000 
1:PHE_22:HN          1:LEU_21:HN           -1.000    3.770    2.900  50.000   50.000 1000.000 
1:GLN_24:HN          1:PHE_22:HN           -1.000    5.707    4.390  50.000   50.000 1000.000 
1:GLN_24:HN          1:GLN_24:HA           -1.000    3.368    2.591  50.000   50.000 1000.000 
1:GLN_24:HN          1:LEU_77:HD2*           -1.000    6.377    4.136  50.000   50.000 1000.000 
1:GLX_25:HN          1:GLX_25:HA           -1.000    3.503    2.695  50.000   50.000 1000.000 
1:GLX_25:HN          1:PHE_22:HA           -1.000    4.424    3.403  50.000   50.000 1000.000 
1:GLX_25:HN          1:GLN_24:HG1           -1.000    5.794    4.457  50.000   50.000 1000.000 
1:GLX_25:HN          1:GLX_25:HG2           -1.000    4.024    3.095  50.000   50.000 1000.000 
1:ALA_26:HN          1:ALA_26:HA           -1.000    3.868    2.975  50.000   50.000 1000.000 
1:ALA_26:HN          1:VAL_23:HA           -1.000    4.341    3.339  50.000   50.000 1000.000 
1:ALA_26:HN          1:PHE_22:HA           -1.000    5.181    3.985  50.000   50.000 1000.000 
1:ASN_27:HN          1:ALA_26:HA           -1.000    3.868    2.975  50.000   50.000 1000.000 
1:ASN_27:HN          1:VAL_23:HA           -1.000    5.837    4.490  50.000   50.000 1000.000 
1:ASN_27:HN          1:ARX_28:HB2           -1.000    5.572    4.286  50.000   50.000 1000.000 
1:ARX_28:HN          1:PHE_29:HB1           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:GLN_24:HN          1:LEU_21:HA           -1.000    4.040    3.108  50.000   50.000 1000.000 
1:ALA_78:HN          1:GLX_75:HA           -1.000    3.962    3.048  50.000   50.000 1000.000 
1:GLX_83:HN          1:TYR_80:HA           -1.000    4.430    3.408  50.000   50.000 1000.000 
1:LEU_86:HN          1:LEU_86:HA           -1.000    3.589    2.761  50.000   50.000 1000.000 
1:GLY_49:HN          1:MET_48:HA           -1.000    5.114    3.934  50.000   50.000 1000.000 
1:LEU_50:HN          1:SER_46:HA           -1.000    4.974    3.826  50.000   50.000 1000.000 
1:LEU_50:HN          1:MET_48:HA           -1.000    5.377    4.136  50.000   50.000 1000.000 
1:MET_51:HN          1:MET_51:HA           -1.000    3.706    2.851  50.000   50.000 1000.000 
1:MET_51:HN          1:MET_48:HA           -1.000    3.974    3.057  50.000   50.000 1000.000 
1:MET_51:HN          1:GLY_49:HN           -1.000    4.181    3.216  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_53:HN           -1.000    6.713    5.164  50.000   50.000 1000.000 
1:SER_52:HN          1:MET_51:HB1           -1.000    5.892    4.532  50.000   50.000 1000.000 
1:LEU_53:HN          1:SER_52:HB1           -1.000    4.581    3.524  50.000   50.000 1000.000 
1:LEU_53:HN          1:SER_52:HB2           -1.000    4.298    3.306  50.000   50.000 1000.000 
1:ALA_54:HN          1:MET_51:HN           -1.000    7.090    5.454  50.000   50.000 1000.000 
1:ALA_54:HN          1:LEU_53:HA           -1.000    3.721    2.862  50.000   50.000 1000.000 
1:SER_56:HN          1:THR_57:HN           -1.000    7.296    5.612  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_66:HB2           -1.000    4.679    3.599  50.000   50.000 1000.000 
1:LYX_5:HN          1:VAL_6:HA           -1.000    5.352    4.117  50.000   50.000 1000.000 
1:VAL_8:HN          1:ARX_9:HA           -1.000    6.024    4.634  50.000   50.000 1000.000 
1:VAL_8:HN          1:GLX_60:HB1           -1.000    6.843    5.264  50.000   50.000 1000.000 
1:VAL_8:HN          1:THR_62:HG2*           -1.000    6.043    3.879  50.000   50.000 1000.000 
1:LEU_10:HN          1:GLX_60:HA           -1.000    4.068    3.129  50.000   50.000 1000.000 
1:LYX_11:HN          1:VAX_81:HA           -1.000    5.403    4.156  50.000   50.000 1000.000 
1:LYX_11:HN          1:VAX_81:HB           -1.000    6.934    5.334  50.000   50.000 1000.000 
1:LYX_11:HN          1:LEU_10:HB*           -1.000    6.699    4.384  50.000   50.000 1000.000 
1:LYX_11:HN          1:THR_12:HG2*           -1.000    6.916    4.551  50.000   50.000 1000.000 
1:LYX_11:HN          1:VAX_81:HG*           -1.000    6.885    3.450  50.000   50.000 1000.000 
1:THR_12:HN          1:LYX_11:HB2           -1.000    5.841    4.493  50.000   50.000 1000.000 
1:GLY_13:HN          1:GLY_13:HA2           -1.000    3.688    2.837  50.000   50.000 1000.000 
1:GLN_15:HN          1:LEU_14:HA           -1.000    3.400    2.615  50.000   50.000 1000.000 
1:GLN_15:HN          1:GLN_15:HA           -1.000    3.517    2.705  50.000   50.000 1000.000 
1:GLN_15:HN          1:LEU_14:HB1           -1.000    4.341    3.339  50.000   50.000 1000.000 
1:PHE_29:HN          1:ARX_28:HD*           -1.000    6.945    4.573  50.000   50.000 1000.000 
1:PHE_29:HN          1:ASN_27:HB*           -1.000    7.215    4.781  50.000   50.000 1000.000 
1:THR_30:HN          1:SER_31:HG           -1.000    5.001    3.847  50.000   50.000 1000.000 
1:THR_30:HN          1:GLX_68:HG*           -1.000    6.966    4.589  50.000   50.000 1000.000 
1:THR_30:HN          1:GLX_68:HB*           -1.000    6.337    4.105  50.000   50.000 1000.000 
1:THR_30:HN          1:ALA_73:HB*           -1.000    6.123    3.941  50.000   50.000 1000.000 
1:SER_31:HN          1:SER_31:HG           -1.000    3.640    2.800  50.000   50.000 1000.000 
1:SER_31:HN          1:GLY_67:HA1           -1.000    4.789    3.684  50.000   50.000 1000.000 
1:ASX_32:HN          1:SER_31:HA           -1.000    3.203    2.464  50.000   50.000 1000.000 
1:ASX_32:HN          1:ASX_32:HA           -1.000    4.198    3.229  50.000   50.000 1000.000 
1:ASX_32:HN          1:GLY_67:HA2           -1.000    3.983    3.064  50.000   50.000 1000.000 
1:ASX_32:HN          1:SER_31:HB1           -1.000    3.939    3.030  50.000   50.000 1000.000 
1:ASX_32:HN          1:SER_31:HB2           -1.000    4.094    3.149  50.000   50.000 1000.000 
1:ASX_32:HN          1:ASX_32:HB1           -1.000    3.995    3.073  50.000   50.000 1000.000 
1:ASX_32:HN          1:ASX_32:HB2           -1.000    3.740    2.877  50.000   50.000 1000.000 
1:VAL_33:HN          1:SER_31:HA           -1.000    5.387    4.144  50.000   50.000 1000.000 
1:PHE_34:HN          1:ILE_64:HA           -1.000    4.802    3.694  50.000   50.000 1000.000 
1:PHE_34:HN          1:ASN_43:HA           -1.000    5.225    4.019  50.000   50.000 1000.000 
1:PHE_34:HN          1:LEU_63:HD*           -1.000    6.625    3.250  50.000   50.000 1000.000 
1:PHE_34:HN          1:VAL_33:HG1*           -1.000    4.553    2.733  50.000   50.000 1000.000 
1:PHE_34:HN          1:VAL_33:HG2*           -1.000    4.505    2.696  50.000   50.000 1000.000 
1:LEU_35:HN          1:ALA_44:HN           -1.000    4.554    3.503  50.000   50.000 1000.000 
1:LEU_35:HN          1:ASN_43:HA           -1.000    4.785    3.681  50.000   50.000 1000.000 
1:LEU_35:HN          1:LYX_41:HB1           -1.000    4.923    3.787  50.000   50.000 1000.000 
1:LEU_35:HN          1:LEU_35:HB1           -1.000    5.762    4.432  50.000   50.000 1000.000 
1:LEU_35:HN          1:LEU_35:HB2           -1.000    3.457    2.659  50.000   50.000 1000.000 
1:LEU_35:HN          1:LYX_41:HG2           -1.000    4.520    3.477  50.000   50.000 1000.000 
1:LEU_35:HN          1:LEU_35:HD*           -1.000    5.845    2.650  50.000   50.000 1000.000 
1:GLX_36:HN          1:THR_62:HA           -1.000    4.840    3.723  50.000   50.000 1000.000 
1:GLX_36:HN          1:THR_62:HB           -1.000    4.430    3.408  50.000   50.000 1000.000 
1:GLX_36:HN          1:GLX_36:HG2           -1.000    4.412    3.394  50.000   50.000 1000.000 
1:GLX_36:HN          1:LEU_35:HB2           -1.000    4.287    3.298  50.000   50.000 1000.000 
1:GLX_36:HN          1:LEU_35:HG           -1.000    4.234    3.257  50.000   50.000 1000.000 
1:GLX_36:HN          1:LEU_35:HD*           -1.000    6.314    3.011  50.000   50.000 1000.000 
1:GLX_36:HN          1:VAL_61:HG2*           -1.000    4.812    2.932  50.000   50.000 1000.000 
1:LYX_37:HN          1:LYX_41:HN           -1.000    4.520    3.477  50.000   50.000 1000.000 
1:LYX_37:HN          1:LYX_37:HB1           -1.000    3.275    2.519  50.000   50.000 1000.000 
1:LYX_37:HN          1:GLX_36:HB1           -1.000    4.947    3.805  50.000   50.000 1000.000 
1:LYX_37:HN          1:LYX_37:HG2           -1.000    4.100    3.154  50.000   50.000 1000.000 
1:ASX_38:HN          1:LYX_37:HB1           -1.000    5.745    4.419  50.000   50.000 1000.000 
1:ASX_38:HN          1:LYX_37:HB2           -1.000    5.565    4.281  50.000   50.000 1000.000 
1:GLY_39:HN          1:LYX_37:HA           -1.000    4.832    3.717  50.000   50.000 1000.000 
1:GLY_39:HN          1:ASX_38:HA           -1.000    3.756    2.889  50.000   50.000 1000.000 
1:GLY_39:HN          1:GLY_39:HA1           -1.000    3.384    2.603  50.000   50.000 1000.000 
1:GLY_39:HN          1:GLY_39:HA2           -1.000    3.311    2.547  50.000   50.000 1000.000 
1:LYX_40:HN          1:ASX_38:HA           -1.000    4.901    3.770  50.000   50.000 1000.000 
1:LYX_40:HN          1:ASX_38:HB2           -1.000    5.128    3.945  50.000   50.000 1000.000 
1:LYX_41:HN          1:GLY_39:HN           -1.000    6.149    4.730  50.000   50.000 1000.000 
1:LYX_41:HN          1:GLX_36:HA           -1.000    4.696    3.612  50.000   50.000 1000.000 
1:LYX_41:HN          1:LYX_41:HB2           -1.000    3.501    2.693  50.000   50.000 1000.000 
1:VAL_42:HN          1:GLX_36:HA           -1.000    4.335    3.335  50.000   50.000 1000.000 
1:VAL_42:HN          1:PHE_34:HB1           -1.000    4.966    3.820  50.000   50.000 1000.000 
1:VAL_42:HN          1:PHE_34:HB2           -1.000    6.370    4.900  50.000   50.000 1000.000 
1:VAL_42:HN          1:GLX_36:HG2           -1.000    4.576    3.520  50.000   50.000 1000.000 
1:VAL_42:HN          1:LYX_41:HB1           -1.000    4.303    3.310  50.000   50.000 1000.000 
1:VAL_42:HN          1:LYX_41:HB2           -1.000    4.124    3.172  50.000   50.000 1000.000 
1:VAL_42:HN          1:VAL_42:HG1*           -1.000    4.587    2.759  50.000   50.000 1000.000 
1:ASN_43:HN          1:ASN_43:HD21           -1.000    4.645    3.573  50.000   50.000 1000.000 
1:ALA_44:HN          1:PHE_34:HB2           -1.000    5.431    4.178  50.000   50.000 1000.000 
1:LYX_45:HN          1:PHE_34:HA           -1.000    5.395    4.150  50.000   50.000 1000.000 
1:LYX_45:HN          1:ALA_44:HB*           -1.000    4.770    2.900  50.000   50.000 1000.000 
1:SER_46:HN          1:ASN_43:HB2           -1.000    5.641    4.339  50.000   50.000 1000.000 
1:ILE_47:HN          1:VAL_23:HG1*           -1.000    6.498    4.229  50.000   50.000 1000.000 
1:MET_48:HN          1:MET_51:HN           -1.000    5.987    4.605  50.000   50.000 1000.000 
1:MET_48:HN          1:ILE_47:HB           -1.000    3.774    2.903  50.000   50.000 1000.000 
1:MET_48:HN          1:ILE_47:HG12           -1.000    4.856    3.735  50.000   50.000 1000.000 
1:LEU_50:HN          1:VAL_23:HG1*           -1.000    6.777    4.444  50.000   50.000 1000.000 
1:LEU_50:HN          1:ILE_47:HD1*           -1.000    6.987    4.605  50.000   50.000 1000.000 
1:LEU_50:HN          1:LEU_50:HD1*           -1.000    4.936    3.028  50.000   50.000 1000.000 
1:LEU_50:HN          1:LEU_50:HD2*           -1.000    4.865    2.973  50.000   50.000 1000.000 
1:LEU_50:HN          1:LEU_14:HD*           -1.000    7.664    4.049  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_50:HB1           -1.000    3.988    3.068  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_50:HD1*           -1.000    5.239    3.261  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_50:HD2*           -1.000    5.313    3.318  50.000   50.000 1000.000 
1:LEU_53:HN          1:LEU_53:HD1*           -1.000    4.437    2.644  50.000   50.000 1000.000 
1:LEU_53:HN          1:LEU_53:HD2*           -1.000    4.424    2.634  50.000   50.000 1000.000 
1:ALA_54:HN          1:LEU_53:HD2*           -1.000    4.906    3.005  50.000   50.000 1000.000 
1:GLY_58:HN          1:LYX_11:HA           -1.000    4.352    3.348  50.000   50.000 1000.000 
1:GLY_58:HN          1:GLY_58:HA1           -1.000    3.511    2.701  50.000   50.000 1000.000 
1:GLY_58:HN          1:THR_59:HB           -1.000    5.492    4.225  50.000   50.000 1000.000 
1:GLY_58:HN          1:THR_57:HA           -1.000    3.348    2.575  50.000   50.000 1000.000 
1:GLY_58:HN          1:GLY_58:HA2           -1.000    2.998    2.306  50.000   50.000 1000.000 
1:GLY_58:HN          1:GLY_13:HA2           -1.000    5.630    4.331  50.000   50.000 1000.000 
1:GLY_58:HN          1:ARX_9:HG2           -1.000    4.963    3.818  50.000   50.000 1000.000 
1:THR_59:HN          1:ARX_9:HA           -1.000    5.513    4.241  50.000   50.000 1000.000 
1:THR_59:HN          1:THR_59:HA           -1.000    3.693    2.841  50.000   50.000 1000.000 
1:THR_59:HN          1:GLY_58:HA1           -1.000    3.756    2.889  50.000   50.000 1000.000 
1:THR_59:HN          1:ARX_9:HG1           -1.000    5.056    3.889  50.000   50.000 1000.000 
1:GLX_60:HN          1:GLX_60:HG1           -1.000    3.572    2.748  50.000   50.000 1000.000 
1:GLX_60:HN          1:GLX_60:HB2           -1.000    3.388    2.606  50.000   50.000 1000.000 
1:GLX_60:HN          1:GLX_60:HG2           -1.000    3.329    2.561  50.000   50.000 1000.000 
1:GLX_60:HN          1:VAL_61:HG1*           -1.000    5.078    3.137  50.000   50.000 1000.000 
1:LEU_63:HN          1:THR_62:HA           -1.000    3.349    2.576  50.000   50.000 1000.000 
1:LEU_63:HN          1:LYX_5:HB2           -1.000    5.550    4.269  50.000   50.000 1000.000 
1:LEU_63:HN          1:LYX_5:HB1           -1.000    5.221    4.016  50.000   50.000 1000.000 
1:LEU_63:HN          1:LEU_63:HG           -1.000    4.485    3.450  50.000   50.000 1000.000 
1:ILE_64:HN          1:GLX_36:HN           -1.000    5.920    4.554  50.000   50.000 1000.000 
1:ILE_64:HN          1:PHE_34:HB1           -1.000    5.513    4.241  50.000   50.000 1000.000 
1:ILE_64:HN          1:ALA_65:HB*           -1.000    6.183    3.987  50.000   50.000 1000.000 
1:ILE_64:HN          1:LEU_63:HD*           -1.000    6.084    2.834  50.000   50.000 1000.000 
1:ILE_64:HN          1:LEU_35:HD*           -1.000    6.475    3.135  50.000   50.000 1000.000 
1:ALA_65:HN          1:LYX_5:HB1           -1.000    5.577    4.290  50.000   50.000 1000.000 
1:ALA_65:HN          1:ILE_64:HG2*           -1.000    4.439    2.645  50.000   50.000 1000.000 
1:GLY_67:HN          1:SER_31:HB1           -1.000    5.833    4.487  50.000   50.000 1000.000 
1:GLY_67:HN          1:ALA_65:HB*           -1.000    5.867    3.744  50.000   50.000 1000.000 
1:GLY_67:HN          1:VAL_33:HG2*           -1.000    5.761    3.662  50.000   50.000 1000.000 
1:GLX_68:HN          1:ASX_32:HN           -1.000    5.466    4.205  50.000   50.000 1000.000 
1:GLX_68:HN          1:GLY_67:HA1           -1.000    3.519    2.707  50.000   50.000 1000.000 
1:GLX_68:HN          1:SER_31:HA           -1.000    4.763    3.664  50.000   50.000 1000.000 
1:GLX_68:HN          1:GLY_67:HA2           -1.000    3.591    2.762  50.000   50.000 1000.000 
1:GLX_68:HN          1:THR_30:HG2*           -1.000    5.750    3.654  50.000   50.000 1000.000 
1:ASX_69:HN          1:SER_31:HA           -1.000    5.837    4.490  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLY_67:HA2           -1.000    4.798    3.691  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLX_68:HG*           -1.000    4.825    2.942  50.000   50.000 1000.000 
1:ASX_69:HN          1:GLX_68:HB*           -1.000    4.396    2.612  50.000   50.000 1000.000 
1:ASX_69:HN          1:THR_30:HG2*           -1.000    5.471    3.439  50.000   50.000 1000.000 
1:ASX_69:HN          1:ALA_73:HB*           -1.000    5.653    3.579  50.000   50.000 1000.000 
1:GLX_70:HN          1:SER_31:HB1           -1.000    5.568    4.283  50.000   50.000 1000.000 
1:GLX_70:HN          1:ASX_69:HB1           -1.000    5.483    4.218  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLX_70:HB1           -1.000    3.533    2.718  50.000   50.000 1000.000 
1:GLX_70:HN          1:ALA_65:HB*           -1.000    5.376    3.366  50.000   50.000 1000.000 
1:GLX_70:HN          1:LEU_74:HD*           -1.000    6.920    3.477  50.000   50.000 1000.000 
1:GLX_70:HN          1:ALA_73:HB*           -1.000    6.087    3.913  50.000   50.000 1000.000 
1:GLN_15:HE22          1:GLN_15:HG*           -1.000    4.813    2.933  50.000   50.000 1000.000 
1:GLN_15:HE22          1:GLN_15:HB*           -1.000    7.046    4.651  50.000   50.000 1000.000 
1:GLN_15:HE22          1:THR_57:HG2*           -1.000    6.203    4.002  50.000   50.000 1000.000 
1:GLN_15:HE22          1:GLN_15:HA           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:GLN_24:HE22          1:GLN_24:HA           -1.000    5.131    3.947  50.000   50.000 1000.000 
1:GLN_24:HE22          1:LYX_76:HE*           -1.000    6.902    4.540  50.000   50.000 1000.000 
1:GLN_24:HE22          1:GLN_24:HG1           -1.000    3.621    2.785  50.000   50.000 1000.000 
1:GLN_24:HE21          1:GLN_24:HG1           -1.000    4.705    3.619  50.000   50.000 1000.000 
1:GLN_24:HE21          1:GLN_24:HG2           -1.000    4.258    3.275  50.000   50.000 1000.000 
1:GLN_24:HE21          1:GLN_24:HB*           -1.000    5.713    3.625  50.000   50.000 1000.000 
1:GLN_24:HE21          1:LEU_21:HD2*           -1.000    5.477    3.444  50.000   50.000 1000.000 
1:GLN_66:HE21          1:GLN_66:HA           -1.000    7.523    5.787  50.000   50.000 1000.000 
1:GLN_66:HE21          1:GLN_66:HB2           -1.000    4.689    3.607  50.000   50.000 1000.000 
1:GLN_71:HE22          1:GLN_71:HG*           -1.000    4.440    2.646  50.000   50.000 1000.000 
1:GLN_71:HE22          1:GLN_4:HB*           -1.000    5.131    3.178  50.000   50.000 1000.000 
1:GLN_71:HE22          1:GLN_71:HB*           -1.000    4.912    3.009  50.000   50.000 1000.000 
1:GLN_71:HE22          1:VAL_6:HG2*           -1.000    6.257    4.044  50.000   50.000 1000.000 
1:GLN_71:HE22          1:LEU_74:HB2           -1.000    5.911    4.547  50.000   50.000 1000.000 
1:GLN_71:HE22          1:LEU_74:HD*           -1.000    6.320    3.015  50.000   50.000 1000.000 
1:GLN_71:HE21          1:GLX_72:HA           -1.000    4.273    3.287  50.000   50.000 1000.000 
1:GLN_71:HE21          1:GLN_71:HG*           -1.000    4.275    2.519  50.000   50.000 1000.000 
1:GLN_71:HE21          1:GLN_4:HB*           -1.000    5.040    3.108  50.000   50.000 1000.000 
1:GLN_71:HE21          1:VAL_6:HG2*           -1.000    6.171    3.978  50.000   50.000 1000.000 
1:GLN_71:HE21          1:LEU_74:HB2           -1.000    6.440    4.954  50.000   50.000 1000.000 
1:GLN_71:HE21          1:LEU_74:HD*           -1.000    6.273    2.979  50.000   50.000 1000.000 
1:GLN_82:HE22          1:ALA_79:HA           -1.000    6.053    4.656  50.000   50.000 1000.000 
1:GLN_82:HE22          1:GLN_82:HG1           -1.000    4.936    3.797  50.000   50.000 1000.000 
1:GLN_82:HE22          1:GLN_82:HG2           -1.000    5.282    4.063  50.000   50.000 1000.000 
1:GLN_82:HE22          1:GLN_82:HB1           -1.000    5.351    4.116  50.000   50.000 1000.000 
1:GLN_82:HE22          1:GLN_82:HB2           -1.000    4.649    3.576  50.000   50.000 1000.000 
1:GLN_82:HE22          1:VAL_8:HB           -1.000    5.837    4.490  50.000   50.000 1000.000 
1:GLN_82:HE22          1:ALA_79:HB*           -1.000    6.976    4.597  50.000   50.000 1000.000 
1:GLN_82:HE22          1:ALA_78:HB*           -1.000    5.645    3.573  50.000   50.000 1000.000 
1:GLN_82:HE22          1:VAX_81:HG*           -1.000    8.181    4.447  50.000   50.000 1000.000 
1:GLN_82:HE22          1:VAL_8:HG1*           -1.000    5.229    3.253  50.000   50.000 1000.000 
1:GLN_82:HE22          1:VAL_8:HG2*           -1.000    5.464    3.434  50.000   50.000 1000.000 
1:GLN_82:HE21          1:ALA_79:HA           -1.000    5.762    4.432  50.000   50.000 1000.000 
1:GLN_82:HE21          1:GLN_82:HG1           -1.000    4.313    3.318  50.000   50.000 1000.000 
1:GLN_82:HE21          1:GLN_82:HG2           -1.000    4.638    3.568  50.000   50.000 1000.000 
1:GLN_82:HE21          1:GLN_82:HB1           -1.000    4.014    3.088  50.000   50.000 1000.000 
1:GLN_82:HE21          1:GLN_82:HB2           -1.000    4.243    3.264  50.000   50.000 1000.000 
1:GLN_82:HE21          1:VAL_8:HB           -1.000    4.556    3.505  50.000   50.000 1000.000 
1:GLN_82:HE21          1:ALA_79:HB*           -1.000    6.053    3.887  50.000   50.000 1000.000 
1:GLN_82:HE21          1:ALA_78:HB*           -1.000    5.263    3.279  50.000   50.000 1000.000 
1:GLN_82:HE21          1:VAX_81:HG*           -1.000    7.447    3.882  50.000   50.000 1000.000 
1:GLN_82:HE21          1:VAL_8:HG1*           -1.000    5.394    3.380  50.000   50.000 1000.000 
1:GLN_82:HE21          1:VAL_8:HG2*           -1.000    5.388    3.375  50.000   50.000 1000.000 
1:GLNC_87:HE22          1:GLNC_87:HG*           -1.000    4.774    2.903  50.000   50.000 1000.000 
1:GLNC_87:HE22          1:GLNC_87:HB1           -1.000    4.948    3.806  50.000   50.000 1000.000 
1:GLNC_87:HE22          1:GLNC_87:HB2           -1.000    5.013    3.856  50.000   50.000 1000.000 
1:GLNC_87:HE22          1:LEU_86:HG           -1.000    5.717    4.398  50.000   50.000 1000.000 
1:GLNC_87:HE21          1:GLNC_87:HG*           -1.000    4.563    2.741  50.000   50.000 1000.000 
1:GLNC_87:HE21          1:GLNC_87:HB1           -1.000    4.520    3.477  50.000   50.000 1000.000 
1:GLNC_87:HE21          1:GLNC_87:HB2           -1.000    5.050    3.885  50.000   50.000 1000.000 
1:GLNC_87:HE21          1:LEU_86:HG           -1.000    5.981    4.601  50.000   50.000 1000.000 
1:ASN_27:HD22          1:GLN_24:HA           -1.000    5.955    4.581  50.000   50.000 1000.000 
1:ASN_27:HD22          1:ASN_27:HB*           -1.000    5.412    3.394  50.000   50.000 1000.000 
1:ASN_27:HD22          1:ALA_26:HB*           -1.000    6.987    4.605  50.000   50.000 1000.000 
1:ASN_27:HD22          1:VAL_23:HG2*           -1.000    5.263    3.279  50.000   50.000 1000.000 
1:ASN_27:HD21          1:GLN_24:HA           -1.000    6.494    4.995  50.000   50.000 1000.000 
1:ASN_27:HD21          1:ASN_27:HB*           -1.000    5.258    3.275  50.000   50.000 1000.000 
1:ASN_27:HD21          1:ALA_26:HB*           -1.000    7.623    5.095  50.000   50.000 1000.000 
1:ASN_27:HD21          1:VAL_23:HG2*           -1.000    5.211    3.239  50.000   50.000 1000.000 
1:ASN_27:HD21          1:ASN_27:HA           -1.000    6.414    4.934  50.000   50.000 1000.000 
1:ASN_27:HD21          1:GLN_24:HB*           -1.000    7.046    4.651  50.000   50.000 1000.000 
1:ASN_27:HD22          1:GLN_24:HB*           -1.000    6.288    4.068  50.000   50.000 1000.000 
1:ASN_43:HD21          1:ASN_43:HB1           -1.000    4.547    3.498  50.000   50.000 1000.000 
1:ASN_43:HD21          1:ASN_43:HB2           -1.000    4.536    3.489  50.000   50.000 1000.000 
1:ASN_43:HD22          1:ASN_43:HB1           -1.000    4.923    3.787  50.000   50.000 1000.000 
1:ASN_43:HD22          1:ASN_43:HB2           -1.000    4.902    3.771  50.000   50.000 1000.000 
1:LEU_10:HN          1:GLX_60:HN           -1.000    5.651    4.347  50.000   50.000 1000.000 
1:LEU_10:HN          1:LYX_11:HN           -1.000    4.437    3.413  50.000   50.000 1000.000 
1:LEU_10:HN          1:THR_59:HB           -1.000    6.504    5.003  50.000   50.000 1000.000 
1:LEU_10:HN          1:GLN_82:HA           -1.000    6.228    4.791  50.000   50.000 1000.000 
1:THR_12:HN          1:LYX_11:HE1           -1.000    5.950    4.577  50.000   50.000 1000.000 
1:GLY_13:HN          1:THR_12:HN           -1.000    6.279    4.830  50.000   50.000 1000.000 
1:GLY_13:HN          1:THR_57:HG2*           -1.000    5.399    3.384  50.000   50.000 1000.000 
1:LEU_14:HN          1:THR_57:HN           -1.000    5.168    3.975  50.000   50.000 1000.000 
1:GLN_15:HN          1:PRO_18:HD2           -1.000    5.897    4.536  50.000   50.000 1000.000 
1:GLN_15:HN          1:GLY_13:HA2           -1.000    5.534    4.257  50.000   50.000 1000.000 
1:GLN_15:HN          1:PRO_18:HG1           -1.000    4.922    3.786  50.000   50.000 1000.000 
1:ARX_17:HN          1:LEU_50:HD2*           -1.000    6.859    4.507  50.000   50.000 1000.000 
1:ALA_19:HN          1:PRO_18:HB*           -1.000    5.724    3.634  50.000   50.000 1000.000 
1:ALA_26:HN          1:ASN_27:HA           -1.000    5.472    4.209  50.000   50.000 1000.000 
1:ARX_28:HN          1:LEU_77:HD2*           -1.000    6.459    4.199  50.000   50.000 1000.000 
1:THR_30:HN          1:VAL_33:HG2*           -1.000    6.749    4.422  50.000   50.000 1000.000 
1:SER_31:HN          1:VAL_33:HG2*           -1.000    6.365    4.127  50.000   50.000 1000.000 
1:ALA_44:HN          1:PHE_34:HN           -1.000    5.859    4.507  50.000   50.000 1000.000 
1:ALA_44:HN          1:VAL_42:HA           -1.000    5.200    4.000  50.000   50.000 1000.000 
1:LYX_45:HN          1:ASN_43:HD22           -1.000    5.459    4.199  50.000   50.000 1000.000 
1:LYX_45:HN          1:LYX_45:HE*           -1.000    6.408    4.160  50.000   50.000 1000.000 
1:LYX_45:HN          1:LYX_45:HG*           -1.000    4.000    2.691  50.000   50.000 1000.000 
1:SER_46:HN          1:LYX_45:HD1           -1.000    5.162    3.971  50.000   50.000 1000.000 
1:SER_46:HN          1:VAL_23:HG1*           -1.000    5.555    3.504  50.000   50.000 1000.000 
1:GLY_49:HN          1:ILE_47:HD1*           -1.000    6.492    4.225  50.000   50.000 1000.000 
1:LEU_50:HN          1:MET_51:HB1           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:LEU_50:HN          1:LEU_50:HB1           -1.000    3.507    2.698  50.000   50.000 1000.000 
1:GLY_49:HN          1:MET_48:HN           -1.000    3.561    2.739  50.000   50.000 1000.000 
1:MET_51:HN          1:LEU_14:HD*           -1.000    8.518    4.706  50.000   50.000 1000.000 
1:SER_52:HN          1:LEU_50:HB2           -1.000    4.830    3.715  50.000   50.000 1000.000 
1:ALA_54:HN          1:LEU_14:HD*           -1.000    8.081    4.370  50.000   50.000 1000.000 
1:VAX_55:HN          1:LEU_10:HG           -1.000    5.677    4.367  50.000   50.000 1000.000 
1:VAX_55:HN          1:LEU_14:HD*           -1.000    6.837    3.413  50.000   50.000 1000.000 
1:SER_56:HN          1:GLY_13:HA1           -1.000    6.946    5.343  50.000   50.000 1000.000 
1:SER_56:HN          1:VAX_55:HB           -1.000    5.997    4.613  50.000   50.000 1000.000 
1:SER_56:HN          1:LEU_53:HB1           -1.000    7.445    5.727  50.000   50.000 1000.000 
1:SER_56:HN          1:LEU_14:HD*           -1.000    8.107    4.390  50.000   50.000 1000.000 
1:THR_57:HN          1:VAX_55:HG*           -1.000    6.877    3.444  50.000   50.000 1000.000 
1:GLY_58:HN          1:SER_56:HA           -1.000    6.552    5.040  50.000   50.000 1000.000 
1:THR_59:HN          1:GLX_60:HA           -1.000    6.111    4.701  50.000   50.000 1000.000 
1:THR_59:HN          1:LEU_10:HB*           -1.000    5.044    3.111  50.000   50.000 1000.000 
1:THR_59:HN          1:ARX_9:HG2           -1.000    4.596    3.535  50.000   50.000 1000.000 
1:THR_59:HN          1:ARX_9:HB*           -1.000    5.911    3.778  50.000   50.000 1000.000 
1:GLX_60:HN          1:LYX_37:HE*           -1.000    6.868    4.514  50.000   50.000 1000.000 
1:PHE_22:HN          1:GLX_25:HN           -1.000    6.076    4.674  50.000   50.000 1000.000 
1:PHE_22:HN          1:PHE_22:HD*           -1.000    5.471    3.439  50.000   50.000 1000.000 
1:PHE_22:HN          1:LEU_21:HB2           -1.000    3.930    3.023  50.000   50.000 1000.000 
1:GLN_24:HN          1:PHE_22:HD*           -1.000    6.156    3.966  50.000   50.000 1000.000 
1:GLN_24:HN          1:GLN_24:HE22           -1.000    6.715    5.165  50.000   50.000 1000.000 
1:GLN_24:HN          1:PHE_22:HA           -1.000    5.987    4.605  50.000   50.000 1000.000 
1:GLN_24:HN          1:PHE_22:HB1           -1.000    6.484    4.988  50.000   50.000 1000.000 
1:GLX_25:HN          1:PHE_22:HD*           -1.000    6.253    4.041  50.000   50.000 1000.000 
1:GLX_25:HN          1:VAL_23:HA           -1.000    5.665    4.358  50.000   50.000 1000.000 
1:GLX_25:HN          1:PHE_22:HB1           -1.000    5.703    4.387  50.000   50.000 1000.000 
1:GLX_25:HN          1:ASN_27:HB*           -1.000    7.799    5.230  50.000   50.000 1000.000 
1:GLX_25:HN          1:LEU_77:HD1*           -1.000    7.484    4.988  50.000   50.000 1000.000 
1:ASX_69:HN          1:ALA_65:HB*           -1.000    5.536    3.489  50.000   50.000 1000.000 
1:ASX_69:HN          1:ALA_73:HN           -1.000    4.853    3.733  50.000   50.000 1000.000 
1:GLN_4:HN          1:ILE_64:HA           -1.000    4.424    3.403  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_71:HA           -1.000    5.126    3.943  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLX_70:HA           -1.000    7.138    5.491  50.000   50.000 1000.000 
1:GLN_4:HN          1:GLN_4:HB*           -1.000    4.899    2.999  50.000   50.000 1000.000 
1:LYX_5:HN          1:GLN_71:HA           -1.000    6.767    5.205  50.000   50.000 1000.000 
1:LYX_5:HN          1:GLN_3:HG2           -1.000    7.433    5.718  50.000   50.000 1000.000 
1:ARX_9:HN          1:VAL_61:HN           -1.000    5.472    4.209  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLN_82:HE21           -1.000    6.208    4.775  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLN_82:HE22           -1.000    6.053    4.656  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLX_60:HA           -1.000    4.506    3.466  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLN_82:HA           -1.000    5.348    4.114  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLN_82:HG1           -1.000    4.997    3.844  50.000   50.000 1000.000 
1:ARX_9:HN          1:GLX_60:HB1           -1.000    4.954    3.811  50.000   50.000 1000.000 
1:ARX_9:HN          1:VAX_81:HG*           -1.000    8.004    4.311  50.000   50.000 1000.000 
1:LYX_11:HN          1:LYX_11:HD*           -1.000    5.120    3.169  50.000   50.000 1000.000 
1:ALA_20:HN          1:PRO_18:HD2           -1.000    7.791    5.993  50.000   50.000 1000.000 
1:VAL_23:HN          1:VAL_23:HB           -1.000    3.457    2.659  50.000   50.000 1000.000 
1:LEU_21:HN          1:LEU_21:HB1           -1.000    2.891    2.224  50.000   50.000 1000.000 
1:GLX_25:HN          1:GLN_24:HE22           -1.000    6.356    4.889  50.000   50.000 1000.000 
1:ALA_26:HN          1:PHE_22:HB2           -1.000    7.129    5.484  50.000   50.000 1000.000 
1:ASN_27:HN          1:ASN_27:HD22           -1.000    4.718    3.629  50.000   50.000 1000.000 
1:ASN_27:HN          1:LEU_77:HD1*           -1.000    5.876    3.751  50.000   50.000 1000.000 
1:ASN_27:HN          1:LEU_77:HD2*           -1.000    6.502    4.232  50.000   50.000 1000.000 
1:VAL_33:HN          1:SER_31:HB1           -1.000    6.440    4.954  50.000   50.000 1000.000 
1:PHE_34:HN          1:PHE_34:HE*           -1.000    6.204    4.003  50.000   50.000 1000.000 
1:LEU_35:HN          1:PHE_34:HE*           -1.000    7.466    4.974  50.000   50.000 1000.000 
1:LYX_37:HN          1:LYX_40:HA           -1.000    5.707    4.390  50.000   50.000 1000.000 
1:GLY_39:HN          1:GLX_36:HA           -1.000    5.790    4.454  50.000   50.000 1000.000 
1:LYX_40:HN          1:LYX_41:HA           -1.000    5.074    3.903  50.000   50.000 1000.000 
1:LYX_40:HN          1:LYX_37:HA           -1.000    5.290    4.069  50.000   50.000 1000.000 
1:LYX_41:HN          1:LYX_40:HE*           -1.000    6.152    3.963  50.000   50.000 1000.000 
1:ALA_44:HN          1:PHE_34:HE*           -1.000    6.733    4.410  50.000   50.000 1000.000 
1:ALA_44:HN          1:PHE_34:HD*           -1.000    5.524    3.480  50.000   50.000 1000.000 
1:SER_46:HN          1:PHE_34:HA           -1.000    5.756    4.428  50.000   50.000 1000.000 
1:THR_59:HN          1:LYX_37:HE*           -1.000    6.925    4.558  50.000   50.000 1000.000 
1:THR_59:HN          1:VAL_61:HG2*           -1.000    5.633    3.564  50.000   50.000 1000.000 
1:GLX_60:HN          1:ARX_9:HA           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:GLX_60:HN          1:VAL_61:HG2*           -1.000    6.286    4.066  50.000   50.000 1000.000 
1:VAL_61:HN          1:THR_59:HA           -1.000    5.931    4.562  50.000   50.000 1000.000 
1:THR_62:HN          1:GLX_36:HA           -1.000    6.169    4.745  50.000   50.000 1000.000 
1:THR_62:HN          1:VAL_61:HB           -1.000    3.251    2.501  50.000   50.000 1000.000 
1:THR_62:HN          1:THR_62:HG2*           -1.000    5.207    3.236  50.000   50.000 1000.000 
1:LEU_63:HN          1:LYX_5:HA           -1.000    5.630    4.331  50.000   50.000 1000.000 
1:LEU_63:HN          1:THR_62:HB           -1.000    5.756    4.428  50.000   50.000 1000.000 
1:LEU_63:HN          1:LEU_63:HD*           -1.000    6.401    3.078  50.000   50.000 1000.000 
1:ILE_64:HN          1:LYX_5:HB2           -1.000    6.896    5.305  50.000   50.000 1000.000 
1:ALA_65:HN          1:PHE_34:HN           -1.000    6.976    5.366  50.000   50.000 1000.000 
1:ALA_65:HN          1:PHE_34:HE*           -1.000    8.024    5.403  50.000   50.000 1000.000 
1:ALA_65:HN          1:GLN_66:HA           -1.000    7.405    5.696  50.000   50.000 1000.000 
1:ALA_65:HN          1:ALA_73:HB*           -1.000    5.579    3.522  50.000   50.000 1000.000 
1:GLN_66:HN          1:PHE_34:HN           -1.000    5.883    4.525  50.000   50.000 1000.000 
1:GLN_66:HN          1:SER_31:HN           -1.000    5.981    4.601  50.000   50.000 1000.000 
1:GLN_66:HN          1:GLN_66:HE21           -1.000    6.271    4.824  50.000   50.000 1000.000 
1:GLN_66:HN          1:SER_31:HA           -1.000    4.606    3.543  50.000   50.000 1000.000 
1:GLN_66:HN          1:SER_31:HB1           -1.000    4.177    3.213  50.000   50.000 1000.000 
1:GLN_66:HN          1:SER_31:HB2           -1.000    4.536    3.489  50.000   50.000 1000.000 
1:GLN_66:HN          1:GLN_66:HG*           -1.000    5.347    3.344  50.000   50.000 1000.000 
1:GLN_66:HN          1:ALA_65:HB*           -1.000    4.741    2.878  50.000   50.000 1000.000 
1:GLN_66:HN          1:ILE_64:HG2*           -1.000    4.519    2.707  50.000   50.000 1000.000 
1:GLY_67:HN          1:SER_31:HB2           -1.000    6.380    4.908  50.000   50.000 1000.000 
1:GLX_68:HN          1:ASX_69:HA           -1.000    6.911    5.316  50.000   50.000 1000.000 
1:GLX_68:HN          1:SER_31:HB1           -1.000    5.521    4.247  50.000   50.000 1000.000 
1:ASX_69:HN          1:THR_30:HB           -1.000    5.765    4.435  50.000   50.000 1000.000 
1:GLX_70:HN          1:GLY_67:HA1           -1.000    6.996    4.305  50.000   50.000 1000.000 
1:GLX_70:HN          1:SER_31:HB2           -1.000    7.598    5.845  50.000   50.000 1000.000 
1:GLN_71:HN          1:GLN_71:HB*           -1.000    3.904    2.234  50.000   50.000 1000.000 
1:GLN_71:HN          1:ALA_73:HB*           -1.000    7.222    4.786  50.000   50.000 1000.000 
1:GLX_72:HN          1:GLN_71:HE22           -1.000    7.674    5.903  50.000   50.000 1000.000 
1:GLX_72:HN          1:GLX_70:HA           -1.000    5.154    3.965  50.000   50.000 1000.000 
1:GLX_72:HN          1:LEU_74:HG           -1.000    5.444    4.188  50.000   50.000 1000.000 
1:GLX_72:HN          1:ALA_65:HB*           -1.000    8.800    6.000  50.000   50.000 1000.000 
1:ALA_73:HN          1:ASX_69:HA           -1.000    5.103    3.925  50.000   50.000 1000.000 
1:LYX_76:HN          1:LYX_76:HE*           -1.000    6.385    4.142  50.000   50.000 1000.000 
1:LYX_76:HN          1:GLX_72:HG*           -1.000    7.222    4.786  50.000   50.000 1000.000 
1:LYX_76:HN          1:LEU_74:HD*           -1.000    6.703    3.310  50.000   50.000 1000.000 
1:LEU_77:HN          1:LYX_76:HB1           -1.000    3.650    2.808  50.000   50.000 1000.000 
1:LEU_77:HN          1:LYX_76:HG2           -1.000    3.836    2.951  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_77:HA           -1.000    4.068    3.129  50.000   50.000 1000.000 
1:ALA_78:HN          1:LEU_63:HD*           -1.000    6.267    2.975  50.000   50.000 1000.000 
1:TYR_80:HN          1:TYR_80:HE*           -1.000    7.325    4.865  50.000   50.000 1000.000 
1:TYR_80:HN          1:LEU_77:HD1*           -1.000    6.131    3.947  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HE22           -1.000    7.435    5.719  50.000   50.000 1000.000 
1:GLN_82:HN          1:ALA_78:HA           -1.000    6.250    4.808  50.000   50.000 1000.000 
1:GLN_82:HN          1:GLN_82:HB2           -1.000    3.505    2.696  50.000   50.000 1000.000 
1:GLX_83:HN          1:GLX_83:HB2           -1.000    3.585    2.758  50.000   50.000 1000.000 
1:GLX_83:HN          1:LYX_11:HB1           -1.000    4.623    3.556  50.000   50.000 1000.000 
1:GLX_84:HN          1:TYR_80:HE*           -1.000    7.265    4.819  50.000   50.000 1000.000 
1:VAX_85:HN          1:LYX_11:HE2           -1.000    7.800    6.000  50.000   50.000 1000.000 
1:VAX_85:HN          1:GLX_84:HG2           -1.000    3.909    3.007  50.000   50.000 1000.000 
1:LEU_86:HN          1:VAX_85:HB           -1.000    3.822    2.940  50.000   50.000 1000.000 
1:GLNC_87:HN          1:GLNC_87:HB1           -1.000    4.666    3.589  50.000   50.000 1000.000 
1:GLNC_87:HN          1:LEU_86:HB2           -1.000    4.320    3.323  50.000   50.000 1000.000 
1:LYX_5:HA          1:LEU_74:HD*           -1.000    5.633    2.487  50.000   50.000 1000.000 
1:LEU_10:HA          1:VAX_81:HB           -1.000    4.599    3.538  50.000   50.000 1000.000 
1:LEU_10:HA          1:VAX_81:HG*           -1.000    6.398    3.075  50.000   50.000 1000.000 
1:THR_12:HA          1:LEU_86:HD1*           -1.000    4.366    2.589  50.000   50.000 1000.000 
1:GLY_13:HA1          1:LEU_14:HN           -1.000    3.697    2.844  50.000   50.000 1000.000 
1:GLY_13:HA1          1:THR_57:HA           -1.000    3.406    2.620  50.000   50.000 1000.000 
1:GLY_13:HA2          1:LEU_10:HG           -1.000    3.662    2.817  50.000   50.000 1000.000 
1:PHE_22:HA          1:GLX_25:HG1           -1.000    4.598    3.537  50.000   50.000 1000.000 
1:PHE_22:HA          1:LEU_77:HB2           -1.000    4.992    3.840  50.000   50.000 1000.000 
1:PHE_22:HA          1:LEU_21:HD2*           -1.000    5.711    3.624  50.000   50.000 1000.000 
1:PHE_22:HA          1:LEU_77:HD1*           -1.000    6.831    4.485  50.000   50.000 1000.000 
1:PHE_22:HA          1:LEU_77:HD2*           -1.000    6.372    4.132  50.000   50.000 1000.000 
1:GLX_25:HA          1:LEU_77:HD2*           -1.000    5.445    3.419  50.000   50.000 1000.000 
1:SER_31:HA          1:SER_31:HG           -1.000    3.851    2.962  50.000   50.000 1000.000 
1:SER_31:HA          1:GLY_67:HA1           -1.000    4.108    3.160  50.000   50.000 1000.000 
1:VAL_33:HA          1:ALA_65:HB*           -1.000    4.745    2.881  50.000   50.000 1000.000 
1:GLY_39:HA2          1:ASX_38:HB1           -1.000    4.853    3.733  50.000   50.000 1000.000 
1:GLY_39:HA2          1:ASX_38:HB2           -1.000    4.644    3.572  50.000   50.000 1000.000 
1:GLY_49:HA*          1:VAL_42:HA           -1.000    6.109    3.930  50.000   50.000 1000.000 
1:GLX_25:HA          1:ASN_27:HB*           -1.000    4.735    2.873  50.000   50.000 1000.000 
1:GLX_25:HA          1:ARX_28:HB2           -1.000    2.864    2.203  50.000   50.000 1000.000 
1:LEU_50:HA          1:LEU_14:HD*           -1.000    6.320    3.015  50.000   50.000 1000.000 
1:ALA_54:HA          1:LYX_37:HE*           -1.000    7.038    4.645  50.000   50.000 1000.000 
1:ALA_54:HA          1:LEU_10:HG           -1.000    4.638    3.568  50.000   50.000 1000.000 
1:ALA_54:HA          1:LEU_10:HD*           -1.000    6.938    3.491  50.000   50.000 1000.000 
1:SER_56:HA          1:GLY_13:HA2           -1.000    4.670    3.592  50.000   50.000 1000.000 
1:THR_62:HA          1:ALA_78:HB*           -1.000    5.961    3.816  50.000   50.000 1000.000 
1:THR_62:HA          1:VAL_61:HG2*           -1.000    5.486    3.451  50.000   50.000 1000.000 
1:ILE_64:HA          1:LYX_5:HB2           -1.000    3.466    2.666  50.000   50.000 1000.000 
1:ALA_65:HA          1:SER_31:HB1           -1.000    4.657    3.582  50.000   50.000 1000.000 
1:ALA_65:HA          1:SER_31:HB2           -1.000    5.023    3.864  50.000   50.000 1000.000 
1:ALA_65:HA          1:GLN_66:HB2           -1.000    4.616    3.551  50.000   50.000 1000.000 
1:ALA_65:HA          1:VAL_33:HB           -1.000    4.490    3.454  50.000   50.000 1000.000 
1:GLN_66:HA          1:GLX_70:HA           -1.000    4.599    3.538  50.000   50.000 1000.000 
1:GLY_67:HA2          1:GLN_66:HA           -1.000    4.550    3.500  50.000   50.000 1000.000 
1:GLY_67:HA2          1:SER_31:HA           -1.000    3.465    2.665  50.000   50.000 1000.000 
1:ASX_69:HA          1:GLX_72:HB*           -1.000    4.319    2.553  50.000   50.000 1000.000 
1:ASX_69:HA          1:GLX_70:HB2           -1.000    5.327    4.098  50.000   50.000 1000.000 
1:ASX_69:HA          1:ALA_73:HB*           -1.000    5.299    3.307  50.000   50.000 1000.000 
1:GLX_70:HA          1:SER_31:HB2           -1.000    5.028    3.868  50.000   50.000 1000.000 
1:GLX_70:HA          1:ALA_65:HB*           -1.000    4.232    2.486  50.000   50.000 1000.000 
1:GLX_70:HA          1:LEU_74:HD*           -1.000    6.425    3.096  50.000   50.000 1000.000 
1:GLX_70:HA          1:ALA_73:HB*           -1.000    4.107    2.390  50.000   50.000 1000.000 
1:ALA_73:HA          1:ALA_26:HA           -1.000    4.303    3.310  50.000   50.000 1000.000 
1:ALA_73:HA          1:GLX_72:HG*           -1.000    5.989    3.838  50.000   50.000 1000.000 
1:ALA_73:HA          1:ALA_65:HB*           -1.000    5.437    3.413  50.000   50.000 1000.000 
1:LEU_74:HA          1:LEU_74:HD*           -1.000    5.230    2.177  50.000   50.000 1000.000 
1:LEU_77:HA          1:TYR_80:HB1           -1.000    3.823    2.941  50.000   50.000 1000.000 
1:TYR_80:HA          1:GLX_83:HG*           -1.000    5.177    3.213  50.000   50.000 1000.000 
1:TYR_80:HA          1:ALA_79:HB*           -1.000    5.242    3.263  50.000   50.000 1000.000 
1:VAX_81:HA          1:LEU_86:HD2*           -1.000    5.696    3.612  50.000   50.000 1000.000 
1:GLN_82:HA          1:LEU_10:HA           -1.000    3.943    3.033  50.000   50.000 1000.000 
1:GLN_82:HA          1:VAX_81:HG*           -1.000    6.316    3.012  50.000   50.000 1000.000 
1:VAX_85:HA          1:LYX_11:HB1           -1.000    4.083    3.141  50.000   50.000 1000.000 
1:LEU_86:HA          1:GLNC_87:HG*           -1.000    4.414    2.626  50.000   50.000 1000.000 
1:GLY_58:HA1          1:THR_57:HG2*           -1.000    5.211    3.239  50.000   50.000 1000.000 
1:GLY_58:HA2          1:THR_57:HG2*           -1.000    5.413    3.395  50.000   50.000 1000.000 
1:GLY_58:HA2          1:ARX_9:HG1           -1.000    3.752    2.886  50.000   50.000 1000.000 
1:PHE_22:HB1          1:ALA_19:HA           -1.000    3.611    2.778  50.000   50.000 1000.000 
1:PHE_22:HB2          1:ALA_19:HA           -1.000    3.535    2.719  50.000   50.000 1000.000 
1:TYR_80:HB1          1:LEU_77:HD2*           -1.000    5.728    3.637  50.000   50.000 1000.000 
1:TYR_80:HB2          1:LEU_77:HD2*           -1.000    5.935    3.796  50.000   50.000 1000.000 
1:TYR_80:HB1          1:VAX_81:HG*           -1.000    5.950    2.731  50.000   50.000 1000.000 
1:TYR_80:HB2          1:VAX_81:HG*           -1.000    6.059    2.815  50.000   50.000 1000.000 
1:ASN_27:HB*          1:GLN_24:HA           -1.000    4.045    2.342  50.000   50.000 1000.000 
1:ASX_69:HB2          1:GLX_72:HB*           -1.000    4.735    2.873  50.000   50.000 1000.000 
1:ASX_69:HB2          1:GLX_72:HG*           -1.000    5.176    3.212  50.000   50.000 1000.000 
1:ASX_69:HB1          1:GLX_72:HB*           -1.000    3.972    2.286  50.000   50.000 1000.000 
1:ASX_69:HB1          1:GLX_72:HG*           -1.000    4.665    2.819  50.000   50.000 1000.000 
1:PHE_29:HB2          1:ALA_73:HB*           -1.000    4.229    2.484  50.000   50.000 1000.000 
1:PHE_34:HB2          1:ILE_64:HD1*           -1.000    4.220    2.477  50.000   50.000 1000.000 
1:GLN_82:HG1          1:VAX_81:HG*           -1.000    5.670    2.515  50.000   50.000 1000.000 
1:GLN_82:HG2          1:VAX_81:HG*           -1.000    6.284    2.988  50.000   50.000 1000.000 
1:GLN_82:HG1          1:GLX_83:HB2           -1.000    3.367    2.590  50.000   50.000 1000.000 
1:GLN_82:HG2          1:GLX_83:HB2           -1.000    3.643    2.802  50.000   50.000 1000.000 
1:MET_51:HB1          1:ILE_47:HG12           -1.000    4.003    3.079  50.000   50.000 1000.000 
1:MET_51:HB2          1:ILE_47:HG12           -1.000    3.571    2.747  50.000   50.000 1000.000 
1:MET_48:HB1          1:ILE_47:HD1*           -1.000    4.331    2.562  50.000   50.000 1000.000 
1:GLN_3:HG1          1:GLN_66:HA           -1.000    4.931    3.793  50.000   50.000 1000.000 
1:GLN_3:HG1          1:ILE_64:HD1*           -1.000    4.156    2.428  50.000   50.000 1000.000 
1:GLX_72:HG*          1:LYX_76:HE*           -1.000    5.506    2.697  50.000   50.000 1000.000 
1:GLX_72:HG*          1:LYX_76:HD*           -1.000    5.139    2.415  50.000   50.000 1000.000 
1:GLX_72:HG*          1:LYX_76:HG2           -1.000    4.264    2.511  50.000   50.000 1000.000 
1:GLX_75:HG1          1:LEU_74:HD*           -1.000    5.915    2.704  50.000   50.000 1000.000 
1:GLX_68:HG*          1:THR_30:HG2*           -1.000    5.348    2.575  50.000   50.000 1000.000 
1:GLN_82:HB1          1:LYX_11:HB1           -1.000    4.160    3.200  50.000   50.000 1000.000 
1:GLN_82:HB1          1:VAL_8:HG1*           -1.000    4.049    2.345  50.000   50.000 1000.000 
1:LEU_21:HB1          1:PRO_18:HA           -1.000    4.823    3.710  50.000   50.000 1000.000 
1:LEU_21:HB2          1:PRO_18:HA           -1.000    4.365    3.358  50.000   50.000 1000.000 
1:LEU_77:HB1          1:LEU_63:HD*           -1.000    6.996    3.535  50.000   50.000 1000.000 
1:LEU_53:HB1          1:GLY_49:HA*           -1.000    5.196    3.228  50.000   50.000 1000.000 
1:GLX_36:HB2          1:LYX_41:HA           -1.000    3.604    2.772  50.000   50.000 1000.000 
1:GLX_36:HB2          1:THR_62:HB           -1.000    5.689    4.376  50.000   50.000 1000.000 
1:GLX_25:HG2          1:PHE_22:HA           -1.000    5.000    3.846  50.000   50.000 1000.000 
1:GLX_25:HG2          1:LEU_77:HD2*           -1.000    5.163    3.202  50.000   50.000 1000.000 
1:GLX_25:HG1          1:LEU_77:HD2*           -1.000    4.805    2.927  50.000   50.000 1000.000 
1:LYX_37:HB1          1:VAL_61:HG1*           -1.000    6.418    4.168  50.000   50.000 1000.000 
1:ILE_64:HG12          1:LYX_5:HB1           -1.000    4.753    3.656  50.000   50.000 1000.000 
1:ILE_64:HG12          1:PHE_34:HB2           -1.000    5.375    4.135  50.000   50.000 1000.000 
1:ILE_64:HG12          1:PHE_34:HB1           -1.000    4.399    3.384  50.000   50.000 1000.000 
1:ILE_64:HG12          1:LEU_63:HA           -1.000    4.926    3.789  50.000   50.000 1000.000 
1:ILE_64:HG12          1:LYX_5:HA           -1.000    4.658    3.583  50.000   50.000 1000.000 
1:LEU_77:HD1*          1:ALA_26:HA           -1.000    4.556    2.735  50.000   50.000 1000.000 
1:LEU_14:HD*          1:LEU_10:HD*           -1.000    5.731    1.793  50.000   50.000 1000.000 
1:LEU_14:HD*          1:VAX_81:HB           -1.000    6.526    3.174  50.000   50.000 1000.000 
1:LEU_14:HD*          1:PHE_22:HB1           -1.000    6.812    3.394  50.000   50.000 1000.000 
1:LEU_77:HD2*          1:ALA_26:HB*           -1.000    6.764    2.588  50.000   50.000 1000.000 
1:LEU_77:HD2*          1:ALA_26:HA           -1.000    4.373    2.595  50.000   50.000 1000.000 
1:ALA_73:HB*          1:ALA_65:HB*           -1.000    5.064    2.357  50.000   50.000 1000.000 
1:ALA_73:HB*          1:SER_31:HB2           -1.000    5.437    3.413  50.000   50.000 1000.000 
1:ALA_73:HB*          1:PHE_29:HB1           -1.000    4.719    2.861  50.000   50.000 1000.000 
1:ILE_64:HD1*          1:PHE_34:HB1           -1.000    4.700    2.846  50.000   50.000 1000.000 
1:ILE_64:HD1*          1:LEU_35:HA           -1.000    5.867    3.744  50.000   50.000 1000.000 
1:ILE_64:HD1*          1:LEU_63:HA           -1.000    6.169    3.976  50.000   50.000 1000.000 
1:ILE_64:HD1*          1:PHE_34:HD*           -1.000    7.096    3.920  50.000   50.000 1000.000 
1:GLN_3:HB1          1:GLN_3:HA           -1.000    6.079    4.676  50.000   50.000 1000.000 
1:LYX_5:HA          1:LYX_5:HB1           -1.000    3.700    2.846  50.000   50.000 1000.000 
1:LYX_5:HD1          1:LYX_5:HA           -1.000    4.563    3.510  50.000   50.000 1000.000 
1:LYX_5:HD2          1:LYX_5:HA           -1.000    5.061    3.893  50.000   50.000 1000.000 
1:GLX_7:HB1          1:GLX_7:HA           -1.000    4.413    3.395  50.000   50.000 1000.000 
1:VAL_8:HA          1:VAL_8:HB           -1.000    3.496    2.689  50.000   50.000 1000.000 
1:VAL_8:HA          1:VAL_8:HG1*           -1.000    4.918    3.014  50.000   50.000 1000.000 
1:VAL_8:HA          1:VAL_8:HG2*           -1.000    4.826    2.943  50.000   50.000 1000.000 
1:LEU_10:HA          1:LEU_10:HD*           -1.000    6.089    2.838  50.000   50.000 1000.000 
1:LEU_10:HB*          1:LEU_10:HA           -1.000    5.057    3.121  50.000   50.000 1000.000 
1:LEU_10:HB*          1:LEU_10:HD*           -1.000    6.329    2.253  50.000   50.000 1000.000 
1:LYX_11:HD*          1:LYX_11:HA           -1.000    4.708    2.852  50.000   50.000 1000.000 
1:LYX_11:HE2          1:LYX_11:HA           -1.000    4.133    3.179  50.000   50.000 1000.000 
1:THR_12:HA          1:THR_12:HG2*           -1.000    5.009    3.084  50.000   50.000 1000.000 
1:GLY_13:HA1          1:GLY_13:HA2           -1.000    3.563    2.741  50.000   50.000 1000.000 
1:LEU_14:HB1          1:LEU_14:HA           -1.000    4.668    3.591  50.000   50.000 1000.000 
1:LEU_14:HB1          1:LEU_14:HD*           -1.000    6.131    2.870  50.000   50.000 1000.000 
1:LEU_14:HB2          1:LEU_14:HA           -1.000    4.907    3.775  50.000   50.000 1000.000 
1:LEU_14:HG          1:LEU_14:HA           -1.000    5.135    3.950  50.000   50.000 1000.000 
1:LEU_14:HG          1:LEU_14:HD*           -1.000    6.067    2.821  50.000   50.000 1000.000 
1:LEU_14:HD*          1:LEU_14:HA           -1.000    5.469    3.438  50.000   50.000 1000.000 
1:ALA_16:HA          1:ALA_16:HB*           -1.000    5.016    3.089  50.000   50.000 1000.000 
1:PRO_18:HG1          1:PRO_18:HA           -1.000    4.073    3.133  50.000   50.000 1000.000 
1:PRO_18:HG1          1:PRO_18:HD1           -1.000    4.134    3.180  50.000   50.000 1000.000 
1:PRO_18:HD1          1:PRO_18:HG2           -1.000    3.723    2.864  50.000   50.000 1000.000 
1:PRO_18:HD2          1:PRO_18:HG1           -1.000    3.719    2.861  50.000   50.000 1000.000 
1:PRO_18:HD2          1:PRO_18:HG2           -1.000    3.154    2.426  50.000   50.000 1000.000 
1:ALA_19:HA          1:ALA_19:HB*           -1.000    4.008    2.314  50.000   50.000 1000.000 
1:ALA_20:HA          1:ALA_20:HB*           -1.000    3.790    2.146  50.000   50.000 1000.000 
1:LEU_21:HB1          1:LEU_21:HA           -1.000    5.924    4.557  50.000   50.000 1000.000 
1:LEU_21:HB2          1:LEU_21:HA           -1.000    3.667    2.821  50.000   50.000 1000.000 
1:PHE_22:HA          1:PHE_22:HB2           -1.000    3.514    2.703  50.000   50.000 1000.000 
1:VAL_23:HB          1:VAL_23:HA           -1.000    3.696    2.843  50.000   50.000 1000.000 
1:VAL_23:HB          1:VAL_23:HG1*           -1.000    4.029    2.330  50.000   50.000 1000.000 
1:VAL_23:HB          1:VAL_23:HG2*           -1.000    3.926    2.251  50.000   50.000 1000.000 
1:GLN_24:HB*          1:GLN_24:HA           -1.000    4.150    2.423  50.000   50.000 1000.000 
1:ALA_26:HB*          1:ALA_26:HA           -1.000    4.476    2.674  50.000   50.000 1000.000 
1:ASN_27:HA          1:ASN_27:HB*           -1.000    4.376    2.597  50.000   50.000 1000.000 
1:ARX_28:HG1          1:GLX_25:HA           -1.000    3.348    2.575  50.000   50.000 1000.000 
1:ARX_28:HG1          1:ARX_28:HD*           -1.000    4.238    2.491  50.000   50.000 1000.000 
1:ARX_28:HG2          1:ARX_28:HA           -1.000    3.320    2.554  50.000   50.000 1000.000 
1:ARX_28:HG2          1:ARX_28:HD*           -1.000    4.189    2.453  50.000   50.000 1000.000 
1:PHE_29:HA          1:PHE_29:HB1           -1.000    4.416    3.397  50.000   50.000 1000.000 
1:PHE_29:HA          1:PHE_29:HB2           -1.000    5.048    3.883  50.000   50.000 1000.000 
1:SER_31:HA          1:SER_31:HB1           -1.000    3.760    2.892  50.000   50.000 1000.000 
1:SER_31:HA          1:SER_31:HB2           -1.000    3.977    3.059  50.000   50.000 1000.000 
1:ASX_32:HB1          1:ASX_32:HA           -1.000    4.269    3.284  50.000   50.000 1000.000 
1:ASX_32:HB2          1:ASX_32:HA           -1.000    4.317    3.321  50.000   50.000 1000.000 
1:VAL_33:HA          1:VAL_33:HB           -1.000    4.884    3.757  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:VAL_33:HA           -1.000    5.185    3.219  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:VAL_33:HB           -1.000    4.229    2.484  50.000   50.000 1000.000 
1:PHE_34:HA          1:PHE_34:HB1           -1.000    3.802    2.925  50.000   50.000 1000.000 
1:PHE_34:HA          1:PHE_34:HB2           -1.000    4.177    3.213  50.000   50.000 1000.000 
1:LEU_35:HD*          1:LEU_35:HA           -1.000    5.722    3.632  50.000   50.000 1000.000 
1:GLX_36:HA          1:GLX_36:HB2           -1.000    3.348    2.575  50.000   50.000 1000.000 
1:GLX_36:HB1          1:GLX_36:HA           -1.000    4.174    3.211  50.000   50.000 1000.000 
1:GLX_36:HG1          1:GLX_36:HA           -1.000    3.826    2.943  50.000   50.000 1000.000 
1:GLX_36:HG2          1:GLX_36:HA           -1.000    4.074    3.134  50.000   50.000 1000.000 
1:LYX_37:HA          1:LYX_37:HG2           -1.000    4.100    3.154  50.000   50.000 1000.000 
1:ASX_38:HA          1:ASX_38:HB1           -1.000    3.068    2.360  50.000   50.000 1000.000 
1:ASX_38:HA          1:ASX_38:HB2           -1.000    3.335    2.565  50.000   50.000 1000.000 
1:LYX_40:HG1          1:LYX_40:HA           -1.000    4.573    3.518  50.000   50.000 1000.000 
1:LYX_40:HG2          1:LYX_40:HA           -1.000    5.157    3.967  50.000   50.000 1000.000 
1:GLX_7:HA          1:ALA_78:HB*           -1.000    4.259    2.507  50.000   50.000 1000.000 
1:VAL_8:HB          1:GLN_82:HG1           -1.000    3.532    2.717  50.000   50.000 1000.000 
1:VAL_8:HB          1:GLN_82:HG2           -1.000    4.290    3.300  50.000   50.000 1000.000 
1:GLY_13:HA1          1:VAX_55:HA           -1.000    3.172    2.440  50.000   50.000 1000.000 
1:LEU_14:HG          1:LEU_10:HD*           -1.000    5.507    2.390  50.000   50.000 1000.000 
1:ALA_19:HA          1:LEU_14:HD*           -1.000    5.517    2.398  50.000   50.000 1000.000 
1:ALA_19:HB*          1:THR_12:HB           -1.000    4.901    3.001  50.000   50.000 1000.000 
1:ALA_19:HB*          1:PRO_18:HG2           -1.000    5.064    3.126  50.000   50.000 1000.000 
1:ALA_20:HA          1:VAL_23:HB           -1.000    3.865    2.973  50.000   50.000 1000.000 
1:ALA_26:HB*          1:LEU_77:HD1*           -1.000    4.944    2.265  50.000   50.000 1000.000 
1:ARX_28:HG1          1:ASN_27:HB*           -1.000    4.983    3.064  50.000   50.000 1000.000 
1:ARX_28:HG2          1:ASN_27:HB*           -1.000    4.880    2.985  50.000   50.000 1000.000 
1:SER_31:HA          1:ASX_32:HB1           -1.000    4.492    3.455  50.000   50.000 1000.000 
1:SER_31:HA          1:VAL_33:HG2*           -1.000    5.364    3.357  50.000   50.000 1000.000 
1:ASX_32:HB1          1:GLN_66:HB1           -1.000    4.025    3.096  50.000   50.000 1000.000 
1:VAL_33:HB          1:LYX_45:HE*           -1.000    5.248    3.268  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:SER_31:HB2           -1.000    4.293    2.533  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:ASN_27:HA           -1.000    4.831    2.947  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:SER_31:HB1           -1.000    5.117    3.167  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:PHE_29:HB1           -1.000    6.184    3.988  50.000   50.000 1000.000 
1:VAL_33:HG2*          1:ALA_65:HB*           -1.000    4.561    1.970  50.000   50.000 1000.000 
1:PHE_34:HA          1:PHE_34:HD*           -1.000    5.581    3.524  50.000   50.000 1000.000 
1:GLX_36:HG1          1:THR_62:HB           -1.000    4.771    3.670  50.000   50.000 1000.000 
1:GLX_36:HG1          1:LYX_41:HA           -1.000    3.607    2.775  50.000   50.000 1000.000 
1:GLX_36:HG2          1:LYX_41:HA           -1.000    3.851    2.962  50.000   50.000 1000.000 
1:GLX_36:HG2          1:THR_62:HB           -1.000    4.784    3.680  50.000   50.000 1000.000 
1:LYX_37:HB2          1:LYX_37:HG1           -1.000    2.857    2.198  50.000   50.000 1000.000 
1:LYX_37:HB1          1:LYX_37:HE*           -1.000    5.094    3.149  50.000   50.000 1000.000 
1:LYX_37:HB2          1:LYX_37:HE*           -1.000    4.682    2.832  50.000   50.000 1000.000 
1:LYX_37:HG1          1:VAL_61:HG1*           -1.000    4.682    2.832  50.000   50.000 1000.000 
1:LYX_41:HA          1:VAL_42:HG2*           -1.000    4.191    2.455  50.000   50.000 1000.000 
1:LYX_41:HB1          1:GLX_36:HA           -1.000    3.303    2.541  50.000   50.000 1000.000 
1:LYX_41:HB2          1:GLX_36:HA           -1.000    3.503    2.695  50.000   50.000 1000.000 
1:LYX_41:HB2          1:GLX_36:HB2           -1.000    3.411    2.624  50.000   50.000 1000.000 
1:LYX_41:HG1          1:PHE_34:HB1           -1.000    3.527    2.713  50.000   50.000 1000.000 
1:LYX_41:HG2          1:PHE_34:HB1           -1.000    3.355    2.581  50.000   50.000 1000.000 
1:LYX_41:HG1          1:PHE_34:HB2           -1.000    3.290    2.531  50.000   50.000 1000.000 
1:LYX_41:HG2          1:PHE_34:HB2           -1.000    3.530    2.715  50.000   50.000 1000.000 
1:LYX_41:HG1          1:LYX_41:HE2           -1.000    3.123    2.402  50.000   50.000 1000.000 
1:LYX_41:HG2          1:LYX_41:HE2           -1.000    2.859    2.199  50.000   50.000 1000.000 
1:LYX_41:HG1          1:GLX_36:HG1           -1.000    3.328    2.560  50.000   50.000 1000.000 
1:LYX_41:HG2          1:GLX_36:HG1           -1.000    3.102    2.386  50.000   50.000 1000.000 
1:LYX_41:HE1          1:VAL_42:HA           -1.000    4.801    3.693  50.000   50.000 1000.000 
1:LYX_41:HE2          1:VAL_42:HA           -1.000    4.833    3.718  50.000   50.000 1000.000 
1:VAL_42:HG2*          1:GLY_49:HA*           -1.000    6.068    3.129  50.000   50.000 1000.000 
1:ASN_43:HA          1:PHE_34:HD*           -1.000    4.262    2.509  50.000   50.000 1000.000 
1:LEU_53:HB1          1:LEU_53:HA           -1.000    4.609    3.545  50.000   50.000 1000.000 
1:LEU_53:HB2          1:LEU_53:HA           -1.000    3.682    2.832  50.000   50.000 1000.000 
1:LEU_53:HG          1:LEU_53:HA           -1.000    3.380    2.600  50.000   50.000 1000.000 
1:ALA_54:HA          1:ALA_54:HB*           -1.000    4.398    2.614  50.000   50.000 1000.000 
1:VAL_61:HA          1:VAL_61:HB           -1.000    3.860    2.969  50.000   50.000 1000.000 
1:THR_62:HB          1:THR_62:HG2*           -1.000    6.689    4.376  50.000   50.000 1000.000 
1:LEU_53:HD2*          1:SER_52:HB1           -1.000    3.698    2.075  50.000   50.000 1000.000 
1:ALA_54:HB*          1:LEU_53:HA           -1.000    8.800    6.000  50.000   50.000 1000.000 
1:ALA_54:HB*          1:VAL_23:HG1*           -1.000    5.390    2.608  50.000   50.000 1000.000 
1:THR_59:HA          1:ARX_9:HG2           -1.000    4.278    3.291  50.000   50.000 1000.000 
1:THR_59:HA          1:LYX_37:HE*           -1.000    5.953    3.810  50.000   50.000 1000.000 
1:THR_59:HG2*          1:LYX_37:HE*           -1.000    5.366    2.589  50.000   50.000 1000.000 
1:THR_59:HG2*          1:LYX_37:HB2           -1.000    4.930    3.023  50.000   50.000 1000.000 
1:VAL_61:HG2*          1:LYX_37:HG1           -1.000    4.592    2.763  50.000   50.000 1000.000 
1:GLN_3:HG1          1:GLN_66:HB1           -1.000    2.929    2.253  50.000   50.000 1000.000 
1:ARX_9:HG2          1:GLY_58:HA2           -1.000    4.650    3.577  50.000   50.000 1000.000 
1:LYX_11:HG1          1:VAX_85:HA           -1.000    4.182    3.217  50.000   50.000 1000.000 
1:LYX_11:HE1          1:GLX_84:HG1           -1.000    3.335    2.565  50.000   50.000 1000.000 
1:ARX_28:HA          1:ASN_27:HB*           -1.000    4.786    2.912  50.000   50.000 1000.000 
1:GLX_60:HG2          1:ARX_9:HA           -1.000    5.752    3.348  50.000   50.000 1000.000 
1:GLX_68:HG*          1:GLY_67:HA1           -1.000    5.293    3.302  50.000   50.000 1000.000 
1:ASN_43:HA          1:ALA_44:HA           -1.000    4.316    3.320  50.000   50.000 1000.000 
1:LYX_45:HN          1:ASN_43:HN           -1.000    5.642    4.340  50.000   50.000 1000.000 
1:SER_46:HN          1:ASN_43:HN           -1.000    6.513    5.010  50.000   50.000 1000.000 
1:SER_46:HN          1:GLY_49:HN           -1.000    5.083    3.910  50.000   50.000 1000.000 
1:SER_46:HN          1:ASN_43:HB1           -1.000    4.928    3.791  50.000   50.000 1000.000 
1:SER_46:HN          1:LYX_45:HG*           -1.000    5.186    3.220  50.000   50.000 1000.000 
1:SER_46:HN          1:ALA_44:HB*           -1.000    5.641    3.570  50.000   50.000 1000.000 
1:LEU_50:HN          1:SER_46:HB1           -1.000    5.078    3.906  50.000   50.000 1000.000 
1:LYX_45:HB*          1:VAL_23:HA           -1.000    4.302    2.540  50.000   50.000 1000.000 
1:VAL_23:HG1*          1:LYX_45:HA           -1.000    4.208    2.468  50.000   50.000 1000.000 
1:VAL_23:HG1*          1:LEU_50:HA           -1.000    3.847    2.190  50.000   50.000 1000.000 
1:GLN_3:HA          1:GLN_66:HA           -1.000    2.821    2.821  200.000   200.000  1000.000
1:LYX_5:HA          1:ILE_64:HA           -1.000    3.991    3.991  200.000   200.000  1000.000
1:GLX_7:HA          1:THR_62:HA           -1.000    2.792    2.792  200.000   200.000  1000.000
1:ARX_9:HA          1:GLX_60:HA           -1.000     2.447   2.447  200.000   200.000  1000.000
1:VAL_33:HA          1:ALA_65:HA           -1.000     2.727   2.727  200.000   200.000  1000.000
1:PHE_34:HA          1:ASN_43:HA           -1.000    2.630    2.630  200.000   200.000  1000.000
1:LEU_35:HA          1:LEU_63:HA           -1.000     2.749   2.749  200.000   200.000  1000.000
1:VAL_61:HA          1:LYX_37:HA           -1.000    3.487   3.487  200.000   200.000  1000.000
1:LYX_41:HA          1:GLX_36:HA           -1.000     2.601   2.601  200.000   200.000  1000.000
1:LEU_35:HN          1:VAL_42:HN           -1.000    3.000    3.000  200.000   200.000 1000.000 
1:LYX_37:HN          1:LYX_40:HN           -1.000    3.000    3.000  200.000   200.000 1000.000 
1:GLN_4:HN          1:ALA_65:HN           -1.000    3.000    3.000  200.000   200.000 1000.000 
1:LEU_63:HN          1:VAL_6:HN           -1.000    2.965    2.281  200.000   200.000 1000.000 
1:VAL_8:HN          1:VAL_61:HN           -1.000    3.261    3.261  200.000   200.000 1000.000 
1:GLX_36:HN          1:THR_62:HN           -1.000    3.000    3.000  200.000   200.000 1000.000 
1:PHE_34:HN          1:ILE_64:HN           -1.000    3.000    3.000  200.000   200.000 1000.000 
1:GLN_66:HN          1:ASX_32:HN           -1.000    3.510    3.512  200.000   200.000 1000.000 
1:GLY_49:HN          1:VAL_42:HG2*           -1.000    5.785    3.681  50.000   50.000 1000.000 
1:GLY_49:HN          1:VAL_42:HG1*           -1.000    5.642    3.571  50.000   50.000 1000.000 
1:GLY_49:HN          1:LEU_50:HB2           -1.000    6.188    4.760  50.000   50.000 1000.000 
1:GLY_49:HN          1:LYX_45:HG*           -1.000    6.717    4.398  50.000   50.000 1000.000 
1:GLY_49:HN          1:MET_48:HB2           -1.000    7.500    5.769  50.000   50.000 1000.000 
1:GLY_49:HN          1:MET_48:HB1           -1.000    7.223    5.556  50.000   50.000 1000.000 
1:GLY_49:HN          1:ILE_47:HN           -1.000    6.009    4.622  50.000   50.000 1000.000 
1:THR_30:HN          1:PHE_29:HD*           -1.000    6.447    4.190  50.000   50.000 1000.000 
1:SER_46:HN          1:ASN_43:HA           -1.000    5.565    4.281  50.000   50.000 1000.000 
1:ALA_44:HA          1:LYX_45:HG*           -1.000    5.632    3.563  50.000   50.000 1000.000 
1:SER_46:HN          1:VAL_23:HA           -1.000    6.071    4.670  50.000   50.000 1000.000 
1:VAL_33:HN          1:ALA_44:HB*           -1.000    5.550    3.500  50.000   50.000 1000.000 
1:PHE_34:HN          1:ALA_44:HB*           -1.000    5.121    3.170  50.000   50.000 1000.000 
1:ALA_65:HA          1:ILE_64:HG2*           -1.000    4.332    2.563  50.000   50.000 1000.000 
1:GLY_49:HA*          1:VAL_42:HB           -1.000    4.475    2.673  50.000   50.000 1000.000 
1:ALA_44:HB*          1:PHE_34:HA           -1.000    5.238    3.260  50.000   50.000 1000.000 
1:ARX_28:HN          1:GLX_25:HN           -1.000    4.185    3.219  50.000   50.000 1000.000 
1:MET_51:HB1          1:ILE_47:HG11           -1.000    65.000    50.000  50.000   50.000 1000.000 
1:ALA_65:HN          1:GLN_4:HB*           -1.000    6.040    3.877  50.000   50.000 1000.000 
1:MET_48:HB2          1:ILE_47:HG2*           -1.000    3.990    2.300  50.000   50.000 1000.000 
#NOE_distance_overlapped
1:ALA_19:HN          1:PRO_18:HG2           0.000    4.973  50.000   50.000 1000.000 
+ 1:ALA_19:HN          1:LEU_21:HB1
1:ALA_20:HN          1:ALA_20:HB*           0.000    4.158  50.000   50.000 1000.000 
+ 1:ALA_20:HN          1:ALA_16:HB*
1:ALA_19:HN          1:ALA_20:HB*           0.000    5.946  50.000   50.000 1000.000 
+ 1:ALA_19:HN          1:ALA_16:HB*
1:GLX_25:HN          1:VAL_23:HG2*           0.000    5.147  50.000   50.000 1000.000 
+ 1:GLX_25:HN          1:LEU_21:HD2*
1:ALA_26:HN          1:GLX_25:HG1           0.000    4.424  50.000   50.000 1000.000 
+ 1:ALA_26:HN          1:VAL_23:HB
1:ARX_28:HN          1:ARX_28:HG1           0.000    4.473  50.000   50.000 1000.000 
+ 1:ARX_28:HN          1:GLX_25:HB*
1:PHE_29:HN          1:ARX_28:HG1           0.000    6.312  50.000   50.000 1000.000 
+ 1:PHE_29:HN          1:GLX_25:HB*
1:PHE_29:HN          1:ARX_28:HB1           0.000    5.323  50.000   50.000 1000.000 
+ 1:PHE_29:HN          1:ARX_28:HG2
1:SER_46:HN          1:SER_46:HB1           0.000    3.837  50.000   50.000 1000.000 
+ 1:SER_46:HN          1:ALA_44:HA
1:MET_48:HN          1:ILE_47:HG2*           0.000    4.843  50.000   50.000 1000.000 
+ 1:MET_48:HN          1:ILE_47:HD1*
1:LEU_50:HN          1:VAL_42:HB           0.000    6.860  50.000   50.000 1000.000 
+ 1:LEU_50:HN          1:LEU_50:HG*
1:MET_51:HN          1:ALA_19:HB*           0.000    5.899  50.000   50.000 1000.000 
+ 1:MET_51:HN          1:ILE_47:HG12
1:SER_56:HN          1:SER_56:HB1           0.000    5.246  50.000   50.000 1000.000 
+ 1:SER_56:HN          1:SER_56:HB2
1:THR_59:HN          1:VAL_8:HG1*           0.000    5.794  50.000   50.000 1000.000 
+ 1:THR_59:HN          1:LEU_10:HD*
+ 1:THR_59:HN          1:VAL_61:HG1*
1:LYX_11:HN          1:LEU_10:HA           0.000    3.892  50.000   50.000 1000.000 
+ 1:LYX_11:HN          1:THR_57:HA
1:ALA_16:HN          1:ALA_16:HA           0.000    4.648  50.000   50.000 1000.000 
+ 1:ALA_16:HN          1:PRO_18:HD1
1:GLN_15:HN          1:ALA_16:HA           0.000    6.139  50.000   50.000 1000.000 
+ 1:GLN_15:HN          1:PRO_18:HD1
1:ARX_17:HN          1:ALA_16:HA           0.000    5.900  50.000   50.000 1000.000 
+ 1:ARX_17:HN          1:PRO_18:HD1
1:SER_52:HN          1:SER_52:HA           0.000    4.065  50.000   50.000 1000.000 
+ 1:SER_52:HN          1:MET_51:HA
1:THR_57:HN          1:GLY_13:HA1           0.000    5.570  50.000   50.000 1000.000 
+ 1:THR_57:HN          1:THR_12:HA 
1:GLN_24:HN          1:VAL_23:HN           0.000    4.309  50.000   50.000 1000.000 
+ 1:GLN_24:HN          1:LEU_21:HN
1:ALA_19:HN          1:LEU_21:HN           0.000    5.808  50.000   50.000 1000.000 
+ 1:ALA_19:HN          1:VAL_23:HN
1:ALA_20:HN          1:LEU_21:HB2           0.000    8.845  50.000   50.000 1000.000 
+ 1:ALA_20:HN          1:LEU_21:HG*
1:ALA_26:HN          1:ALA_26:HA           0.000    4.256  50.000   50.000 1000.000 
+ 1:ALA_26:HN          1:GLX_25:HA
+ 1:ALA_26:HN          1:GLN_24:HA
1:ALA_26:HN          1:LEU_77:HA           0.000    5.776  50.000   50.000 1000.000 
+ 1:ALA_26:HN          1:LYX_45:HA
1:ASN_27:HN          1:ARX_28:HB1           0.000    6.370  50.000   50.000 1000.000 
+ 1:ASN_27:HN          1:ARX_28:HG2
1:ARX_28:HN          1:GLX_25:HA           0.000    3.961  50.000   50.000 1000.000 
+ 1:ARX_28:HN          1:ALA_26:HA          
+ 1:ARX_28:HN          1:ARX_28:HA          
1:ALA_19:HN          1:ALA_16:HA           0.000    5.194  50.000   50.000 1000.000 
+ 1:ALA_19:HN          1:PRO_18:HD1
1:GLY_49:HN          1:GLY_49:HA*           0.000    4.218  50.000   50.000 1000.000 
+ 1:GLY_49:HN          1:SER_46:HB2
1:SER_52:HN          1:SER_52:HB1           0.000    3.942  50.000   50.000 1000.000 
+ 1:SER_52:HN          1:THR_59:HB
1:SER_52:HN          1:GLY_49:HA*           0.000    4.840  50.000   50.000 1000.000 
+ 1:SER_52:HN          1:LEU_50:HA
1:SER_52:HN          1:MET_51:HB2           0.000    6.571  50.000   50.000 1000.000 
+ 1:SER_52:HN          1:MET_48:HB2
1:LEU_53:HN          1:SER_52:HA           0.000    3.782  50.000   50.000 1000.000 
+ 1:LEU_53:HN          1:LEU_53:HA
1:LEU_53:HN          1:LEU_50:HA           0.000    4.769  50.000   50.000 1000.000 
+ 1:LEU_53:HN          1:GLY_49:HA*
1:SER_56:HN          1:ALA_54:HB*           0.000    6.338  50.000   50.000 1000.000 
+ 1:SER_56:HN          1:ALA_19:HB*
1:LYX_11:HN          1:GLN_82:HA           0.000    4.344  50.000   50.000 1000.000 
+ 1:LYX_11:HN         1:GLX_84:HA
1:THR_12:HN          1:VAX_81:HA           0.000    7.710  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:VAX_85:HA
1:THR_12:HN          1:LEU_10:HA           0.000    7.118  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:THR_57:HA
1:THR_12:HN          1:LYX_11:HD2           0.000    6.306  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:ARX_9:HG1
1:THR_12:HN          1:THR_57:HG2*           0.000    8.560  50.000   50.000 1000.000 
+ 1:THR_12:HN           1:VAX_81:HG*
1:THR_12:HN          1:LEU_10:HD*           0.000    6.420  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:VAL_8:HG2*
1:THR_12:HN          1:VAX_81:HA           0.000    5.832  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:VAX_85:HA
1:THR_12:HN          1:LEU_10:HA           0.000    5.049  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:THR_57:HA
1:THR_12:HN          1:LYX_11:HD2           0.000    4.609  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:ARX_9:HG1
1:THR_12:HN          1:THR_57:HG2*           0.000    6.399  50.000   50.000 1000.000 
+ 1:THR_12:HN           1:VAX_81:HG*
1:THR_12:HN          1:LEU_10:HD*           0.000    4.833  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:VAL_8:HG2*
1:GLY_13:HN          1:GLY_13:HA1           0.000    4.150  50.000   50.000 1000.000 
+ 1:GLY_13:HN         1:THR_12:HA
1:GLN_15:HN          1:GLY_13:HA1           0.000    5.369  50.000   50.000 1000.000 
+ 1:GLN_15:HN          1:MET_51:HA
1:PHE_29:HN          1:ARX_28:HA           0.000    4.470  50.000   50.000 1000.000 
+ 1:PHE_29:HN          1:ALA_26:HA
+ 1:PHE_29:HN          1:GLX_25:HA
1:THR_30:HN          1:ARX_28:HA           0.000    6.336  50.000   50.000 1000.000 
+ 1:THR_30:HN          1:ALA_26:HA    
1:ILE_47:HN          1:ILE_47:HA           0.000    5.047  50.000   50.000 1000.000 
+ 1:ILE_47:HN          1:SER_46:HB2
1:ILE_47:HN          1:VAL_42:HG1*           0.000    7.673  50.000   50.000 1000.000 
+ 1:ILE_47:HN          1:LYX_45:HD2
+ 1:ILE_47:HN          1:VAL_23:HG2*
+ 1:ILE_47:HN          1:LEU_50:HD1*
1:MET_48:HN          1:ILE_47:HA           0.000    4.815  50.000   50.000 1000.000 
+ 1:MET_48:HN          1:GLY_49:HA*
+ 1:MET_48:HN          1:LEU_50:HA
1:THR_57:HN          1:THR_57:HB           0.000    3.819  50.000   50.000 1000.000 
+ 1:THR_57:HN          1:THR_57:HA
1:LEU_10:HN          1:LEU_35:HD*           0.000    6.407  50.000   50.000 1000.000 
+ 1:LEU_10:HN         1:VAL_61:HG2*
1:THR_12:HN          1:LEU_86:HA           0.000    5.171  50.000   50.000 1000.000 
+ 1:THR_12:HN          1:GLX_84:HA
+ 1:THR_12:HN          1:GLN_82:HA
+ 1:THR_12:HN          1:GLNC_87:HA
1:GLY_13:HN          1:THR_12:HB           0.000    4.697  50.000   50.000 1000.000 
+ 1:GLY_13:HN         1:LYX_11:HA 
1:ALA_19:HN          1:GLN_15:HN           0.000    6.844  50.000   50.000 1000.000 
+ 1:ALA_19:HN         1:GLN_15:HE22
1:ALA_20:HN          1:LEU_21:HN           0.000    4.128  50.000   50.000 1000.000 
+ 1:ALA_20:HN         1:VAL_23:HN  
1:ALA_26:HN          1:LEU_77:HB2           0.000    6.266  50.000   50.000 1000.000 
+ 1:ALA_26:HN          1:ARX_28:HB1
+ 1:ALA_26:HN          1:ARX_28:HG2
1:ASN_27:HN          1:ARX_28:HG1           0.000    5.778  50.000   50.000 1000.000 
+ 1:ASN_27:HN         1:GLX_25:HB*
1:SER_31:HN          1:GLX_68:HG*           0.000    6.768  50.000   50.000 1000.000 
+ 1:SER_31:HN         1:GLX_70:HB1
1:SER_31:HN          1:ARX_28:HB2           0.000    8.505  50.000   50.000 1000.000 
+ 1:SER_31:HN         1:ALA_65:HB*
1:ASN_43:HN          1:ALA_44:HA           0.000    6.660  50.000   50.000 1000.000 
+ 1:ASN_43:HN         1:SER_46:HB1
1:ALA_44:HN          1:LEU_35:HN           0.000    4.849  50.000   50.000 1000.000 
+ 1:ALA_44:HN         1:ASN_43:HN
1:SER_46:HN          1:VAL_23:HG2*           0.000    5.390  50.000   50.000 1000.000 
+ 1:SER_46:HN         1:LYX_45:HD2
1:LEU_50:HN          1:MET_51:HB2           0.000    8.091  50.000   50.000 1000.000 
+ 1:LEU_50:HN         1:MET_48:HB2
1:LEU_50:HN          1:ILE_47:HG1*           0.000    7.344  50.000   50.000 1000.000 
+ 1:LEU_50:HN         1:ALA_19:HB*
1:MET_51:HN          1:SER_52:HB1           0.000    6.111  50.000   50.000 1000.000 
+ 1:MET_51:HN         1:SER_52:HB2
1:MET_51:HN          1:VAX_55:HB           0.000    6.129  50.000   50.000 1000.000 
+ 1:MET_51:HN         1:MET_48:HG*
+ 1:MET_51:HN         1:MET_48:HE*
1:SER_52:HN          1:LEU_50:HB1           0.000    5.456  50.000   50.000 1000.000 
+ 1:SER_52:HN         1:LEU_53:HB1   
1:SER_56:HN          1:SER_52:HB1           0.000    8.206  50.000   50.000 1000.000 
+ 1:SER_56:HN         1:SER_52:HB2
1:PHE_22:HD*          1:LEU_21:HN           0.000    5.231  50.000   50.000 1000.000 
+ 1:PHE_22:HD*        1:VAL_23:HN
1:PHE_22:HN          1:LEU_21:HN           0.000    4.095  50.000   50.000 1000.000 
+ 1:PHE_22:HN        1:VAL_23:HN
1:ALA_20:HN          1:LEU_21:HN           0.000    4.097  50.000   50.000 1000.000 
+ 1:ALA_20:HN        1:VAL_23:HN
1:ALA_20:HA          1:LEU_21:HN           0.000    3.898  50.000   50.000 1000.000 
+ 1:ALA_20:HA        1:VAL_23:HN
1:VAL_23:HA          1:LEU_21:HN           0.000    4.586  50.000   50.000 1000.000 
+ 1:VAL_23:HA        1:VAL_23:HN
1:PHE_22:HA          1:LEU_21:HN           0.000    4.830  50.000   50.000 1000.000 
+ 1:PHE_22:HA        1:VAL_23:HN
1:PHE_22:HB1          1:LEU_21:HN           0.000    4.535  50.000   50.000 1000.000 
+ 1:PHE_22:HB1        1:VAL_23:HN
1:PHE_22:HB2          1:LEU_21:HN           0.000    4.718  50.000   50.000 1000.000 
+ 1:PHE_22:HB2        1:VAL_23:HN
1:LEU_21:HB2          1:LEU_21:HN           0.000    3.717  50.000   50.000 1000.000 
+ 1:LEU_21:HB2        1:VAL_23:HN
1:ALA_20:HB*          1:LEU_21:HN           0.000    3.645  50.000   50.000 1000.000 
+ 1:ALA_20:HB*        1:VAL_23:HN
1:GLN_24:HN          1:PHE_22:HB2           0.000    7.831  50.000   50.000 1000.000 
+ 1:GLN_24:HN         1:ARX_28:HD*
1:GLN_24:HN          1:GLN_24:HB*           0.000    3.492  50.000   50.000 1000.000 
+ 1:GLN_24:HN         1:VAL_23:HB
1:GLX_25:HN          1:GLN_24:HB*           0.000    3.993  50.000   50.000 1000.000 
+ 1:GLX_25:HN         1:GLX_25:HG1
1:GLY_58:HN          1:VAL_8:HG1*           0.000    5.655  50.000   50.000 1000.000 
+ 1:GLY_58:HN          1:LEU_10:HD*
1:GLY_67:HN          1:GLX_70:HB2           0.000    5.086  50.000   50.000 1000.000 
+ 1:GLY_67:HN          1:LEU_74:HB1 
1:LYX_76:HN          1:ASN_27:HD22           0.000    6.035  50.000   50.000 1000.000 
+ 1:LYX_76:HN          1:PHE_29:HD*
+ 1:LYX_76:HN          1:PHE_29:HE*
1:VAX_55:HN          1:MET_51:HA           0.000    7.032  50.000   50.000 1000.000 
+ 1:VAX_55:HN        1:SER_52:HA
+ 1:VAX_55:HN         1:LEU_53:HA
1:ALA_73:HN          1:ASX_69:HN           0.000    5.552  50.000   50.000 1000.000 
+ 1:ALA_73:HN          1:PHE_29:HN
1:ASX_32:HN          1:ASX_69:HN           0.000    5.820  50.000   50.000 1000.000 
+ 1:ASX_32:HN          1:PHE_34:HE*    
1:ALA_73:HN          1:ASN_27:HD22           0.000    6.517  50.000   50.000 1000.000 
+ 1:ALA_73:HN         1:PHE_29:HD*
+ 1:ALA_73:HN         1:PHE_29:HE*
1:LEU_77:HN          1:ASN_27:HD22           0.000    6.517  50.000   50.000 1000.000 
+ 1:LEU_77:HN         1:PHE_29:HD*
+ 1:LEU_77:HN         1:PHE_29:HE*
1:PHE_29:HN          1:ASN_27:HD22           0.000    6.083  50.000   50.000 1000.000 
+ 1:PHE_29:HN         1:PHE_29:HD*
+ 1:PHE_29:HN         1:PHE_29:HE*
1:ARX_28:HN          1:ASN_27:HD22           0.000    6.083  50.000   50.000 1000.000 
+ 1:ARX_28:HN         1:PHE_29:HD*
+ 1:ARX_28:HN         1:PHE_29:HE*
1:TYR_80:HN          1:LYX_76:HA           0.000    3.856  50.000   50.000 1000.000 
+ 1:TYR_80:HN         1:LEU_77:HA
+ 1:TYR_80:HN         1:ALA_79:HA
+ 1:TYR_80:HN         1:TYR_80:HA
1:GLX_70:HN          1:ASX_69:HB2           0.000    4.462  50.000   50.000 1000.000 
+ 1:GLX_70:HN         1:GLX_70:HG1
1:VAL_23:HN          1:LEU_10:HD*           0.000    4.634  50.000   50.000 1000.000 
+ 1:VAL_23:HN         1:LEU_50:HD1*
+ 1:VAL_23:HN         1:VAL_23:HG* 
1:ALA_20:HN          1:PRO_18:HG2           0.000    5.190  50.000   50.000 1000.000 
+ 1:ALA_20:HN         1:LEU_21:HB1  
1:VAL_33:HN          1:VAL_33:HB           0.000    4.686  50.000   50.000 1000.000 
+ 1:VAL_33:HN         1:ILE_64:HG12
1:ALA_26:HN          1:PHE_29:HN           0.000    5.919  50.000   50.000 1000.000 
+ 1:ALA_26:HN         1:PHE_22:HE*
1:LYX_41:HN          1:LYX_41:HB1           0.000    4.336  50.000   50.000 1000.000 
+ 1:LYX_41:HN         1:GLX_36:HB2
1:ALA_26:HN          1:PHE_22:HD*           0.000    6.433  50.000   50.000 1000.000 
+ 1:ALA_26:HN         1:PHE_29:HD*
+ 1:ALA_26:HN         1:PHE_29:HE*
1:ARX_28:HN          1:ALA_26:HB*           0.000    5.734  50.000   50.000 1000.000 
+ 1:ARX_28:HN         1:ILE_47:HG2*
1:LEU_77:HN          1:ALA_78:HB*           0.000    4.607  50.000   50.000 1000.000 
+ 1:LEU_77:HN         1:LEU_77:HB2
1:LEU_53:HN          1:SER_52:HB2           0.000    4.921  50.000   50.000 1000.000 
+ 1:LEU_53:HN         1:ALA_54:HA
1:ASN_43:HN          1:LEU_50:HD2*           0.000    6.182  50.000   50.000 1000.000 
+ 1:ASN_43:HN         1:VAL_33:HG1*
+ 1:ASN_43:HN         1:VAL_42:HG2*
1:TYR_80:HN          1:LEU_77:HB1           0.000    5.861  50.000   50.000 1000.000 
+ 1:TYR_80:HN          1:LEU_77:HG           
1:PHE_22:HN          1:ALA_20:HA           0.000    4.138  50.000   50.000 1000.000 
+ 1:PHE_22:HN          1:ALA_19:HA       
1:GLX_25:HN          1:PHE_22:HB2           0.000    6.905  50.000   50.000 1000.000 
+ 1:GLX_25:HN          1:ARX_28:HD*         
1:VAX_85:HN          1:GLX_84:HA           0.000    3.677  50.000   50.000 1000.000 
+ 1:VAX_85:HN          1:GLN_82:HA
1:THR_30:HN          1:ARX_28:HB2           0.000    6.390  50.000   50.000 1000.000 
+ 1:THR_30:HN          1:ALA_65:HB*
1:LEU_74:HA          1:LEU_74:HN           0.000    3.876  50.000   50.000 1000.000 
+ 1:LEU_74:HA          1:GLX_75:HN          
1:GLX_84:HN          1:GLX_84:HG2           0.000    4.218  50.000   50.000 1000.000 
+ 1:GLX_84:HN          1:GLN_82:HB2
1:VAX_85:HN          1:GLX_83:HN           0.000    6.953  50.000   50.000 1000.000 
+ 1:VAX_85:HN          1:GLNC_87:HE21    
1:GLN_4:HN          1:GLN_3:HB2           0.000    4.647  50.000   50.000 1000.000 
+ 1:GLN_4:HN          1:GLX_70:HG2
1:LYX_5:HN          1:ILE_64:HG12           0.000    4.548  50.000   50.000 1000.000 
+ 1:LYX_5:HN          1:THR_62:HG2*
1:ARX_9:HN          1:LEU_10:HA           0.000    5.937  50.000   50.000 1000.000 
+ 1:ARX_9:HN          1:THR_57:HA
1:LEU_10:HN          1:ARX_9:HB*           0.000    4.255  50.000   50.000 1000.000 
+ 1:LEU_10:HN         1:ARX_9:HG1  
1:GLY_13:HN          1:LEU_10:HA           0.000    5.546  50.000   50.000 1000.000 
+ 1:GLY_13:HN         1:THR_57:HA  
1:GLY_13:HN          1:LEU_10:HG           0.000    4.807  50.000   50.000 1000.000 
+ 1:GLY_13:HN         1:LEU_21:HD2*  
1:ALA_19:HN          1:LEU_21:HD2*           0.000    6.479  50.000   50.000 1000.000 
+ 1:ALA_19:HN         1:LEU_50:HD1*
1:ALA_20:HN          1:LEU_50:HD1*           0.000    5.388  50.000   50.000 1000.000 
+ 1:ALA_20:HN         1:LEU_21:HD2*
1:LEU_21:HN          1:GLN_24:HE22           0.000    7.738  50.000   50.000 1000.000 
+ 1:VAL_23:HN         1:GLN_24:HE22
1:LEU_21:HN          1:PHE_22:HE*           0.000    9.257  50.000   50.000 1000.000 
+ 1:VAL_23:HN         1:PHE_22:HE*
1:LEU_21:HN          1:PRO_18:HA           0.000    4.865  50.000   50.000 1000.000 
+ 1:VAL_23:HN         1:PRO_18:HA
+ 1:LEU_21:HN         1:GLY_13:HA1
+ 1:VAL_23:HN         1:GLY_13:HA1
1:LEU_21:HN          1:ALA_19:HB*           0.000    4.981  50.000   50.000 1000.000 
+ 1:VAL_23:HN         1:ALA_19:HB*
1:VAL_33:HN          1:PHE_34:HD*           0.000    8.692  50.000   50.000 1000.000 
+ 1:VAL_33:HN         1:ASN_43:HD22 
1:VAL_33:HN          1:PHE_34:HD*           0.000    8.692  50.000   50.000 1000.000 
+ 1:VAL_33:HN         1:ASN_43:HD22
1:PHE_34:HN          1:PHE_34:HD*           0.000    5.708  50.000   50.000 1000.000 
+ 1:PHE_34:HN         1:ASN_43:HD22
1:LEU_35:HN          1:PHE_34:HD*           0.000    6.267  50.000   50.000 1000.000 
+ 1:LEU_35:HN         1:ASN_43:HD22
1:LYX_37:HN          1:THR_59:HB           0.000    6.205  50.000   50.000 1000.000 
+ 1:LYX_37:HN         1:THR_62:HB 
1:VAL_42:HN          1:PHE_34:HD*           0.000    8.063  50.000   50.000 1000.000 
+ 1:VAL_42:HN         1:ASN_43:HD22  
1:SER_46:HN          1:VAL_33:HG2*           0.000    7.250  50.000   50.000 1000.000 
+ 1:SER_46:HN         1:LEU_35:HD* 
1:LEU_50:HN          1:PHE_22:HB2           0.000    8.828  50.000   50.000 1000.000 
+ 1:LEU_50:HN         1:ASN_43:HB1 
1:ALA_54:HN          1:LEU_35:HD2*           0.000    7.121  50.000   50.000 1000.000 
+ 1:ALA_54:HN         1:VAL_61:HG2*
1:GLY_58:HN          1:LEU_86:HG           0.000    6.621  50.000   50.000 1000.000 
+ 1:GLY_58:HN         1:LYX_11:HB1   
1:VAL_61:HN          1:VAL_8:HA           0.000    7.594  50.000   50.000 1000.000 
+ 1:VAL_61:HN         1:LYX_37:HA 
1:VAL_61:HN          1:THR_62:HB           0.000    6.476  50.000   50.000 1000.000 
+ 1:VAL_61:HN         1:THR_59:HB
1:ILE_64:HN          1:PHE_34:HD*           0.000    8.035  50.000   50.000 1000.000 
+ 1:ILE_64:HN         1:ASN_43:HD22
1:ALA_65:HN          1:PHE_34:HD*           0.000    7.577  50.000   50.000 1000.000 
+ 1:ALA_65:HN         1:GLX_70:HN     
1:VAL_6:HN          1:PHE_34:HE*           0.000    7.016  50.000   50.000 1000.000 
+ 1:VAL_6:HN          1:GLN_82:HE21
+ 1:GLN_66:HN         1:PHE_34:HE*
+ 1:GLN_66:HN         1:GLN_82:HE21
1:VAL_6:HN          1:PHE_34:HD*           0.000    7.679  50.000   50.000 1000.000 
+ 1:VAL_6:HN          1:GLN_82:HE22
+ 1:GLN_66:HN         1:PHE_34:HD*
+ 1:GLN_66:HN         1:GLN_82:HE22
1:VAL_6:HN          1:LYX_5:HA           0.000    3.943  50.000   50.000 1000.000 
+ 1:VAL_6:HN          1:SER_31:HG
+ 1:VAL_6:HN          1:ALA_65:HA
+ 1:GLN_66:HN         1:LYX_5:HA  
+ 1:GLN_66:HN         1:ALA_65:HA
+ 1:VAL_6:HN          1:SER_31:HG
1:GLN_71:HN          1:ASX_69:HB2           0.000    4.730  50.000   50.000 1000.000 
+ 1:GLN_71:HN         1:GLX_70:HG1  
1:GLN_71:HN          1:GLX_70:HB1           0.000    4.449  50.000   50.000 1000.000 
+ 1:GLN_71:HN         1:GLN_71:HG*
1:GLX_72:HN          1:PHE_29:HD*           0.000    6.480  50.000   50.000 1000.000 
+ 1:GLX_72:HN         1:PHE_29:HE* 
1:GLX_72:HN          1:GLX_72:HA           0.000    3.730  50.000   50.000 1000.000 
+ 1:GLX_72:HN         1:GLN_71:HA
1:GLX_72:HN          1:GLX_72:HB*           0.000    3.426  50.000   50.000 1000.000 
+ 1:GLX_72:HN         1:GLN_71:HB*
1:ALA_73:HN          1:LEU_74:HB1           0.000    5.364  50.000   50.000 1000.000 
+ 1:ALA_73:HN         1:GLX_70:HB2
1:LEU_74:HN          1:GLX_72:HN           0.000    5.065  50.000   50.000 1000.000 
+ 1:GLX_75:HN             1:GLX_72:HN 
1:LEU_74:HN          1:LYX_5:HA           0.000    7.331  50.000   50.000 1000.000 
+ 1:LEU_74:HN         1:ALA_65:HA 
+ 1:LEU_74:HN         1:SER_31:HG 
1:LEU_74:HN          1:LEU_74:HB1           0.000    3.593  50.000   50.000 1000.000 
+ 1:GLX_75:HN             1:LEU_74:HB1 
1:LEU_74:HN          1:LEU_74:HB2           0.000    3.598  50.000   50.000 1000.000 
+ 1:GLX_75:HN             1:LEU_74:HB2 
1:LEU_74:HN          1:ALA_65:HB*           0.000    4.943  50.000   50.000 1000.000 
+ 1:GLX_75:HN             1:ALA_65:HB* 
1:LEU_74:HN          1:LEU_74:HD*           0.000    4.504  50.000   50.000 1000.000 
+ 1:GLX_75:HN             1:LEU_74:HD* 
1:LEU_74:HN          1:ALA_73:HB*           0.000    4.112  50.000   50.000 1000.000 
+ 1:GLX_75:HN             1:ALA_73:HB* 
1:LEU_77:HN          1:LYX_76:HA           0.000    3.660  50.000   50.000 1000.000 
+ 1:LEU_77:HN         1:LEU_77:HA 
1:LEU_77:HN          1:GLX_25:HA           0.000    5.307  50.000   50.000 1000.000 
+ 1:LEU_77:HN         1:ALA_26:HA
+ 1:LEU_77:HN         1:GLX_75:HA
1:LEU_77:HN          1:LEU_77:HB1           0.000    3.600  50.000   50.000 1000.000 
+ 1:LEU_77:HN         1:LEU_77:HG
1:ALA_78:HN          1:GLX_75:HB2           0.000    6.614  50.000   50.000 1000.000 
+ 1:ALA_78:HN         1:LYX_76:HB1
1:ALA_78:HN          1:LEU_74:HG           0.000    5.641  50.000   50.000 1000.000 
+ 1:ALA_78:HN         1:ALA_79:HB*
1:ALA_78:HN          1:LEU_77:HB2           0.000    4.058  50.000   50.000 1000.000 
+ 1:ALA_78:HN         1:ALA_78:HB*
1:ALA_78:HN          1:LEU_74:HD*           0.000    5.665  50.000   50.000 1000.000 
+ 1:ALA_78:HN         1:VAL_8:HG2*
1:ALA_79:HN          1:GLX_75:HB*           0.000    6.878  50.000   50.000 1000.000 
+ 1:ALA_79:HN         1:LYX_76:HB1
1:TYR_80:HN          1:PHE_22:HD*           0.000    5.305  50.000   50.000 1000.000 
+ 1:TYR_80:HN         1:TYR_80:HD*   
1:TYR_80:HN          1:LEU_77:HB2           0.000    5.513  50.000   50.000 1000.000 
+ 1:TYR_80:HN         1:ALA_78:HB*
1:VAX_81:HN          1:PHE_22:HD*           0.000    5.765  50.000   50.000 1000.000 
+ 1:VAX_81:HN         1:TYR_80:HD*
1:VAX_81:HN          1:VAX_81:HA           0.000    4.027  50.000   50.000 1000.000 
+ 1:VAX_81:HN         1:ALA_79:HA       
1:VAX_81:HN          1:VAL_8:HG1*           0.000    6.311  50.000   50.000 1000.000 
+ 1:VAX_81:HN         1:VAL_8:HG2*
+ 1:VAX_81:HN         1:LEU_10:HD* 
1:GLN_82:HN          1:LYX_11:HB1           0.000    6.344  50.000   50.000 1000.000 
+ 1:GLN_82:HN         1:ALA_79:HB* 
1:GLX_83:HN          1:GLN_82:HB2           0.000    4.168  50.000   50.000 1000.000 
+ 1:GLX_83:HN         1:GLX_83:HB1
1:GLX_83:HN          1:VAL_8:HG2*           0.000    6.113  50.000   50.000 1000.000 
+ 1:GLX_83:HN         1:LEU_86:HD2*
1:GLX_84:HN          1:LYX_11:HG2           0.000    3.972  50.000   50.000 1000.000 
+ 1:GLX_84:HN         1:GLX_84:HB1
1:GLX_84:HN          1:LYX_11:HB2           0.000    4.041  50.000   50.000 1000.000 
+ 1:GLX_84:HN         1:GLX_83:HB2
+ 1:GLX_84:HN         1:GLX_84:HB*
1:GLX_84:HN          1:LYX_11:HB1           0.000    4.952  50.000   50.000 1000.000 
+ 1:GLX_84:HN         1:LEU_86:HB1
+ 1:GLX_84:HN         1:LEU_86:HG
1:VAX_85:HN          1:LYX_11:HG1           0.000    4.053  50.000   50.000 1000.000 
+ 1:VAX_85:HN         1:GLX_84:HB1 
+ 1:VAX_85:HN         1:VAX_85:HB 
1:VAX_85:HN          1:LYX_11:HB2           0.000    4.378  50.000   50.000 1000.000 
+ 1:VAX_85:HN         1:GLX_84:HB2 
1:LEU_86:HN          1:LEU_86:HB2           0.000    3.535  50.000   50.000 1000.000 
+ 1:LEU_86:HN         1:LEU_86:HG 
1:LEU_86:HN          1:VAX_85:HG*           0.000    4.355  50.000   50.000 1000.000 
+ 1:LEU_86:HN         1:LEU_86:HD1*
1:GLNC_87:HN          1:LEU_86:HA           0.000    3.867  50.000   50.000 1000.000 
+ 1:GLNC_87:HN        1:GLNC_87:HA 
1:GLNC_87:HN          1:ARX_9:HG1           0.000    5.205  50.000   50.000 1000.000 
+ 1:GLNC_87:HN        1:GLNC_87:HB2
1:GLNC_87:HN          1:LEU_86:HB1           0.000    5.174  50.000   50.000 1000.000 
+ 1:GLNC_87:HN        1:LEU_86:HG
1:GLNC_87:HN          1:LEU_86:HD1*           0.000    7.675  50.000   50.000 1000.000 
+ 1:GLNC_87:HN        1:LEU_10:HD*
1:VAL_8:HN          1:VAL_8:HG2*           0.000    4.837  50.000   50.000 1000.000 
+ 1:VAL_8:HN          1:VAL_61:HG1*
1:GLN_71:HE22          1:GLN_71:HA           0.000    6.122  50.000   50.000 1000.000 
+ 1:GLN_71:HE22       1:GLX_72:HA
+ 1:GLN_71:HE22       1:GLX_75:HA
1:VAL_33:HN          1:ASX_32:HA           0.000    4.040  50.000   50.000 1000.000 
+ 1:VAL_33:HN          1:ASN_27:HA
+ 1:VAL_33:HN          1:GLN_3:HA
1:ARX_9:HN          1:VAL_8:HG2*           0.000    4.896  50.000   50.000 1000.000 
+ 1:ARX_9:HN          1:LEU_10:HD*
1:THR_12:HA          1:LYX_11:HB1           0.000    4.171  50.000   50.000 1000.000 
+ 1:THR_12:HA         1:LYX_11:HD1
+ 1:THR_12:HA         1:LEU_86:HB1
+ 1:THR_12:HA         1:LEU_86:HG
1:LEU_50:HN          1:LEU_50:HB1           0.000    4.236  50.000   50.000 1000.000 
+ 1:LEU_50:HN        1:LEU_50:HG          
1:LYX_11:HN          1:LEU_86:HG           0.000    4.531  50.000   50.000 1000.000 
+ 1:LYX_11:HN          1:LYX_11:HB1
1:GLX_7:HA          1:VAL_6:HN           0.000    3.350  50.000   50.000 1000.000 
+ 1:GLX_7:HA          1:LEU_63:HN
+ 1:GLX_7:HA          1:THR_62:HN
1:THR_12:HA          1:LYX_11:HE1           0.000    4.322  50.000   50.000 1000.000 
1:THR_12:HA          1:LYX_11:HG1           0.000    3.931  50.000   50.000 1000.000 
+ 1:THR_12:HA        1:PRO_18:HG2        
1:GLN_24:HA          1:ASN_27:HB*           0.000    3.933  50.000   50.000 1000.000 
+ 1:GLN_24:HA         1:ARX_28:HD*
1:GLX_25:HA          1:ARX_28:HD*           0.000    3.888  50.000   50.000 1000.000 
+ 1:GLX_25:HA         1:LYX_76:HE*
1:ALA_19:HA          1:PHE_22:HB1           0.000    4.629  50.000   50.000 1000.000 
+ 1:ALA_20:HA          1:PHE_22:HB1
1:VAX_55:HA          1:LEU_14:HG           0.000    6.399  50.000   50.000 1000.000 
+ 1:VAX_55:HA         1:ALA_54:HB*
1:LYX_5:HA          1:THR_62:HG2*           0.000    5.021  50.000   50.000 1000.000 
+ 1:LYX_5:HA          1:ILE_64:HG12
1:THR_12:HA          1:LYX_11:HD1           0.000    3.894  50.000   50.000 1000.000 
+ 1:THR_12:HA         1:LYX_11:HB1
+ 1:THR_12:HA         1:LEU_86:HB1
+ 1:THR_12:HA         1:LEU_86:HG
1:LEU_14:HA          1:PRO_18:HB1           0.000    5.338  50.000   50.000 1000.000 
+ 1:LEU_14:HA         1:PRO_18:HG1
1:PHE_22:HB1          1:ALA_19:HA           0.000    3.973  50.000   50.000 1000.000 
+ 1:PHE_22:HB1         1:ALA_20:HA
1:PHE_22:HB2          1:ALA_19:HA           0.000    4.624  50.000   50.000 1000.000 
+ 1:PHE_22:HB2         1:ALA_20:HA
1:GLN_24:HA          1:ASN_27:HB*           0.000    3.933  50.000   50.000 1000.000 
+ 1:GLN_24:HA         1:ARX_28:HD*
1:MET_48:HA          1:ILE_47:HD1*           0.000    4.607  50.000   50.000 1000.000 
+ 1:MET_48:HA         1:ILE_47:HG21
1:GLY_49:HA*          1:LEU_53:HD1*           0.000    4.518  50.000   50.000 1000.000 
1:MET_51:HA          1:LEU_14:HB1           0.000    3.923  50.000   50.000 1000.000 
+ 1:MET_51:HA         1:LEU_50:HB2
1:VAX_55:HA          1:LEU_14:HG           0.000    6.399  50.000   50.000 1000.000 
+ 1:VAX_55:HA         1:ALA_54:HB*
1:THR_62:HA          1:LEU_35:HD1*           0.000    6.677  50.000   50.000 1000.000 
+ 1:THR_62:HA         1:LEU_63:HB2
1:ALA_65:HA          1:GLN_3:HG2           0.000    5.303  50.000   50.000 1000.000 
+ 1:ALA_65:HA         1:GLX_70:HB1
+ 1:ALA_65:HA         1:GLN_66:HG1
1:ALA_65:HA          1:VAL_33:HG1*           0.000    4.237  50.000   50.000 1000.000 
1:GLY_67:HA2          1:GLN_66:HG*           0.000    4.743  50.000   50.000 1000.000 
+ 1:GLY_67:HA2        1:GLX_68:HG*
1:ASX_69:HA          1:GLX_68:HG*           0.000    4.771  50.000   50.000 1000.000 
+ 1:ASX_69:HA         1:GLX_72:HG*
1:ALA_73:HA          1:PHE_29:HD*           0.000    3.898  50.000   50.000 1000.000 
+ 1:ALA_73:HA         1:PHE_29:HE*
1:LEU_74:HA          1:ALA_73:HB*           0.000    5.915  50.000   50.000 1000.000 
+ 1:LEU_74:HA         1:LEU_77:HD1*
1:LEU_77:HA          1:PHE_22:HE*           0.000    5.030  50.000   50.000 1000.000 
+ 1:LEU_77:HA         1:TYR_80:HD*
1:LEU_77:HA          1:TYR_80:HB2           0.000    4.735  50.000   50.000 1000.000 
+ 1:LEU_77:HA         1:PHE_22:HB1
1:TYR_80:HA          1:GLN_82:HB2           0.000    5.936  50.000   50.000 1000.000 
+ 1:TYR_80:HA         1:GLX_83:HB1
1:LYX_11:HE*          1:GLN_82:HA           0.000    4.883  50.000   50.000 1000.000 
+ 1:LYX_11:HE*         1:GLX_84:HA
1:LEU_86:HA          1:GLNC_87:HE22           0.000    5.010  50.000   50.000 1000.000 
+ 1:LEU_86:HA         1:THR_12:HN
1:GLX_68:HA          1:ALA_65:HB*           0.000    6.785  50.000   50.000 1000.000 
+ 1:GLX_68:HA          1:VAL_2:HG21
1:GLY_13:HN          1:SER_56:HA           0.000    5.584  50.000   50.000 1000.000 
+ 1:GLY_13:HN          1:LEU_14:HA
1:GLN_66:HE21          1:ASX_69:HN           0.000    9.166  50.000   50.000 1000.000 
+ 1:GLN_66:HE21          1:PHE_34:HE*
1:VAL_8:HN          1:VAL_61:HA           0.000    4.216  50.000   50.000 1000.000 
+ 1:VAL_8:HN          1:THR_62:HA
1:TYR_80:HB1          1:ALA_79:HB*           0.000    5.171  50.000   50.000 1000.000 
+ 1:TYR_80:HB1        1:LYX_76:HG2 
1:TYR_80:HB2          1:ALA_79:HB*           0.000    4.680  50.000   50.000 1000.000 
+ 1:TYR_80:HB2        1:LYX_76:HG2 
1:ASN_43:HB2          1:GLY_49:HA*           0.000    5.446  50.000   50.000 1000.000 
+ 1:ASN_43:HB2        1:SER_46:HB2
1:ASN_43:HB2          1:ALA_44:HA           0.000    7.886  50.000   50.000 1000.000 
+ 1:ASN_43:HB2        1:SER_46:HB1
1:ASN_43:HB1          1:ALA_44:HA           0.000    7.535  50.000   50.000 1000.000 
+ 1:ASN_43:HB1        1:SER_46:HB1
1:PHE_34:HB2          1:ILE_64:HG12           0.000    4.849  50.000   50.000 1000.000 
1:PHE_34:HB2          1:LYX_41:HG1           0.000    4.929  50.000   50.000 1000.000 
+ 1:PHE_34:HB2        1:ALA_44:HB*
1:GLN_82:HG1          1:VAL_8:HG1*           0.000    4.630  50.000   50.000 1000.000 
1:GLN_82:HG2          1:VAL_8:HG1*           0.000    5.488  50.000   50.000 1000.000 
1:MET_51:HB1          1:ILE_47:HG2*           0.000    6.139  50.000   50.000 1000.000 
+ 1:MET_51:HB1        1:ILE_47:HD1*
1:GLN_3:HG1          1:ILE_64:HG2*           0.000    4.310  50.000   50.000 1000.000 
1:GLN_3:HG1          1:ILE_64:HG2*           0.000    4.469  50.000   50.000 1000.000 
1:GLX_72:HG*          1:PHE_29:HD*           0.000    4.779  50.000   50.000 1000.000 
+ 1:GLX_72:HG*        1:PHE_29:HE*
1:GLX_75:HG1          1:LEU_74:HG           0.000    4.734  50.000   50.000 1000.000 
+ 1:GLX_75:HG1        1:ALA_79:HB*
1:LEU_77:HB1          1:VAL_23:HA           0.000    5.176  50.000   50.000 1000.000 
+ 1:LEU_77:HB1        1:LEU_74:HA
1:GLX_36:HB2          1:VAL_61:HG2*           0.000    5.838  50.000   50.000 1000.000 
+ 1:GLX_36:HB2        1:ILE_64:HD1*
1:ILE_64:HG12          1:LYX_5:HB2           0.000    7.064  50.000   50.000 1000.000 
+ 1:ILE_64:HG12       1:GLN_3:HB2
1:LEU_14:HD*          1:PHE_22:HB2           0.000    7.096  50.000   50.000 1000.000 
+ 1:LEU_14:HD*        1:ASN_43:HB1 
1:ILE_64:HD1*          1:GLN_3:HB1           0.000    5.411  50.000   50.000 1000.000 
+ 1:ILE_64:HD1*       1:LYX_5:HD2
1:PRO_18:HD2          1:ALA_16:HB*           0.000    6.633  50.000   50.000 1000.000 
+ 1:PRO_18:HD2        1:ALA_20:HB*
1:GLX_70:HN          1:GLX_70:HG2           0.000    4.688  50.000   50.000 1000.000 
+ 1:GLX_70:HN          1:GLX_68:HB*
1:ASN_27:HD22          1:LEU_74:HB1           0.000    8.983  50.000   50.000 1000.000 
+ 1:ASN_27:HD22          1:LYX_45:HG*
1:LYX_5:HN          1:LYX_5:HD2           0.000    4.060  50.000   50.000 1000.000 
+ 1:LYX_5:HN          1:GLN_4:HB*
1:LEU_10:HN          1:THR_57:HA           0.000    5.011  50.000   50.000 1000.000 
+ 1:LEU_10:HN          1:LEU_10:HA
1:ILE_64:HD1*          1:GLX_36:HA           0.000    6.159  50.000   50.000 1000.000 
+ 1:ILE_64:HD1*          1:PHE_34:HA
+ 1:ILE_64:HD1*          1:ALA_65:HA
+ 1:ILE_64:HD1*          1:SER_31:HG
1:GLN_82:HB1          1:LYX_11:HE1           0.000    5.168  50.000   50.000 1000.000 
1:PHE_34:HA          1:VAL_33:HG1*           0.000    4.892  50.000   50.000 1000.000 
+ 1:PHE_34:HA          1:VAL_42:HG2*
1:GLY_39:HN          1:LYX_40:HB*           0.000    4.928  50.000   50.000 1000.000 
+ 1:GLY_39:HN          1:GLX_36:HG2
+ 1:GLY_39:HN          1:LYX_37:HB1 
1:PHE_22:HN          1:GLN_24:HE22           0.000    6.168  50.000   50.000 1000.000 
+ 1:PHE_22:HN          1:TYR_80:HE*
1:ASN_27:HN          1:VAL_23:HB           0.000    5.656  50.000   50.000 1000.000 
+ 1:ASN_27:HN          1:GLX_25:HG1
+ 1:ASN_27:HN          1:LYX_45:HB*
1:GLY_13:HN          1:LYX_11:HB2           0.000    6.784  50.000   50.000 1000.000 
+ 1:GLY_13:HN          1:ARX_9:HG2
1:ASX_69:HN          1:LEU_74:HD*           0.000    7.506  50.000   50.000 1000.000 
+ 1:ASX_69:HN          1:VAL_33:HG1*
1:PHE_22:HN          1:ALA_19:HB*           0.000    5.171  50.000   50.000 1000.000 
+ 1:PHE_22:HN          1:THR_12:HG2*
1:GLN_82:HN          1:ALA_79:HA           0.000    4.710  50.000   50.000 1000.000 
+ 1:GLN_82:HN          1:VAX_81:HA
+ 1:GLN_82:HN          1:GLX_83:HA
1:THR_59:HN          1:GLY_58:HA2           0.000    5.136  50.000   50.000 1000.000 
+ 1:THR_59:HN          1:THR_57:HA
1:GLX_7:HA          1:GLX_7:HG1           0.000    4.356  50.000   50.000 1000.000 
1:LYX_5:HA          1:ILE_64:HG12           0.000    3.912  50.000   50.000 1000.000 
1:GLX_7:HA          1:VAL_8:HG2*           0.000    3.731  50.000   50.000 1000.000 
1:GLY_13:HA2          1:LEU_10:HD*           0.000    3.973  50.000   50.000 1000.000 
+ 1:GLY_13:HA2       1:VAX_55:HG* 
1:LEU_14:HA          1:ALA_19:HA           0.000    4.777  50.000   50.000 1000.000 
+ 1:LEU_14:HA         1:ALA_20:HA
1:LEU_14:HD*          1:ALA_19:HA           0.000    5.472  50.000   50.000 1000.000 
+ 1:LEU_14:HD*         1:ALA_20:HA
+ 1:LEU_14:HD*         1:ALA_54:HA
1:GLN_24:HB*          1:VAL_23:HG2*           0.000    6.217  50.000   50.000 1000.000 
+ 1:GLN_24:HB*        1:LEU_21:HD2*
1:ALA_26:HB*          1:VAL_23:HA           0.000    4.660  50.000   50.000 1000.000 
+ 1:ALA_26:HB*        1:LEU_74:HA
1:ASN_43:HB2          1:VAL_42:HA           0.000    6.763  50.000   50.000 1000.000 
+ 1:ASN_43:HB2        1:SER_46:HA
1:ALA_44:HA          1:PHE_34:HB1           0.000    5.867  50.000   50.000 1000.000 
+ 1:ALA_44:HA         1:ASN_43:HB1
1:SER_46:HN          1:ALA_44:HN           0.000    5.176  50.000   50.000 1000.000 
+ 1:SER_46:HN          1:ILE_47:HN
1:ALA_44:HN          1:SER_46:HN           0.000    6.354  50.000   50.000 1000.000 
+ 1:ALA_44:HN          1:ASN_27:HD21
1:SER_46:HN          1:LYX_45:HB*           0.000    6.089  50.000   50.000 1000.000 
+ 1:SER_46:HN          1:VAL_23:HB
1:ASN_43:HN          1:VAL_42:HA           0.000    3.750  50.000   50.000 1000.000 
+ 1:ASN_43:HN         1:SER_46:HA
1:LYX_45:HN          1:ASN_43:HA           0.000    4.945  50.000   50.000 1000.000 
+ 1:LYX_45:HN          1:ASX_32:HA
1:SER_46:HN          1:SER_46:HB2           0.000    4.414  50.000   50.000 1000.000 
+ 1:SER_46:HN          1:GLY_49:HA*
1:LYX_45:HN          1:SER_46:HB2           0.000    5.897  50.000   50.000 1000.000 
+ 1:LYX_45:HN          1:GLY_49:HA*
1:LEU_35:HB1          1:VAL_61:HB           0.000    5.035  50.000   50.000 1000.000 
+ 1:LEU_35:HB1          1:VAL_42:HB 
1:VAL_33:HN          1:ASX_32:HB2           0.000    4.347  50.000   50.000 1000.000 
1:ARX_9:HN          1:LYX_11:HE2           0.000    7.134  50.000   50.000 1000.000 
1:ALA_44:HN          1:SER_46:HN           0.000    6.929  50.000   50.000 1000.000 
+ 1:ALA_44:HN          1:ASN_27:HD21
1:LYX_45:HN          1:VAL_33:HB           0.000    6.275  50.000   50.000 1000.000 
+ 1:LYX_45:HN          1:LEU_50:HB2
1:LYX_45:HN          1:VAL_33:HG2*           0.000    6.407  50.000   50.000 1000.000 
+ 1:LYX_45:HN          1:LEU_35:HD2*
1:ASX_38:HB2          1:LYX_40:HG2           0.000    4.798  50.000   50.000 1000.000 
+ 1:ASX_38:HB2          1:LYX_37:HG2
1:LYX_40:HB*          1:LEU_53:HD2*           0.000    4.478  50.000   50.000 1000.000 
+ 1:LYX_40:HB*          1:VAL_42:HG2*
1:PHE_34:HA          1:ALA_44:HB*           0.000    4.497  50.000   50.000 1000.000 
+ 1:PHE_34:HA          1:LYX_41:HG1
+ 1:PHE_34:HA          1:LYX_41:HD1
1:LYX_40:HN          1:LYX_40:HB*           0.000    3.651  50.000   50.000 1000.000 
+ 1:LYX_40:HN          1:LYX_37:HB1
1:LYX_41:HN          1:LYX_40:HB*           0.000    4.654  50.000   50.000 1000.000 
+ 1:LYX_41:HN          1:GLX_36:HG2
+ 1:LYX_41:HN          1:LYX_37:HB1
1:LYX_37:HN          1:VAL_61:HG1*           0.000    5.608  50.000   50.000 1000.000 
+ 1:LYX_37:HN          1:LEU_53:HD*
1:LYX_37:HN          1:VAL_61:HG2*           0.000    6.450  50.000   50.000 1000.000 
+ 1:LYX_37:HN          1:LEU_35:HD2*
1:ASN_43:HN          1:SER_46:HB2           0.000    5.421  50.000   50.000 1000.000 
+ 1:ASN_43:HN          1:GLY_49:HA*
1:LYX_41:HG1          1:VAL_42:HG1*           0.000    5.564  50.000   50.000 1000.000 
+ 1:LYX_41:HG1          1:ILE_64:HD1*
1:VAL_42:HG2*          1:LEU_53:HB1           0.000    6.765  50.000   50.000 1000.000 
+ 1:VAL_42:HG2*          1:LYX_45:HG*
1:PHE_34:HB2          1:ILE_64:HB           0.000    4.253  50.000   50.000 1000.000 
+ 1:PHE_34:HB2          1:LYX_41:HB1
1:GLX_7:HN          1:LYX_5:HD2           0.000    4.276  50.000   50.000 1000.000 
+ 1:GLX_7:HN          1:VAL_6:HB
1:GLX_7:HN          1:LYX_5:HD1           0.000    5.260  50.000   50.000 1000.000 
+ 1:GLX_7:HN          1:VAL_6:HG1*
1:ASN_27:HA          1:SER_31:HB2           0.000    4.586  50.000   50.000 1000.000 
+ 1:ASN_27:HA          1:LYX_45:HE*
1:LYX_5:HA          1:LEU_74:HG           0.000    4.281  50.000   50.000 1000.000 
+ 1:LYX_5:HA          1:LEU_74:HB2
1:THR_30:HN          1:SER_31:HB2           0.000    6.399  50.000   50.000 1000.000 
+ 1:THR_30:HN          1:LYX_45:HE*
1:GLX_7:HN          1:LEU_63:HN           0.000    4.620  50.000   50.000 1000.000 
+ 1:GLX_7:HN          1:VAL_6:HN
1:ALA_44:HA          1:VAL_33:HG1*           0.000    4.790  50.000   50.000 1000.000 
+ 1:ALA_44:HA          1:VAL_42:HG2*    
1:VAL_33:HN          1:SER_31:HB2           0.000    5.138  50.000   50.000 1000.000 
+ 1:VAL_33:HN          1:LYX_45:HE*
1:ALA_65:HN          1:GLN_66:HB2           0.000    5.371  50.000   50.000 1000.000 
+ 1:ALA_65:HN          1:LYX_5:HB2
1:GLX_70:HN          1:ALA_65:HA           0.000    5.645  50.000   50.000 1000.000 
+ 1:GLX_70:HN          1:SER_31:HG
1:MET_48:HB2          1:LEU_53:HD2*           0.000    5.200  50.000   50.000 1000.000 
+ 1:MET_48:HB2          1:VAL_42:HG2*
1:GLY_67:HN          1:GLX_70:HG2           0.000    5.305  50.000   50.000 1000.000 
+ 1:GLY_67:HN          1:GLN_66:HB1
1:PHE_29:HN          1:SER_31:HB2           0.000    6.720  50.000   50.000 1000.000 
+ 1:PHE_29:HN          1:LYX_45:HE*
1:GLX_70:HN          1:GLY_67:HA2           0.000    5.583  50.000   50.000 1000.000 
+ 1:GLX_70:HN          1:GLX_70:HA
1:VAL_23:HN          1:LEU_14:HD*           0.000    6.774  50.000   50.000 1000.000 
+ 1:LEU_21:HN         1:LEU_14:HD*  
1:PHE_22:HB2          1:LEU_14:HD*           0.000    6.568  50.000   50.000 1000.000 
+ 1:ASX_38:HB1          1:LEU_14:HD* 
1:ALA_19:HB*          1:LEU_14:HD*           0.000    6.149  50.000   50.000 1000.000 
+ 1:ALA_20:HB*          1:LEU_14:HD* 
1:GLY_67:HN          1:GLX_70:HG1           0.000    6.571  50.000   50.000 1000.000 
+ 1:GLY_67:HN          1:ASX_69:HB2
1:GLX_7:HN          1:VAL_8:HG2*           0.000    6.257  50.000   50.000 1000.000 
+ 1:GLX_7:HN          1:LEU_74:HD*
1:GLN_15:HN          1:PRO_18:HG2           0.000    4.666  50.000   50.000 1000.000 
+ 1:GLN_15:HN          1:VAX_55:HB
1:ALA_65:HN          1:ALA_65:HA           0.000    4.673  50.000   50.000 1000.000 
+ 1:ALA_65:HN          1:LYX_5:HA
+ 1:ALA_65:HN          1:SER_31:HG
1:ASX_32:HN          1:ALA_65:HA           0.000    4.796  50.000   50.000 1000.000 
+ 1:ASX_32:HN          1:SER_31:HG
1:PHE_34:HN          1:ALA_65:HA           0.000    5.213  50.000   50.000 1000.000 
+ 1:PHE_34:HN          1:SER_31:HG
+ 1:PHE_34:HN          1:LYX_5:HA
1:GLY_67:HN          1:ALA_65:HA           0.000    6.305  50.000   50.000 1000.000 
+ 1:GLY_67:HN          1:SER_31:HG
1:VAL_33:HN          1:ALA_65:HA           0.000    5.870  50.000   50.000 1000.000 
+ 1:VAL_33:HN          1:SER_31:HG
1:GLX_68:HN          1:ALA_65:HA           0.000    5.837  50.000   50.000 1000.000 
+ 1:GLX_68:HN          1:SER_31:HG
1:ASX_69:HN          1:ALA_65:HA           0.000    3.925  50.000   50.000 1000.000 
+ 1:ASX_69:HN          1:SER_31:HG
1:GLY_67:HA2          1:ALA_65:HA           0.000    6.283  50.000   50.000 1000.000 
+ 1:GLY_67:HA2          1:SER_31:HG
1:VAL_33:HG2*          1:ALA_65:HA           0.000    7.126  50.000   50.000 1000.000 
+ 1:VAL_33:HG2*          1:SER_31:HG
1:GLY_49:HN          1:MET_48:HG*           0.000    5.161  50.000   50.000 1000.000 
+ 1:GLY_49:HN          1:MET_48:HE*
1:SER_52:HN          1:MET_48:HG*           0.000    5.649  50.000   50.000 1000.000 
+ 1:SER_52:HN          1:MET_48:HE*
1:SER_52:HN          1:MET_51:HG*           0.000    4.974  50.000   50.000 1000.000 
+ 1:SER_52:HN          1:MET_51:HE* 
1:LEU_50:HN          1:MET_51:HG*           0.000    8.117  50.000   50.000 1000.000 
+ 1:LEU_50:HN          1:MET_51:HE*
1:MET_48:HA          1:MET_51:HG*           0.000    3.998  50.000   50.000 1000.000 
+ 1:MET_48:HA          1:MET_51:HE*
#NMR_dihedral
1:GLN_4:C  1:GLN_4:CA  1:GLN_4:N  1:GLN_3:C   200  236  50.000   50.000   100.000 
1:LYX_5:C  1:LYX_5:CA  1:LYX_5:N  1:GLN_4:C   190  210  50.000   50.000   100.000 
1:GLX_7:C  1:GLX_7:CA  1:GLX_7:N  1:VAL_6:C   260  310  50.000   50.000   100.000 
1:VAL_8:C  1:VAL_8:CA  1:VAL_8:N  1:GLX_7:C   200  260  50.000   50.000   100.000 
1:LYX_11:C  1:LYX_11:CA  1:LYX_11:N  1:LEU_10:C   265  285  50.000   50.000   100.000 
1:ALA_19:C  1:ALA_19:CA  1:ALA_19:N  1:PRO_18:C   280  305  50.000   50.000   100.000 
1:ALA_20:C  1:ALA_20:CA  1:ALA_20:N  1:ALA_19:C   290  320  50.000   50.000   100.000 
1:GLN_24:C  1:GLN_24:CA  1:GLN_24:N  1:VAL_23:C   290  315  50.000   50.000   100.000 
1:GLX_25:C  1:GLX_25:CA  1:GLX_25:N  1:GLN_24:C   285  305  50.000   50.000   100.000 
1:ALA_26:C  1:ALA_26:CA  1:ALA_26:N  1:GLX_25:C   300  320  50.000   50.000   100.000 
1:ASN_27:C  1:ASN_27:CA  1:ASN_27:N  1:ALA_26:C   295  310  50.000   50.000   100.000 
1:ARX_28:C  1:ARX_28:CA  1:ARX_28:N  1:ASN_27:C   270  310  50.000   50.000   100.000 
1:THR_30:C  1:THR_30:CA  1:THR_30:N  1:PHE_29:C   200  280  50.000   50.000   100.000 
1:PHE_34:C  1:PHE_34:CA  1:PHE_34:N  1:VAL_33:C   200  280  50.000   50.000   100.000 
1:LEU_35:C  1:LEU_35:CA  1:LEU_35:N  1:PHE_34:C   200  230  50.000   50.000   100.000 
1:GLX_36:C  1:GLX_36:CA  1:GLX_36:N  1:LEU_35:C   200  280  50.000   50.000   100.000 
1:LYX_41:C  1:LYX_41:CA  1:LYX_41:N  1:LYX_40:C   200  280  50.000   50.000   100.000 
1:VAL_42:C  1:VAL_42:CA  1:VAL_42:N  1:LYX_41:C   200  280  50.000   50.000   100.000 
1:VAL_42:C  1:VAL_42:CA  1:VAL_42:N  1:LYX_41:C   200  230  50.000   50.000   100.000 
1:ALA_44:C  1:ALA_44:CA  1:ALA_44:N  1:ASN_43:C   270  310  50.000   50.000   100.000 
1:SER_46:C  1:SER_46:CA  1:SER_46:N  1:LYX_45:C   260  290  50.000   50.000   100.000 
1:LEU_50:C  1:LEU_50:CA  1:LEU_50:N  1:GLY_49:C   290  330  50.000   50.000   100.000 
1:MET_51:C  1:MET_51:CA  1:MET_51:N  1:LEU_50:C   285  325  50.000   50.000   100.000 
1:SER_52:C  1:SER_52:CA  1:SER_52:N  1:MET_51:C   280  320  50.000   50.000   100.000 
1:LEU_53:C  1:LEU_53:CA  1:LEU_53:N  1:SER_52:C   280  320  50.000   50.000   100.000 
1:GLX_60:C  1:GLX_60:CA  1:GLX_60:N  1:THR_59:C   255  295  50.000   50.000   100.000 
1:ILE_64:C  1:ILE_64:CA  1:ILE_64:N  1:LEU_63:C   250  290  50.000   50.000   100.000 
1:GLX_68:C  1:GLX_68:CA  1:GLX_68:N  1:GLY_67:C   290  330  50.000   50.000   100.000 
1:ASX_69:C  1:ASX_69:CA  1:ASX_69:N  1:GLX_68:C   250  290  50.000   50.000   100.000 
1:GLX_70:C  1:GLX_70:CA  1:GLX_70:N  1:ASX_69:C   290  320  50.000   50.000   100.000 
1:GLN_71:C  1:GLN_71:CA  1:GLN_71:N  1:GLX_70:C   280  320  50.000   50.000   100.000 
1:GLX_72:C  1:GLX_72:CA  1:GLX_72:N  1:GLN_71:C   280  320  50.000   50.000   100.000 
1:LEU_74:C  1:LEU_74:CA  1:LEU_74:N  1:ALA_73:C   280  320  50.000   50.000   100.000 
1:GLX_75:C  1:GLX_75:CA  1:GLX_75:N  1:LEU_74:C   280  320  50.000   50.000   100.000 
1:LYX_76:C  1:LYX_76:CA  1:LYX_76:N  1:GLX_75:C   280  320  50.000   50.000   100.000 
1:LEU_77:C  1:LEU_77:CA  1:LEU_77:N  1:LYX_76:C   280  320  50.000   50.000   100.000 
1:ALA_78:C  1:ALA_78:CA  1:ALA_78:N  1:LEU_77:C   280  320  50.000   50.000   100.000 
1:ALA_79:C  1:ALA_79:CA  1:ALA_79:N  1:ALA_78:C   280  320  50.000   50.000   100.000 
1:TYR_80:C  1:TYR_80:CA  1:TYR_80:N  1:ALA_79:C   280  320  50.000   50.000   100.000 
1:VAX_81:C  1:VAX_81:CA  1:VAX_81:N  1:TYR_80:C   280  320  50.000   50.000   100.000 
1:LEU_14:C  1:LEU_14:CA  1:LEU_14:N  1:GLY_13:C   45  100  50.000   50.000   100.000 
1:ASX_38:C  1:ASX_38:CA  1:ASX_38:N  1:LYX_37:C   45  100  50.000   50.000   100.000 
1:LEU_10:C  1:LEU_10:CA  1:LEU_10:N  1:ARX_9:C   180  360  50.000   50.000   100.000 
1:GLN_15:C  1:GLN_15:CA  1:GLN_15:N  1:LEU_14:C   180  360  50.000   50.000   100.000 
1:VAL_33:C  1:VAL_33:CA  1:VAL_33:N  1:ASX_32:C   180  360  50.000   50.000   100.000 
1:ILE_47:C  1:ILE_47:CA  1:ILE_47:N  1:SER_46:C   180  360  50.000   50.000   100.000 
1:MET_48:C  1:MET_48:CA  1:MET_48:N  1:ILE_47:C   180  360  50.000   50.000   100.000 
1:ALA_54:C  1:ALA_54:CA  1:ALA_54:N  1:LEU_53:C   180  360  50.000   50.000   100.000 
1:THR_57:C  1:THR_57:CA  1:THR_57:N  1:SER_56:C   180  360  50.000   50.000   100.000 
1:VAX_85:C  1:VAX_85:CA  1:VAX_85:N  1:GLX_84:C   180  360  50.000   50.000   100.000 
1:LEU_86:C  1:LEU_86:CA  1:LEU_86:N  1:VAX_85:C   180  360  50.000   50.000   100.000 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    VAL   2          1H        VAL   2 -16.522   5.949  -2.335
    2   2H    VAL   2          2H        VAL   2 -17.273   4.647  -3.088
    3   3H    VAL   2          3H        VAL   2 -18.108   6.092  -2.877
    4    HA   VAL   2           HA       VAL   2 -18.074   5.856  -0.542
    5    HB   VAL   2           HB       VAL   2 -19.897   4.883  -1.937
    6   1HG1  VAL   2          1HG2      VAL   2 -18.352   2.288  -1.551
    7   2HG1  VAL   2          2HG2      VAL   2 -19.990   2.432  -2.234
    8   3HG1  VAL   2          3HG2      VAL   2 -18.597   3.131  -3.096
    9   1HG2  VAL   2          1HG1      VAL   2 -20.040   4.928   0.510
   10   2HG2  VAL   2          2HG1      VAL   2 -20.830   3.477  -0.150
   11   3HG2  VAL   2          3HG1      VAL   2 -19.220   3.350   0.595
   12    H    GLN   3           H        GLN   3 -17.037   5.027   1.296
   13    HA   GLN   3           HA       GLN   3 -14.807   3.175   0.631
   14   1HB   GLN   3          1HB       GLN   3 -14.352   5.575   1.432
   15   2HB   GLN   3          2HB       GLN   3 -15.019   5.070   2.994
   16   1HG   GLN   3          1HG       GLN   3 -13.290   3.285   3.121
   17   2HG   GLN   3          2HG       GLN   3 -12.595   3.853   1.585
   18   1HE2  GLN   3          2HE2      GLN   3 -12.768   4.389   5.028
   19   2HE2  GLN   3          1HE2      GLN   3 -11.755   5.817   5.032
   20    H    GLN   4           H        GLN   4 -14.755   1.205   1.518
   21    HA   GLN   4           HA       GLN   4 -15.782   0.905   4.280
   22   1HB   GLN   4          1HB       GLN   4 -16.454  -0.861   1.908
   23   2HB   GLN   4          2HB       GLN   4 -16.432  -1.498   3.565
   24   1HG   GLN   4          1HG       GLN   4 -18.088   0.901   2.691
   25   2HG   GLN   4          2HG       GLN   4 -18.700  -0.758   2.863
   26   1HE2  GLN   4          2HE2      GLN   4 -17.429   2.062   4.616
   27   2HE2  GLN   4          1HE2      GLN   4 -17.985   1.524   6.201
   28    H    LYS   5           H        LYS   5 -14.569  -0.981   5.389
   29    HA   LYS   5           HA       LYS   5 -12.205  -1.899   3.954
   30   1HB   LYS   5          1HB       LYS   5 -10.829  -0.970   6.001
   31   2HB   LYS   5          2HB       LYS   5 -11.199   0.039   4.594
   32   1HG   LYS   5          1HG       LYS   5 -11.646   1.417   6.471
   33   2HG   LYS   5          2HG       LYS   5 -13.229   0.907   5.822
   34   1HD   LYS   5          1HD       LYS   5 -13.176  -0.974   7.558
   35   2HD   LYS   5          2HD       LYS   5 -11.713  -0.178   8.213
   36   1HE   LYS   5          1HE       LYS   5 -12.987   1.889   8.615
   37   2HE   LYS   5          2HE       LYS   5 -14.451   1.131   7.952
   38   1HZ   LYS   5          1HZ       LYS   5 -12.976   0.219  10.323
   39   2HZ   LYS   5          2HZ       LYS   5 -14.408   1.034  10.331
   40   3HZ   LYS   5          3HZ       LYS   5 -14.328  -0.489   9.704
   41    H    VAL   6           H        VAL   6 -11.388  -3.741   4.819
   42    HA   VAL   6           HA       VAL   6 -12.763  -4.724   7.281
   43    HB   VAL   6           HB       VAL   6 -12.535  -7.020   6.337
   44   1HG1  VAL   6          1HG2      VAL   6 -14.643  -5.743   6.137
   45   2HG1  VAL   6          2HG2      VAL   6 -14.066  -5.035   4.609
   46   3HG1  VAL   6          3HG2      VAL   6 -14.387  -6.784   4.714
   47   1HG2  VAL   6          1HG1      VAL   6 -10.699  -6.557   4.730
   48   2HG2  VAL   6          2HG1      VAL   6 -12.105  -7.297   3.928
   49   3HG2  VAL   6          3HG1      VAL   6 -11.802  -5.550   3.766
   50    H    GLU   7           H        GLU   7 -11.347  -4.939   8.953
   51    HA   GLU   7           HA       GLU   7  -8.502  -4.775   8.240
   52   1HB   GLU   7          1HB       GLU   7  -8.160  -4.742  10.752
   53   2HB   GLU   7          2HB       GLU   7  -9.025  -3.355  10.077
   54   1HG   GLU   7          1HG       GLU   7 -10.594  -5.699  11.164
   55   2HG   GLU   7          2HG       GLU   7  -9.890  -4.493  12.264
   56    H    VAL   8           H        VAL   8  -6.970  -6.169   8.444
   57    HA   VAL   8           HA       VAL   8  -7.639  -8.964   9.213
   58    HB   VAL   8           HB       VAL   8  -6.462  -9.627   7.070
   59   1HG1  VAL   8          1HG2      VAL   8  -8.807  -7.724   6.652
   60   2HG1  VAL   8          2HG2      VAL   8  -8.240  -8.971   5.505
   61   3HG1  VAL   8          3HG2      VAL   8  -8.925  -9.456   7.075
   62   1HG2  VAL   8          1HG1      VAL   8  -5.162  -7.513   6.864
   63   2HG2  VAL   8          2HG1      VAL   8  -6.089  -7.848   5.380
   64   3HG2  VAL   8          3HG1      VAL   8  -6.667  -6.617   6.543
   65    H    ARG   9           H        ARG   9  -5.498 -10.218   9.515
   66    HA   ARG   9           HA       ARG   9  -3.485  -8.246  10.500
   67   1HB   ARG   9          1HB       ARG   9  -3.747  -9.877  12.156
   68   2HB   ARG   9          2HB       ARG   9  -3.738 -11.231  10.984
   69   1HG   ARG   9          1HG       ARG   9  -1.357  -9.407  11.212
   70   2HG   ARG   9          2HG       ARG   9  -1.581 -10.684  12.417
   71   1HD   ARG   9          1HD       ARG   9  -1.703 -12.405  10.673
   72   2HD   ARG   9          2HD       ARG   9  -1.594 -11.182   9.403
   73    HE   ARG   9           HE       ARG   9   0.691 -11.021   9.748
   74   1HH1  ARG   9          1HH2      ARG   9  -0.809 -12.765  12.415
   75   2HH1  ARG   9          2HH2      ARG   9   0.691 -13.334  13.095
   76   1HH2  ARG   9          2HH1      ARG   9   2.684 -11.710  10.641
   77   2HH2  ARG   9          1HH1      ARG   9   2.719 -12.704  12.069
   78    H    LEU  10           H        LEU  10  -1.920  -7.680   9.253
   79    HA   LEU  10           HA       LEU  10  -1.775  -8.783   6.624
   80   1HB   LEU  10          1HB       LEU  10  -1.035  -6.405   7.787
   81   2HB   LEU  10          2HB       LEU  10   0.542  -7.230   7.741
   82    HG   LEU  10           HG       LEU  10   0.597  -6.297   5.658
   83   1HD1  LEU  10          1HD2      LEU  10  -1.196  -8.711   5.174
   84   2HD1  LEU  10          2HD2      LEU  10  -0.273  -7.847   3.912
   85   3HD1  LEU  10          3HD2      LEU  10   0.585  -8.665   5.245
   86   1HD2  LEU  10          1HD1      LEU  10  -1.573  -5.109   6.050
   87   2HD2  LEU  10          2HD1      LEU  10  -1.495  -5.737   4.384
   88   3HD2  LEU  10          3HD1      LEU  10  -2.458  -6.590   5.616
   89    H    LYS  11           H        LYS  11  -1.449 -11.059   7.158
   90    HA   LYS  11           HA       LYS  11   1.073 -11.914   8.269
   91   1HB   LYS  11          1HB       LYS  11  -0.809 -13.351   8.395
   92   2HB   LYS  11          2HB       LYS  11  -1.104 -13.278   6.633
   93   1HG   LYS  11          1HG       LYS  11   1.560 -14.328   7.505
   94   2HG   LYS  11          2HG       LYS  11   0.107 -15.358   7.683
   95   1HD   LYS  11          1HD       LYS  11   1.084 -13.982   5.151
   96   2HD   LYS  11          2HD       LYS  11   0.854 -15.729   5.454
   97   1HE   LYS  11          1HE       LYS  11  -1.342 -13.592   5.437
   98   2HE   LYS  11          2HE       LYS  11  -1.053 -14.771   4.138
   99   1HZ   LYS  11          1HZ       LYS  11  -1.436 -16.512   5.806
  100   2HZ   LYS  11          2HZ       LYS  11  -1.807 -15.370   6.933
  101   3HZ   LYS  11          3HZ       LYS  11  -2.762 -15.575   5.613
  102    H    THR  12           H        THR  12  -0.012 -10.994   5.097
  103    HA   THR  12           HA       THR  12   2.163 -11.812   3.436
  104    HB   THR  12           HB       THR  12   0.560  -9.229   3.341
  105    HG1  THR  12           HG1      THR  12  -0.600 -11.383   3.443
  106   1HG2  THR  12          1HG2      THR  12   1.841 -10.817   1.114
  107   2HG2  THR  12          2HG2      THR  12   0.919  -9.309   0.958
  108   3HG2  THR  12          3HG2      THR  12   2.492  -9.315   1.803
  109    H    GLY  13           H        GLY  13   1.658  -9.172   5.769
  110   1HA   GLY  13          1HA       GLY  13   2.443  -7.055   5.955
  111   2HA   GLY  13          2HA       GLY  13   3.948  -7.895   6.291
  112    H    LEU  14           H        LEU  14   2.110  -7.669   3.375
  113    HA   LEU  14           HA       LEU  14   2.788  -7.197   1.169
  114   1HB   LEU  14          1HB       LEU  14   2.249  -4.742   2.758
  115   2HB   LEU  14          2HB       LEU  14   2.417  -4.718   0.980
  116    HG   LEU  14           HG       LEU  14   0.839  -6.875   1.154
  117   1HD1  LEU  14          1HD2      LEU  14   0.652  -6.716   3.629
  118   2HD1  LEU  14          2HD2      LEU  14  -0.108  -5.123   3.450
  119   3HD1  LEU  14          3HD2      LEU  14  -0.927  -6.570   2.815
  120   1HD2  LEU  14          1HD1      LEU  14   0.327  -4.908  -0.208
  121   2HD2  LEU  14          2HD1      LEU  14  -1.114  -5.486   0.658
  122   3HD2  LEU  14          3HD1      LEU  14  -0.250  -4.042   1.235
  123    H    GLN  15           H        GLN  15   4.962  -8.096   1.536
  124    HA   GLN  15           HA       GLN  15   7.147  -6.144   1.858
  125   1HB   GLN  15          1HB       GLN  15   7.146  -9.125   1.266
  126   2HB   GLN  15          2HB       GLN  15   8.599  -8.151   1.605
  127   1HG   GLN  15          1HG       GLN  15   7.826  -7.616   3.823
  128   2HG   GLN  15          2HG       GLN  15   6.198  -8.222   3.469
  129   1HE2  GLN  15          2HE2      GLN  15   5.690 -10.306   3.972
  130   2HE2  GLN  15          1HE2      GLN  15   6.869 -11.518   4.430
  131    H    ALA  16           H        ALA  16   5.760  -8.295  -0.707
  132    HA   ALA  16           HA       ALA  16   5.992  -6.244  -2.673
  133   1HB   ALA  16          1HB       ALA  16   8.418  -6.449  -2.292
  134   2HB   ALA  16          2HB       ALA  16   8.338  -8.176  -2.723
  135   3HB   ALA  16          3HB       ALA  16   7.970  -6.936  -3.947
  136    H    ARG  17           H        ARG  17   6.525  -9.741  -2.295
  137    HA   ARG  17           HA       ARG  17   5.981 -10.440  -5.025
  138   1HB   ARG  17          1HB       ARG  17   7.229 -11.858  -3.518
  139   2HB   ARG  17          2HB       ARG  17   5.815 -12.094  -2.476
  140   1HG   ARG  17          1HG       ARG  17   5.699 -12.803  -5.418
  141   2HG   ARG  17          2HG       ARG  17   6.444 -13.918  -4.257
  142   1HD   ARG  17          1HD       ARG  17   3.622 -12.827  -3.947
  143   2HD   ARG  17          2HD       ARG  17   4.025 -14.392  -4.679
  144    HE   ARG  17           HE       ARG  17   5.317 -14.495  -2.257
  145   1HH1  ARG  17          2HH1      ARG  17   1.980 -13.969  -3.291
  146   2HH1  ARG  17          1HH1      ARG  17   1.281 -14.834  -1.939
  147   1HH2  ARG  17          1HH2      ARG  17   4.457 -15.656  -0.579
  148   2HH2  ARG  17          2HH2      ARG  17   2.730 -15.754  -0.290
  149    HA   PRO  18           HA       PRO  18   1.491 -11.335  -3.858
  150   1HB   PRO  18          1HB       PRO  18   0.620 -11.177  -1.270
  151   2HB   PRO  18          2HB       PRO  18   1.622 -12.584  -1.773
  152   1HG   PRO  18          1HG       PRO  18   2.620  -9.976  -0.564
  153   2HG   PRO  18          2HG       PRO  18   2.902 -11.555   0.151
  154   1HD   PRO  18          1HD       PRO  18   4.739 -10.528  -1.494
  155   2HD   PRO  18          2HD       PRO  18   4.245 -12.225  -1.795
  156    H    ALA  19           H        ALA  19   2.742  -8.888  -1.564
  157    HA   ALA  19           HA       ALA  19   0.409  -7.331  -1.561
  158   1HB   ALA  19          1HB       ALA  19   2.066  -7.327   0.158
  159   2HB   ALA  19          2HB       ALA  19   3.268  -6.588  -0.936
  160   3HB   ALA  19          3HB       ALA  19   1.785  -5.685  -0.473
  161    H    ALA  20           H        ALA  20   3.090  -7.302  -3.893
  162    HA   ALA  20           HA       ALA  20   2.421  -4.721  -5.020
  163   1HB   ALA  20          1HB       ALA  20   3.614  -7.211  -6.321
  164   2HB   ALA  20          2HB       ALA  20   3.603  -5.574  -7.021
  165   3HB   ALA  20          3HB       ALA  20   4.536  -5.908  -5.541
  166    H    LEU  21           H        LEU  21   1.297  -8.070  -5.420
  167    HA   LEU  21           HA       LEU  21  -0.566  -7.537  -7.555
  168   1HB   LEU  21          1HB       LEU  21   0.488  -9.742  -6.947
  169   2HB   LEU  21          2HB       LEU  21  -0.573  -9.807  -5.525
  170    HG   LEU  21           HG       LEU  21  -1.604  -9.435  -8.373
  171   1HD1  LEU  21          1HD1      LEU  21  -1.238 -12.003  -6.777
  172   2HD1  LEU  21          2HD1      LEU  21  -2.046 -11.871  -8.358
  173   3HD1  LEU  21          3HD1      LEU  21  -0.303 -11.537  -8.219
  174   1HD2  LEU  21          1HD2      LEU  21  -3.137  -8.874  -6.474
  175   2HD2  LEU  21          2HD2      LEU  21  -3.698 -10.288  -7.397
  176   3HD2  LEU  21          3HD2      LEU  21  -2.887 -10.517  -5.829
  177    H    PHE  22           H        PHE  22  -0.629  -7.556  -3.985
  178    HA   PHE  22           HA       PHE  22  -3.370  -7.186  -3.421
  179   1HB   PHE  22          1HB       PHE  22  -0.851  -5.935  -2.252
  180   2HB   PHE  22          2HB       PHE  22  -2.464  -5.564  -1.643
  181    HD1  PHE  22           HD1      PHE  22  -2.623  -6.386   0.446
  182    HD2  PHE  22           HD2      PHE  22  -1.032  -8.871  -2.683
  183    HE1  PHE  22           HE1      PHE  22  -2.330  -8.255   2.076
  184    HE2  PHE  22           HE2      PHE  22  -0.846 -10.768  -1.078
  185    HZ   PHE  22           HZ       PHE  22  -1.364 -10.418   1.317
  186    H    VAL  23           H        VAL  23  -0.898  -4.640  -3.651
  187    HA   VAL  23           HA       VAL  23  -2.514  -2.362  -3.818
  188    HB   VAL  23           HB       VAL  23   0.198  -3.146  -4.920
  189   1HG1  VAL  23          1HG2      VAL  23  -1.088  -0.394  -5.077
  190   2HG1  VAL  23          2HG2      VAL  23   0.617  -0.767  -5.423
  191   3HG1  VAL  23          3HG2      VAL  23  -0.668  -1.439  -6.454
  192   1HG2  VAL  23          1HG1      VAL  23  -0.119  -2.881  -2.478
  193   2HG2  VAL  23          2HG1      VAL  23   0.954  -1.621  -3.106
  194   3HG2  VAL  23          3HG1      VAL  23  -0.738  -1.241  -2.711
  195    H    GLN  24           H        GLN  24  -1.263  -4.473  -6.422
  196    HA   GLN  24           HA       GLN  24  -2.374  -3.187  -8.627
  197   1HB   GLN  24          1HB       GLN  24  -0.658  -4.890  -8.673
  198   2HB   GLN  24          2HB       GLN  24  -1.780  -6.113  -8.049
  199   1HG   GLN  24          1HG       GLN  24  -2.794  -4.745 -10.429
  200   2HG   GLN  24          2HG       GLN  24  -1.252  -5.573 -10.726
  201   1HE2  GLN  24          2HE2      GLN  24  -3.011  -7.107  -8.141
  202   2HE2  GLN  24          1HE2      GLN  24  -3.743  -8.353  -9.134
  203    H    GLU  25           H        GLU  25  -3.961  -5.583  -6.467
  204    HA   GLU  25           HA       GLU  25  -6.292  -5.794  -8.175
  205   1HB   GLU  25          1HB       GLU  25  -5.823  -6.566  -5.238
  206   2HB   GLU  25          2HB       GLU  25  -7.202  -7.114  -6.219
  207   1HG   GLU  25          1HG       GLU  25  -4.324  -7.702  -6.937
  208   2HG   GLU  25          2HG       GLU  25  -5.291  -8.769  -5.900
  209    H    ALA  26           H        ALA  26  -5.584  -4.409  -4.975
  210    HA   ALA  26           HA       ALA  26  -8.053  -3.157  -4.408
  211   1HB   ALA  26          1HB       ALA  26  -5.223  -2.124  -3.980
  212   2HB   ALA  26          2HB       ALA  26  -6.676  -1.542  -3.128
  213   3HB   ALA  26          3HB       ALA  26  -6.101  -3.211  -2.872
  214    H    ASN  27           H        ASN  27  -5.302  -2.171  -6.330
  215    HA   ASN  27           HA       ASN  27  -6.151   0.324  -7.371
  216   1HB   ASN  27          1HB       ASN  27  -4.113  -1.745  -7.774
  217   2HB   ASN  27          2HB       ASN  27  -4.589  -0.999  -9.294
  218   1HD2  ASN  27          2HD2      ASN  27  -2.492  -0.766  -6.802
  219   2HD2  ASN  27          1HD2      ASN  27  -2.052   0.941  -6.782
  220    H    ARG  28           H        ARG  28  -6.880  -2.989  -8.343
  221    HA   ARG  28           HA       ARG  28  -7.575  -2.452 -11.152
  222   1HB   ARG  28          1HB       ARG  28  -8.504  -4.575  -9.158
  223   2HB   ARG  28          2HB       ARG  28  -8.872  -4.573 -10.892
  224   1HG   ARG  28          1HG       ARG  28  -6.441  -4.749 -11.393
  225   2HG   ARG  28          2HG       ARG  28  -6.092  -4.833  -9.657
  226   1HD   ARG  28          1HD       ARG  28  -7.391  -6.905  -9.453
  227   2HD   ARG  28          2HD       ARG  28  -8.024  -6.696 -11.103
  228    HE   ARG  28           HE       ARG  28  -5.150  -6.852 -11.118
  229   1HH1  ARG  28          1HH2      ARG  28  -8.063  -8.791 -10.775
  230   2HH1  ARG  28          2HH2      ARG  28  -7.389 -10.214 -11.524
  231   1HH2  ARG  28          2HH1      ARG  28  -4.205  -8.680 -11.966
  232   2HH2  ARG  28          1HH1      ARG  28  -5.107 -10.162 -12.217
  233    H    PHE  29           H        PHE  29  -9.091  -2.942  -8.068
  234    HA   PHE  29           HA       PHE  29 -11.757  -2.184  -8.526
  235   1HB   PHE  29          1HB       PHE  29  -9.783  -2.053  -6.236
  236   2HB   PHE  29          2HB       PHE  29 -11.469  -1.649  -6.019
  237    HD1  PHE  29           HD1      PHE  29 -12.758  -3.615  -7.878
  238    HD2  PHE  29           HD2      PHE  29  -9.476  -4.162  -5.160
  239    HE1  PHE  29           HE1      PHE  29 -12.950  -6.065  -8.161
  240    HE2  PHE  29           HE2      PHE  29  -9.757  -6.624  -5.332
  241    HZ   PHE  29           HZ       PHE  29 -11.404  -7.574  -6.950
  242    H    THR  30           H        THR  30 -12.631  -0.351  -9.017
  243    HA   THR  30           HA       THR  30 -11.012   2.081  -9.344
  244    HB   THR  30           HB       THR  30 -13.946   1.436  -9.821
  245    HG1  THR  30           HG1      THR  30 -12.085   0.477 -11.102
  246   1HG2  THR  30          1HG2      THR  30 -12.316   3.842 -10.701
  247   2HG2  THR  30          2HG2      THR  30 -14.016   3.486 -11.140
  248   3HG2  THR  30          3HG2      THR  30 -13.584   3.828  -9.443
  249    H    SER  31           H        SER  31 -10.723   1.621  -6.838
  250    HA   SER  31           HA       SER  31 -12.609   3.319  -5.320
  251   1HB   SER  31          1HB       SER  31 -11.153   0.810  -4.406
  252   2HB   SER  31          2HB       SER  31 -12.445   1.670  -3.536
  253    HG   SER  31           HG       SER  31 -13.042  -0.309  -4.739
  254    H    ASP  32           H        ASP  32 -11.748   4.648  -3.830
  255    HA   ASP  32           HA       ASP  32  -8.881   5.159  -3.731
  256   1HB   ASP  32          1HB       ASP  32 -11.233   6.028  -1.986
  257   2HB   ASP  32          2HB       ASP  32  -9.588   6.678  -1.863
  258    H    VAL  33           H        VAL  33  -8.277   2.905  -3.291
  259    HA   VAL  33           HA       VAL  33  -9.326   1.667  -0.903
  260    HB   VAL  33           HB       VAL  33  -7.952  -0.215  -1.451
  261   1HG1  VAL  33          1HG2      VAL  33  -8.988   1.209  -3.936
  262   2HG1  VAL  33          2HG2      VAL  33  -8.640  -0.535  -3.836
  263   3HG1  VAL  33          3HG2      VAL  33  -9.938   0.180  -2.840
  264   1HG2  VAL  33          1HG1      VAL  33  -5.883   1.066  -1.888
  265   2HG2  VAL  33          2HG1      VAL  33  -6.214  -0.119  -3.182
  266   3HG2  VAL  33          3HG1      VAL  33  -6.555   1.610  -3.448
  267    H    PHE  34           H        PHE  34  -8.137   0.909   0.865
  268    HA   PHE  34           HA       PHE  34  -5.746   2.468   1.542
  269   1HB   PHE  34          1HB       PHE  34  -8.234   2.604   3.297
  270   2HB   PHE  34          2HB       PHE  34  -6.621   3.169   3.709
  271    HD1  PHE  34           HD1      PHE  34  -9.558   3.836   1.525
  272    HD2  PHE  34           HD2      PHE  34  -5.706   5.202   2.856
  273    HE1  PHE  34           HE1      PHE  34 -10.086   6.103   0.707
  274    HE2  PHE  34           HE2      PHE  34  -6.232   7.493   2.026
  275    HZ   PHE  34           HZ       PHE  34  -8.443   7.954   0.991
  276    H    LEU  35           H        LEU  35  -5.016   1.825   3.796
  277    HA   LEU  35           HA       LEU  35  -5.859  -0.805   4.717
  278   1HB   LEU  35          1HB       LEU  35  -4.108  -1.284   2.998
  279   2HB   LEU  35          2HB       LEU  35  -2.944  -0.310   3.941
  280    HG   LEU  35           HG       LEU  35  -3.339  -1.822   5.892
  281   1HD1  LEU  35          1HD2      LEU  35  -5.122  -3.316   3.916
  282   2HD1  LEU  35          2HD2      LEU  35  -4.708  -3.869   5.556
  283   3HD1  LEU  35          3HD2      LEU  35  -5.688  -2.401   5.333
  284   1HD2  LEU  35          1HD1      LEU  35  -2.722  -3.309   3.301
  285   2HD2  LEU  35          2HD1      LEU  35  -1.549  -2.385   4.272
  286   3HD2  LEU  35          3HD1      LEU  35  -2.295  -3.858   4.939
  287    H    GLU  36           H        GLU  36  -6.078  -0.461   6.788
  288    HA   GLU  36           HA       GLU  36  -4.583   1.849   7.946
  289   1HB   GLU  36          1HB       GLU  36  -7.122   1.031   9.148
  290   2HB   GLU  36          2HB       GLU  36  -6.576   2.666   8.756
  291   1HG   GLU  36          1HG       GLU  36  -7.281   2.396   6.452
  292   2HG   GLU  36          2HG       GLU  36  -7.595   0.672   6.699
  293    H    LYS  37           H        LYS  37  -3.010   0.947   9.187
  294    HA   LYS  37           HA       LYS  37  -3.076  -1.694  10.339
  295   1HB   LYS  37          1HB       LYS  37  -1.373   0.786  10.749
  296   2HB   LYS  37          2HB       LYS  37  -1.117  -0.713  11.658
  297   1HG   LYS  37          1HG       LYS  37  -0.770  -2.003   9.640
  298   2HG   LYS  37          2HG       LYS  37  -1.024  -0.546   8.670
  299   1HD   LYS  37          1HD       LYS  37   1.444  -0.991   9.107
  300   2HD   LYS  37          2HD       LYS  37   0.909   0.526   9.877
  301   1HE   LYS  37          1HE       LYS  37   0.413  -0.815  11.962
  302   2HE   LYS  37          2HE       LYS  37   1.174  -2.215  11.185
  303   1HZ   LYS  37          1HZ       LYS  37   3.177  -0.913  10.985
  304   2HZ   LYS  37          2HZ       LYS  37   2.480   0.363  11.763
  305   3HZ   LYS  37          3HZ       LYS  37   2.726  -1.057  12.568
  306    H    ASP  38           H        ASP  38  -4.917  -2.008  11.605
  307    HA   ASP  38           HA       ASP  38  -6.346  -1.778  13.336
  308   1HB   ASP  38          1HB       ASP  38  -3.779  -0.806  14.615
  309   2HB   ASP  38          2HB       ASP  38  -5.291  -1.065  15.513
  310    H    GLY  39           H        GLY  39  -6.157   0.383  11.367
  311   1HA   GLY  39          1HA       GLY  39  -7.765   2.319  11.654
  312   2HA   GLY  39          2HA       GLY  39  -6.880   2.648  13.161
  313    H    LYS  40           H        LYS  40  -4.214   1.955  11.772
  314    HA   LYS  40           HA       LYS  40  -3.599   4.657  10.956
  315   1HB   LYS  40          1HB       LYS  40  -2.008   2.085  10.670
  316   2HB   LYS  40          2HB       LYS  40  -1.359   3.739  10.680
  317   1HG   LYS  40          1HG       LYS  40  -2.218   3.947  13.068
  318   2HG   LYS  40          2HG       LYS  40  -2.638   2.209  12.993
  319   1HD   LYS  40          1HD       LYS  40  -0.375   2.582  13.994
  320   2HD   LYS  40          2HD       LYS  40  -0.319   1.628  12.492
  321   1HE   LYS  40          1HE       LYS  40   0.184   3.703  11.210
  322   2HE   LYS  40          2HE       LYS  40   0.182   4.631  12.721
  323   1HZ   LYS  40          1HZ       LYS  40   2.010   3.266  13.475
  324   2HZ   LYS  40          2HZ       LYS  40   2.008   2.419  12.061
  325   3HZ   LYS  40          3HZ       LYS  40   2.394   4.018  12.060
  326    H    LYS  41           H        LYS  41  -5.275   4.669   9.137
  327    HA   LYS  41           HA       LYS  41  -4.657   2.854   6.995
  328   1HB   LYS  41          1HB       LYS  41  -6.671   3.100   6.428
  329   2HB   LYS  41          2HB       LYS  41  -6.922   4.209   7.760
  330   1HG   LYS  41          1HG       LYS  41  -6.108   4.944   4.934
  331   2HG   LYS  41          2HG       LYS  41  -7.768   5.009   5.520
  332   1HD   LYS  41          1HD       LYS  41  -7.300   6.722   7.124
  333   2HD   LYS  41          2HD       LYS  41  -5.543   6.486   6.982
  334   1HE   LYS  41          1HE       LYS  41  -7.247   7.503   4.675
  335   2HE   LYS  41          2HE       LYS  41  -6.425   8.555   5.851
  336   1HZ   LYS  41          1HZ       LYS  41  -4.364   7.447   5.276
  337   2HZ   LYS  41          2HZ       LYS  41  -5.133   6.610   4.086
  338   3HZ   LYS  41          3HZ       LYS  41  -5.030   8.258   3.994
  339    H    VAL  42           H        VAL  42  -4.190   3.277   4.903
  340    HA   VAL  42           HA       VAL  42  -3.242   5.866   3.848
  341    HB   VAL  42           HB       VAL  42  -1.147   4.679   3.006
  342   1HG1  VAL  42          1HG1      VAL  42  -1.402   5.033   6.013
  343   2HG1  VAL  42          2HG1      VAL  42   0.130   4.949   5.104
  344   3HG1  VAL  42          3HG1      VAL  42  -0.996   6.303   4.830
  345   1HG2  VAL  42          1HG2      VAL  42  -2.038   2.398   3.430
  346   2HG2  VAL  42          2HG2      VAL  42  -0.445   2.639   4.202
  347   3HG2  VAL  42          3HG2      VAL  42  -1.936   2.697   5.179
  348    H    ASN  43           H        ASN  43  -2.820   5.641   1.434
  349    HA   ASN  43           HA       ASN  43  -4.977   4.096   0.319
  350   1HB   ASN  43          1HB       ASN  43  -2.745   5.774  -0.843
  351   2HB   ASN  43          2HB       ASN  43  -3.778   4.766  -1.872
  352   1HD2  ASN  43          2HD2      ASN  43  -6.266   4.885  -0.958
  353   2HD2  ASN  43          1HD2      ASN  43  -6.822   6.542  -0.815
  354    H    ALA  44           H        ALA  44  -4.958   2.171   0.426
  355    HA   ALA  44           HA       ALA  44  -3.050   0.224   0.812
  356   1HB   ALA  44          1HB       ALA  44  -5.600   0.024  -0.854
  357   2HB   ALA  44          2HB       ALA  44  -4.738  -1.355  -0.141
  358   3HB   ALA  44          3HB       ALA  44  -5.508  -0.144   0.912
  359    H    LYS  45           H        LYS  45  -4.200   1.509  -2.250
  360    HA   LYS  45           HA       LYS  45  -2.616  -0.356  -3.881
  361   1HB   LYS  45          1HB       LYS  45  -3.680   0.906  -5.731
  362   2HB   LYS  45          2HB       LYS  45  -4.873   0.256  -4.586
  363   1HG   LYS  45          1HG       LYS  45  -5.212   2.446  -3.592
  364   2HG   LYS  45          2HG       LYS  45  -3.773   3.093  -4.418
  365   1HD   LYS  45          1HD       LYS  45  -5.788   3.771  -5.676
  366   2HD   LYS  45          2HD       LYS  45  -4.768   2.625  -6.586
  367   1HE   LYS  45          1HE       LYS  45  -6.269   0.755  -5.830
  368   2HE   LYS  45          2HE       LYS  45  -7.328   1.943  -5.042
  369   1HZ   LYS  45          1HZ       LYS  45  -6.728   1.877  -7.913
  370   2HZ   LYS  45          2HZ       LYS  45  -8.109   1.319  -7.205
  371   3HZ   LYS  45          3HZ       LYS  45  -7.747   2.923  -7.142
  372    H    SER  46           H        SER  46  -1.898   2.381  -2.190
  373    HA   SER  46           HA       SER  46  -0.014   3.568  -4.106
  374   1HB   SER  46          1HB       SER  46  -1.182   4.348  -1.409
  375   2HB   SER  46          2HB       SER  46   0.035   5.316  -2.262
  376    HG   SER  46           HG       SER  46  -1.536   5.368  -4.051
  377    H    ILE  47           H        ILE  47   2.018   4.276  -3.315
  378    HA   ILE  47           HA       ILE  47   3.773   2.431  -2.383
  379    HB   ILE  47           HB       ILE  47   4.268   4.599  -3.454
  380   1HG1  ILE  47          1HG1      ILE  47   6.020   3.205  -2.295
  381   2HG1  ILE  47          2HG1      ILE  47   6.403   4.927  -2.495
  382   1HG2  ILE  47          1HG2      ILE  47   2.819   6.042  -2.045
  383   2HG2  ILE  47          2HG2      ILE  47   3.896   5.760  -0.666
  384   3HG2  ILE  47          3HG2      ILE  47   4.496   6.646  -2.084
  385   1HD1  ILE  47          1HD1      ILE  47   5.733   5.363  -0.161
  386   2HD1  ILE  47          2HD1      ILE  47   5.379   3.632   0.057
  387   3HD1  ILE  47          3HD1      ILE  47   7.046   4.165  -0.258
  388    H    MET  48           H        MET  48   2.358   4.980  -0.235
  389    HA   MET  48           HA       MET  48   3.571   3.821   2.106
  390   1HB   MET  48          1HB       MET  48   3.153   6.184   1.942
  391   2HB   MET  48          2HB       MET  48   1.415   5.925   1.696
  392   1HG   MET  48          1HG       MET  48   1.233   4.942   3.938
  393   2HG   MET  48          2HG       MET  48   2.993   4.990   4.123
  394   1HE   MET  48          1HE       MET  48   4.411   7.052   4.484
  395   2HE   MET  48          2HE       MET  48   3.773   7.767   2.985
  396   3HE   MET  48          3HE       MET  48   3.807   8.729   4.485
  397    H    GLY  49           H        GLY  49   0.647   3.120   0.340
  398   1HA   GLY  49          1HA       GLY  49  -0.880   2.043   2.564
  399   2HA   GLY  49          2HA       GLY  49  -1.166   1.782   0.815
  400    H    LEU  50           H        LEU  50   1.183   0.764  -0.130
  401    HA   LEU  50           HA       LEU  50   1.308  -1.887   0.883
  402   1HB   LEU  50          1HB       LEU  50   2.154  -0.340  -1.298
  403   2HB   LEU  50          2HB       LEU  50   3.649  -0.964  -0.561
  404    HG   LEU  50           HG       LEU  50   2.448  -2.504  -2.342
  405   1HD1  LEU  50          1HD2      LEU  50   4.366  -3.087  -0.878
  406   2HD1  LEU  50          2HD2      LEU  50   3.225  -3.484   0.431
  407   3HD1  LEU  50          3HD2      LEU  50   3.230  -4.456  -1.067
  408   1HD2  LEU  50          1HD1      LEU  50   0.199  -2.359  -1.180
  409   2HD2  LEU  50          2HD1      LEU  50   0.814  -4.026  -1.321
  410   3HD2  LEU  50          3HD1      LEU  50   0.929  -3.159   0.230
  411    H    MET  51           H        MET  51   3.953   0.468   0.568
  412    HA   MET  51           HA       MET  51   5.810  -1.093   1.933
  413   1HB   MET  51          1HB       MET  51   6.286   0.688   0.235
  414   2HB   MET  51          2HB       MET  51   5.818   1.906   1.440
  415   1HG   MET  51          1HG       MET  51   7.595   0.947   2.965
  416   2HG   MET  51          2HG       MET  51   8.133  -0.055   1.608
  417   1HE   MET  51          1HE       MET  51   6.753   3.584   1.632
  418   2HE   MET  51          2HE       MET  51   7.774   3.539   3.093
  419   3HE   MET  51          3HE       MET  51   8.245   4.556   1.708
  420    H    SER  52           H        SER  52   3.684   1.532   3.030
  421    HA   SER  52           HA       SER  52   5.117   1.635   5.603
  422   1HB   SER  52          1HB       SER  52   2.626   3.115   4.705
  423   2HB   SER  52          2HB       SER  52   3.590   3.462   6.166
  424    HG   SER  52           HG       SER  52   5.395   3.766   4.647
  425    H    LEU  53           H        LEU  53   1.627   1.334   4.861
  426    HA   LEU  53           HA       LEU  53   1.188   0.236   7.514
  427   1HB   LEU  53          1HB       LEU  53  -0.583   0.800   5.178
  428   2HB   LEU  53          2HB       LEU  53  -1.166   0.030   6.676
  429    HG   LEU  53           HG       LEU  53  -1.487   2.391   6.949
  430   1HD1  LEU  53          1HD1      LEU  53  -0.700   1.155   8.926
  431   2HD1  LEU  53          2HD1      LEU  53   0.985   1.532   8.483
  432   3HD1  LEU  53          3HD1      LEU  53  -0.133   2.841   8.939
  433   1HD2  LEU  53          1HD2      LEU  53   0.202   3.187   5.290
  434   2HD2  LEU  53          2HD2      LEU  53   0.351   4.024   6.857
  435   3HD2  LEU  53          3HD2      LEU  53   1.493   2.728   6.427
  436    H    ALA  54           H        ALA  54   0.581  -1.036   4.237
  437    HA   ALA  54           HA       ALA  54  -0.200  -3.621   4.888
  438   1HB   ALA  54          1HB       ALA  54  -0.415  -2.508   2.655
  439   2HB   ALA  54          2HB       ALA  54   1.346  -2.581   2.463
  440   3HB   ALA  54          3HB       ALA  54   0.399  -4.081   2.502
  441    H    VAL  55           H        VAL  55   3.059  -2.346   4.363
  442    HA   VAL  55           HA       VAL  55   4.385  -4.853   4.534
  443    HB   VAL  55           HB       VAL  55   5.353  -1.988   4.949
  444   1HG1  VAL  55          1HG2      VAL  55   7.006  -4.532   4.599
  445   2HG1  VAL  55          2HG2      VAL  55   7.640  -2.868   4.648
  446   3HG1  VAL  55          3HG2      VAL  55   6.896  -3.586   6.101
  447   1HG2  VAL  55          1HG1      VAL  55   4.560  -2.571   2.693
  448   2HG2  VAL  55          2HG1      VAL  55   6.323  -2.311   2.722
  449   3HG2  VAL  55          3HG1      VAL  55   5.665  -3.964   2.662
  450    H    SER  56           H        SER  56   2.771  -3.202   7.022
  451    HA   SER  56           HA       SER  56   4.614  -4.120   9.076
  452   1HB   SER  56          1HB       SER  56   1.827  -2.888   9.135
  453   2HB   SER  56          2HB       SER  56   2.839  -3.159  10.570
  454    HG   SER  56           HG       SER  56   3.527  -1.508   8.309
  455    H    THR  57           H        THR  57   4.423  -6.347   7.932
  456    HA   THR  57           HA       THR  57   2.484  -8.153   8.088
  457    HB   THR  57           HB       THR  57   5.113  -8.839   9.369
  458    HG1  THR  57           HG1      THR  57   6.025  -8.741   7.239
  459   1HG2  THR  57          1HG2      THR  57   3.399 -10.022   7.136
  460   2HG2  THR  57          2HG2      THR  57   4.852 -10.787   7.828
  461   3HG2  THR  57          3HG2      THR  57   3.396 -10.556   8.827
  462    H    GLY  58           H        GLY  58   1.034  -8.737   9.524
  463   1HA   GLY  58          1HA       GLY  58   0.457  -9.840  11.587
  464   2HA   GLY  58          2HA       GLY  58   1.837  -9.065  12.375
  465    H    THR  59           H        THR  59   0.583  -6.518  10.690
  466    HA   THR  59           HA       THR  59  -0.784  -5.598  13.117
  467    HB   THR  59           HB       THR  59  -0.566  -4.210  10.415
  468    HG1  THR  59           HG1      THR  59   1.486  -4.734  11.266
  469   1HG2  THR  59          1HG2      THR  59  -0.900  -3.125  13.246
  470   2HG2  THR  59          2HG2      THR  59  -0.858  -2.165  11.749
  471   3HG2  THR  59          3HG2      THR  59  -2.213  -3.279  12.060
  472    H    GLU  60           H        GLU  60  -3.066  -5.221  13.304
  473    HA   GLU  60           HA       GLU  60  -4.649  -6.767  11.346
  474   1HB   GLU  60          1HB       GLU  60  -5.702  -5.210  13.727
  475   2HB   GLU  60          2HB       GLU  60  -6.443  -6.590  12.857
  476   1HG   GLU  60          1HG       GLU  60  -3.856  -6.801  14.444
  477   2HG   GLU  60          2HG       GLU  60  -5.457  -7.192  15.105
  478    H    VAL  61           H        VAL  61  -4.151  -5.401   9.601
  479    HA   VAL  61           HA       VAL  61  -5.025  -2.575   9.858
  480    HB   VAL  61           HB       VAL  61  -3.668  -2.079   7.955
  481   1HG1  VAL  61          1HG1      VAL  61  -2.272  -4.182   9.686
  482   2HG1  VAL  61          2HG1      VAL  61  -1.448  -2.940   8.710
  483   3HG1  VAL  61          3HG1      VAL  61  -2.432  -2.465  10.117
  484   1HG2  VAL  61          1HG2      VAL  61  -4.114  -4.132   6.623
  485   2HG2  VAL  61          2HG2      VAL  61  -2.363  -3.803   6.801
  486   3HG2  VAL  61          3HG2      VAL  61  -3.134  -5.067   7.795
  487    H    THR  62           H        THR  62  -6.777  -1.824   9.003
  488    HA   THR  62           HA       THR  62  -8.626  -3.625   7.725
  489    HB   THR  62           HB       THR  62  -9.012  -0.642   7.867
  490    HG1  THR  62           HG1      THR  62  -9.314  -0.737  10.046
  491   1HG2  THR  62          1HG2      THR  62 -11.271  -1.392   8.696
  492   2HG2  THR  62          2HG2      THR  62 -10.883  -2.029   7.087
  493   3HG2  THR  62          3HG2      THR  62 -10.733  -3.071   8.522
  494    H    LEU  63           H        LEU  63  -8.544  -4.100   5.563
  495    HA   LEU  63           HA       LEU  63  -7.306  -2.065   3.840
  496   1HB   LEU  63          1HB       LEU  63  -6.811  -4.529   3.615
  497   2HB   LEU  63          2HB       LEU  63  -8.422  -4.712   2.866
  498    HG   LEU  63           HG       LEU  63  -6.574  -2.480   1.986
  499   1HD1  LEU  63          1HD2      LEU  63  -6.350  -5.373   1.082
  500   2HD1  LEU  63          2HD2      LEU  63  -5.514  -3.987   0.342
  501   3HD1  LEU  63          3HD2      LEU  63  -5.140  -4.462   2.015
  502   1HD2  LEU  63          1HD1      LEU  63  -8.601  -4.252   0.551
  503   2HD2  LEU  63          2HD1      LEU  63  -8.869  -2.579   1.101
  504   3HD2  LEU  63          3HD1      LEU  63  -7.694  -2.911  -0.191
  505    H    ILE  64           H        ILE  64  -8.346  -0.561   3.099
  506    HA   ILE  64           HA       ILE  64 -11.300  -0.417   3.011
  507    HB   ILE  64           HB       ILE  64  -9.075   1.637   2.559
  508   1HG1  ILE  64          1HG1      ILE  64 -10.881   1.189   4.954
  509   2HG1  ILE  64          2HG1      ILE  64  -9.101   1.091   4.913
  510   1HG2  ILE  64          1HG2      ILE  64 -12.077   2.000   2.820
  511   2HG2  ILE  64          2HG2      ILE  64 -10.877   3.311   2.701
  512   3HG2  ILE  64          3HG2      ILE  64 -11.117   2.195   1.334
  513   1HD1  ILE  64          1HD1      ILE  64  -9.083   3.527   4.213
  514   2HD1  ILE  64          2HD1      ILE  64 -10.852   3.543   4.402
  515   3HD1  ILE  64          3HD1      ILE  64  -9.807   3.258   5.826
  516    H    ALA  65           H        ALA  65 -12.326   0.329   1.169
  517    HA   ALA  65           HA       ALA  65 -10.847   0.978  -1.215
  518   1HB   ALA  65          1HB       ALA  65 -12.905  -1.276  -1.202
  519   2HB   ALA  65          2HB       ALA  65 -12.193  -0.546  -2.662
  520   3HB   ALA  65          3HB       ALA  65 -11.168  -1.477  -1.538
  521    H    GLN  66           H        GLN  66 -11.570   2.894  -1.394
  522    HA   GLN  66           HA       GLN  66 -14.441   3.345  -0.853
  523   1HB   GLN  66          1HB       GLN  66 -12.620   4.562   0.513
  524   2HB   GLN  66          2HB       GLN  66 -11.966   5.189  -1.000
  525   1HG   GLN  66          1HG       GLN  66 -14.568   5.940  -1.198
  526   2HG   GLN  66          2HG       GLN  66 -14.342   6.013   0.556
  527   1HE2  GLN  66          2HE2      GLN  66 -12.017   7.133   1.122
  528   2HE2  GLN  66          1HE2      GLN  66 -11.716   8.601   0.209
  529    H    GLY  67           H        GLY  67 -14.640   2.213  -2.964
  530   1HA   GLY  67          1HA       GLY  67 -14.548   4.205  -5.171
  531   2HA   GLY  67          2HA       GLY  67 -13.657   2.705  -5.330
  532    H    GLU  68           H        GLU  68 -15.063   2.740  -7.186
  533    HA   GLU  68           HA       GLU  68 -17.745   1.947  -7.315
  534   1HB   GLU  68          1HB       GLU  68 -15.393   0.863  -8.923
  535   2HB   GLU  68          2HB       GLU  68 -17.083   0.977  -9.447
  536   1HG   GLU  68          1HG       GLU  68 -15.134   3.259  -8.933
  537   2HG   GLU  68          2HG       GLU  68 -15.866   2.795 -10.482
  538    H    ASP  69           H        ASP  69 -14.757   0.116  -6.498
  539    HA   ASP  69           HA       ASP  69 -16.442  -2.288  -5.933
  540   1HB   ASP  69          1HB       ASP  69 -13.488  -2.308  -6.361
  541   2HB   ASP  69          2HB       ASP  69 -14.619  -3.655  -6.385
  542    H    GLU  70           H        GLU  70 -16.410  -0.052  -4.109
  543    HA   GLU  70           HA       GLU  70 -14.495   0.046  -2.187
  544   1HB   GLU  70          1HB       GLU  70 -16.532   1.397  -2.235
  545   2HB   GLU  70          2HB       GLU  70 -17.530  -0.068  -2.152
  546   1HG   GLU  70          1HG       GLU  70 -16.376  -0.484   0.139
  547   2HG   GLU  70          2HG       GLU  70 -15.983   1.250   0.054
  548    H    GLN  71           H        GLN  71 -17.419  -1.846  -1.528
  549    HA   GLN  71           HA       GLN  71 -16.438  -3.527   0.389
  550   1HB   GLN  71          1HB       GLN  71 -18.800  -3.381  -0.145
  551   2HB   GLN  71          2HB       GLN  71 -18.515  -4.060  -1.759
  552   1HG   GLN  71          1HG       GLN  71 -19.466  -5.758  -0.304
  553   2HG   GLN  71          2HG       GLN  71 -17.808  -6.208  -0.743
  554   1HE2  GLN  71          2HE2      GLN  71 -16.089  -5.873   0.898
  555   2HE2  GLN  71          1HE2      GLN  71 -16.559  -5.903   2.596
  556    H    GLU  72           H        GLU  72 -16.373  -4.153  -3.140
  557    HA   GLU  72           HA       GLU  72 -15.506  -6.846  -3.087
  558   1HB   GLU  72          1HB       GLU  72 -16.486  -5.841  -5.040
  559   2HB   GLU  72          2HB       GLU  72 -15.324  -4.495  -5.002
  560   1HG   GLU  72          1HG       GLU  72 -14.775  -5.982  -6.790
  561   2HG   GLU  72          2HG       GLU  72 -13.495  -6.027  -5.567
  562    H    ALA  73           H        ALA  73 -13.714  -3.769  -3.548
  563    HA   ALA  73           HA       ALA  73 -11.141  -4.911  -3.821
  564   1HB   ALA  73          1HB       ALA  73 -12.278  -2.254  -2.925
  565   2HB   ALA  73          2HB       ALA  73 -10.558  -2.471  -3.381
  566   3HB   ALA  73          3HB       ALA  73 -11.883  -2.711  -4.576
  567    H    LEU  74           H        LEU  74 -12.680  -3.199  -1.085
  568    HA   LEU  74           HA       LEU  74 -10.553  -3.393   0.720
  569   1HB   LEU  74          1HB       LEU  74 -12.249  -2.799   2.392
  570   2HB   LEU  74          2HB       LEU  74 -12.499  -1.944   0.845
  571    HG   LEU  74           HG       LEU  74 -14.084  -3.899   0.259
  572   1HD1  LEU  74          1HD2      LEU  74 -14.222  -3.887   3.303
  573   2HD1  LEU  74          2HD2      LEU  74 -15.377  -4.672   2.189
  574   3HD1  LEU  74          3HD2      LEU  74 -13.701  -5.252   2.272
  575   1HD2  LEU  74          1HD1      LEU  74 -14.656  -1.552   0.440
  576   2HD2  LEU  74          2HD1      LEU  74 -15.939  -2.579   1.103
  577   3HD2  LEU  74          3HD1      LEU  74 -14.839  -1.704   2.209
  578    H    GLU  75           H        GLU  75 -13.333  -5.672   0.332
  579    HA   GLU  75           HA       GLU  75 -12.435  -7.298   2.495
  580   1HB   GLU  75          1HB       GLU  75 -14.108  -8.921   1.691
  581   2HB   GLU  75          2HB       GLU  75 -14.769  -7.279   1.822
  582   1HG   GLU  75          1HG       GLU  75 -14.468  -6.960  -0.606
  583   2HG   GLU  75          2HG       GLU  75 -13.758  -8.564  -0.742
  584    H    LYS  76           H        LYS  76 -11.972  -7.727  -1.111
  585    HA   LYS  76           HA       LYS  76 -10.695 -10.275  -0.518
  586   1HB   LYS  76          1HB       LYS  76  -9.971 -10.196  -2.876
  587   2HB   LYS  76          2HB       LYS  76 -11.735 -10.132  -2.640
  588   1HG   LYS  76          1HG       LYS  76 -11.740  -7.746  -3.091
  589   2HG   LYS  76          2HG       LYS  76  -9.962  -7.705  -3.204
  590   1HD   LYS  76          1HD       LYS  76 -11.624  -9.606  -4.902
  591   2HD   LYS  76          2HD       LYS  76 -11.421  -7.918  -5.365
  592   1HE   LYS  76          1HE       LYS  76  -9.743  -9.309  -6.501
  593   2HE   LYS  76          2HE       LYS  76  -8.959  -8.170  -5.397
  594   1HZ   LYS  76          1HZ       LYS  76  -9.502 -10.997  -4.815
  595   2HZ   LYS  76          2HZ       LYS  76  -8.043 -10.371  -5.255
  596   3HZ   LYS  76          3HZ       LYS  76  -8.726  -9.935  -3.821
  597    H    LEU  77           H        LEU  77  -9.560  -6.960  -1.085
  598    HA   LEU  77           HA       LEU  77  -6.791  -7.695  -1.200
  599   1HB   LEU  77          1HB       LEU  77  -8.275  -5.134  -0.640
  600   2HB   LEU  77          2HB       LEU  77  -6.501  -5.245  -0.507
  601    HG   LEU  77           HG       LEU  77  -6.942  -4.523  -2.776
  602   1HD1  LEU  77          1HD2      LEU  77  -5.235  -6.324  -2.465
  603   2HD1  LEU  77          2HD2      LEU  77  -6.543  -7.529  -2.703
  604   3HD1  LEU  77          3HD2      LEU  77  -6.091  -6.445  -4.042
  605   1HD2  LEU  77          1HD1      LEU  77  -8.621  -7.036  -3.013
  606   2HD2  LEU  77          2HD1      LEU  77  -9.287  -5.378  -2.984
  607   3HD2  LEU  77          3HD1      LEU  77  -8.226  -5.905  -4.336
  608    H    ALA  78           H        ALA  78  -8.835  -6.576   1.624
  609    HA   ALA  78           HA       ALA  78  -6.670  -6.866   3.481
  610   1HB   ALA  78          1HB       ALA  78  -8.813  -5.726   4.070
  611   2HB   ALA  78          2HB       ALA  78  -9.647  -7.301   3.969
  612   3HB   ALA  78          3HB       ALA  78  -8.406  -7.028   5.204
  613    H    ALA  79           H        ALA  79  -9.112  -9.118   2.204
  614    HA   ALA  79           HA       ALA  79  -8.695 -11.393   3.807
  615   1HB   ALA  79          1HB       ALA  79 -10.407 -11.137   1.979
  616   2HB   ALA  79          2HB       ALA  79  -9.078 -11.217   0.789
  617   3HB   ALA  79          3HB       ALA  79  -9.447 -12.635   1.801
  618    H    TYR  80           H        TYR  80  -7.183 -10.465   0.743
  619    HA   TYR  80           HA       TYR  80  -5.366 -12.421   0.260
  620   1HB   TYR  80          1HB       TYR  80  -6.154 -10.273  -0.887
  621   2HB   TYR  80          2HB       TYR  80  -4.816  -9.474  -0.064
  622    HD1  TYR  80           HD1      TYR  80  -3.688 -12.733  -0.632
  623    HD2  TYR  80           HD2      TYR  80  -4.577  -9.104  -2.768
  624    HE1  TYR  80           HE1      TYR  80  -2.096 -13.398  -2.397
  625    HE2  TYR  80           HE2      TYR  80  -2.946  -9.752  -4.533
  626    HH   TYR  80           HH       TYR  80  -1.153 -12.832  -4.422
  627    H    VAL  81           H        VAL  81  -4.994  -9.753   2.615
  628    HA   VAL  81           HA       VAL  81  -2.138  -9.984   2.821
  629    HB   VAL  81           HB       VAL  81  -2.288  -8.265   4.354
  630   1HG1  VAL  81          1HG1      VAL  81  -3.608  -7.571   2.328
  631   2HG1  VAL  81          2HG1      VAL  81  -5.074  -8.165   3.124
  632   3HG1  VAL  81          3HG1      VAL  81  -4.196  -6.785   3.821
  633   1HG2  VAL  81          1HG2      VAL  81  -3.452  -9.632   6.072
  634   2HG2  VAL  81          2HG2      VAL  81  -4.114  -7.978   5.979
  635   3HG2  VAL  81          3HG2      VAL  81  -4.988  -9.338   5.235
  636    H    GLN  82           H        GLN  82  -4.914 -11.432   4.519
  637    HA   GLN  82           HA       GLN  82  -2.960 -12.655   6.361
  638   1HB   GLN  82          1HB       GLN  82  -4.867 -12.685   7.881
  639   2HB   GLN  82          2HB       GLN  82  -4.668 -11.057   7.209
  640   1HG   GLN  82          1HG       GLN  82  -6.473 -11.510   5.607
  641   2HG   GLN  82          2HG       GLN  82  -6.628 -13.125   6.268
  642   1HE2  GLN  82          2HE2      GLN  82  -8.723 -11.597   6.340
  643   2HE2  GLN  82          1HE2      GLN  82  -9.177 -11.088   7.974
  644    H    GLU  83           H        GLU  83  -4.655 -13.487   3.619
  645    HA   GLU  83           HA       GLU  83  -5.946 -15.846   4.673
  646   1HB   GLU  83          1HB       GLU  83  -7.012 -15.929   2.516
  647   2HB   GLU  83          2HB       GLU  83  -6.903 -14.235   3.090
  648   1HG   GLU  83          1HG       GLU  83  -4.928 -13.869   1.658
  649   2HG   GLU  83          2HG       GLU  83  -5.027 -15.541   1.071
  650    H    GLU  84           H        GLU  84  -2.971 -15.364   2.738
  651    HA   GLU  84           HA       GLU  84  -2.858 -18.346   2.561
  652   1HB   GLU  84          1HB       GLU  84  -1.236 -17.888   0.657
  653   2HB   GLU  84          2HB       GLU  84  -2.925 -17.424   0.381
  654   1HG   GLU  84          1HG       GLU  84  -2.381 -15.074   1.037
  655   2HG   GLU  84          2HG       GLU  84  -0.675 -15.521   1.138
  656    H    VAL  85           H        VAL  85  -0.013 -16.753   1.863
  657    HA   VAL  85           HA       VAL  85   1.217 -16.129   4.435
  658    HB   VAL  85           HB       VAL  85   3.143 -17.729   3.962
  659   1HG1  VAL  85          1HG1      VAL  85   0.596 -19.260   4.845
  660   2HG1  VAL  85          2HG1      VAL  85   2.274 -19.817   5.068
  661   3HG1  VAL  85          3HG1      VAL  85   1.717 -18.384   5.914
  662   1HG2  VAL  85          1HG2      VAL  85   2.515 -18.483   1.625
  663   2HG2  VAL  85          2HG2      VAL  85   2.815 -19.848   2.706
  664   3HG2  VAL  85          3HG2      VAL  85   1.142 -19.401   2.287
  Start of MODEL    2
    1   1H    VAL   2          1H        VAL   2 -16.719   6.519  -2.296
    2   2H    VAL   2          2H        VAL   2 -17.428   5.202  -3.064
    3   3H    VAL   2          3H        VAL   2 -18.312   6.612  -2.826
    4    HA   VAL   2           HA       VAL   2 -18.243   6.337  -0.482
    5    HB   VAL   2           HB       VAL   2 -19.660   4.289  -0.351
    6   1HG1  VAL   2          1HG1      VAL   2 -20.514   6.505  -1.157
    7   2HG1  VAL   2          2HG1      VAL   2 -20.143   6.007  -2.824
    8   3HG1  VAL   2          3HG1      VAL   2 -21.380   5.130  -1.890
    9   1HG2  VAL   2          1HG2      VAL   2 -18.865   3.982  -3.283
   10   2HG2  VAL   2          2HG2      VAL   2 -18.421   2.882  -1.954
   11   3HG2  VAL   2          3HG2      VAL   2 -20.126   3.043  -2.448
   12    H    GLN   3           H        GLN   3 -17.380   5.219   1.383
   13    HA   GLN   3           HA       GLN   3 -15.003   3.613   0.606
   14   1HB   GLN   3          1HB       GLN   3 -14.609   5.899   1.616
   15   2HB   GLN   3          2HB       GLN   3 -15.399   5.334   3.096
   16   1HG   GLN   3          1HG       GLN   3 -13.649   3.650   3.435
   17   2HG   GLN   3          2HG       GLN   3 -12.947   4.023   1.849
   18   1HE2  GLN   3          2HE2      GLN   3 -11.016   5.066   2.176
   19   2HE2  GLN   3          1HE2      GLN   3 -10.808   6.374   3.322
   20    H    GLN   4           H        GLN   4 -14.689   1.646   1.488
   21    HA   GLN   4           HA       GLN   4 -16.011   1.050   4.061
   22   1HB   GLN   4          1HB       GLN   4 -17.642   0.172   2.516
   23   2HB   GLN   4          2HB       GLN   4 -16.375  -0.577   1.525
   24   1HG   GLN   4          1HG       GLN   4 -17.424  -2.297   2.879
   25   2HG   GLN   4          2HG       GLN   4 -15.764  -2.042   3.452
   26   1HE2  GLN   4          2HE2      GLN   4 -18.887  -2.528   4.402
   27   2HE2  GLN   4          1HE2      GLN   4 -18.826  -1.799   6.011
   28    H    LYS   5           H        LYS   5 -14.791  -0.778   5.207
   29    HA   LYS   5           HA       LYS   5 -12.385  -1.682   3.806
   30   1HB   LYS   5          1HB       LYS   5 -11.026  -0.766   5.827
   31   2HB   LYS   5          2HB       LYS   5 -11.512   0.296   4.497
   32   1HG   LYS   5          1HG       LYS   5 -11.971   1.568   6.404
   33   2HG   LYS   5          2HG       LYS   5 -13.556   0.942   5.880
   34   1HD   LYS   5          1HD       LYS   5 -13.245  -0.946   7.542
   35   2HD   LYS   5          2HD       LYS   5 -11.736  -0.129   8.062
   36   1HE   LYS   5          1HE       LYS   5 -13.040   1.898   8.654
   37   2HE   LYS   5          2HE       LYS   5 -14.536   1.076   8.158
   38   1HZ   LYS   5          1HZ       LYS   5 -14.104  -0.569   9.845
   39   2HZ   LYS   5          2HZ       LYS   5 -12.738   0.227  10.319
   40   3HZ   LYS   5          3HZ       LYS   5 -14.217   0.936  10.507
   41    H    VAL   6           H        VAL   6 -11.600  -3.564   4.585
   42    HA   VAL   6           HA       VAL   6 -12.916  -4.608   7.042
   43    HB   VAL   6           HB       VAL   6 -12.873  -6.891   5.893
   44   1HG1  VAL   6          1HG1      VAL   6 -14.660  -4.623   4.912
   45   2HG1  VAL   6          2HG1      VAL   6 -15.049  -6.354   4.779
   46   3HG1  VAL   6          3HG1      VAL   6 -14.892  -5.595   6.383
   47   1HG2  VAL   6          1HG2      VAL   6 -11.446  -6.222   3.948
   48   2HG2  VAL   6          2HG2      VAL   6 -13.026  -6.865   3.435
   49   3HG2  VAL   6          3HG2      VAL   6 -12.731  -5.111   3.419
   50    H    GLU   7           H        GLU   7 -11.544  -5.434   8.526
   51    HA   GLU   7           HA       GLU   7  -8.691  -5.263   7.776
   52   1HB   GLU   7          1HB       GLU   7  -9.527  -3.949   9.714
   53   2HB   GLU   7          2HB       GLU   7 -10.063  -5.450  10.505
   54   1HG   GLU   7          1HG       GLU   7  -7.864  -6.177  10.903
   55   2HG   GLU   7          2HG       GLU   7  -7.177  -5.074   9.694
   56    H    VAL   8           H        VAL   8  -7.178  -6.676   8.371
   57    HA   VAL   8           HA       VAL   8  -7.812  -9.421   9.194
   58    HB   VAL   8           HB       VAL   8  -6.563 -10.217   7.065
   59   1HG1  VAL   8          1HG1      VAL   8  -9.353  -9.043   6.882
   60   2HG1  VAL   8          2HG1      VAL   8  -8.650 -10.287   5.796
   61   3HG1  VAL   8          3HG1      VAL   8  -8.905 -10.654   7.517
   62   1HG2  VAL   8          1HG2      VAL   8  -7.507  -7.457   6.166
   63   2HG2  VAL   8          2HG2      VAL   8  -5.819  -8.018   6.231
   64   3HG2  VAL   8          3HG2      VAL   8  -6.944  -8.756   5.069
   65    H    ARG   9           H        ARG   9  -5.514 -10.706   8.935
   66    HA   ARG   9           HA       ARG   9  -3.605  -8.703  10.019
   67   1HB   ARG   9          1HB       ARG   9  -3.854 -10.936  11.218
   68   2HB   ARG   9          2HB       ARG   9  -3.048 -11.665   9.796
   69   1HG   ARG   9          1HG       ARG   9  -1.099 -10.063  10.232
   70   2HG   ARG   9          2HG       ARG   9  -1.912  -9.536  11.686
   71   1HD   ARG   9          1HD       ARG   9  -1.053 -12.383  11.123
   72   2HD   ARG   9          2HD       ARG   9  -0.368 -11.266  12.322
   73    HE   ARG   9           HE       ARG   9  -2.703 -12.898  12.638
   74   1HH1  ARG   9          2HH1      ARG   9  -1.363  -9.716  13.491
   75   2HH1  ARG   9          1HH1      ARG   9  -2.461  -9.488  14.832
   76   1HH2  ARG   9          1HH2      ARG   9  -4.139 -12.556  14.411
   77   2HH2  ARG   9          2HH2      ARG   9  -4.094 -11.034  15.275
   78    H    LEU  10           H        LEU  10  -1.915  -8.062   8.976
   79    HA   LEU  10           HA       LEU  10  -1.771  -8.230   6.160
   80   1HB   LEU  10          1HB       LEU  10  -1.242  -6.368   7.737
   81   2HB   LEU  10          2HB       LEU  10   0.188  -7.254   8.288
   82    HG   LEU  10           HG       LEU  10   1.222  -7.031   6.106
   83   1HD1  LEU  10          1HD1      LEU  10  -1.373  -5.623   5.304
   84   2HD1  LEU  10          2HD1      LEU  10   0.097  -5.767   4.306
   85   3HD1  LEU  10          3HD1      LEU  10  -0.843  -7.221   4.720
   86   1HD2  LEU  10          1HD2      LEU  10   1.256  -5.232   7.853
   87   2HD2  LEU  10          2HD2      LEU  10   1.449  -4.605   6.204
   88   3HD2  LEU  10          3HD2      LEU  10  -0.124  -4.450   7.036
   89    H    LYS  11           H        LYS  11  -1.693 -10.712   6.226
   90    HA   LYS  11           HA       LYS  11   0.756 -12.060   6.968
   91   1HB   LYS  11          1HB       LYS  11  -1.256 -13.289   6.987
   92   2HB   LYS  11          2HB       LYS  11  -1.761 -12.711   5.393
   93   1HG   LYS  11          1HG       LYS  11   0.670 -14.463   5.746
   94   2HG   LYS  11          2HG       LYS  11  -0.965 -15.108   5.530
   95   1HD   LYS  11          1HD       LYS  11   0.587 -13.344   3.592
   96   2HD   LYS  11          2HD       LYS  11  -0.009 -14.994   3.328
   97   1HE   LYS  11          1HE       LYS  11  -2.342 -14.196   3.517
   98   2HE   LYS  11          2HE       LYS  11  -1.755 -12.542   3.818
   99   1HZ   LYS  11          1HZ       LYS  11  -0.735 -12.615   1.634
  100   2HZ   LYS  11          2HZ       LYS  11  -1.420 -14.091   1.347
  101   3HZ   LYS  11          3HZ       LYS  11  -2.375 -12.780   1.576
  102    H    THR  12           H        THR  12  -0.341 -10.360   4.168
  103    HA   THR  12           HA       THR  12   1.636 -11.203   2.239
  104    HB   THR  12           HB       THR  12   0.937  -8.789   1.371
  105    HG1  THR  12           HG1      THR  12  -1.248  -9.342   3.116
  106   1HG2  THR  12          1HG2      THR  12  -1.199  -9.693   0.488
  107   2HG2  THR  12          2HG2      THR  12   0.128 -10.863   0.337
  108   3HG2  THR  12          3HG2      THR  12  -1.082 -11.057   1.627
  109    H    GLY  13           H        GLY  13   1.457  -8.783   4.816
  110   1HA   GLY  13          1HA       GLY  13   2.711  -6.935   5.349
  111   2HA   GLY  13          2HA       GLY  13   4.023  -8.132   5.380
  112    H    LEU  14           H        LEU  14   2.179  -7.033   2.691
  113    HA   LEU  14           HA       LEU  14   2.812  -6.447   0.527
  114   1HB   LEU  14          1HB       LEU  14   3.326  -4.267   2.492
  115   2HB   LEU  14          2HB       LEU  14   3.642  -3.983   0.776
  116    HG   LEU  14           HG       LEU  14   1.297  -3.398   1.523
  117   1HD1  LEU  14          1HD2      LEU  14   1.505  -5.566  -0.577
  118   2HD1  LEU  14          2HD2      LEU  14   0.138  -4.447  -0.374
  119   3HD1  LEU  14          3HD2      LEU  14   1.739  -3.821  -0.838
  120   1HD2  LEU  14          1HD1      LEU  14   0.952  -5.360   3.044
  121   2HD2  LEU  14          2HD1      LEU  14  -0.339  -5.177   1.829
  122   3HD2  LEU  14          3HD1      LEU  14   0.916  -6.418   1.611
  123    H    GLN  15           H        GLN  15   4.746  -8.224   1.472
  124    HA   GLN  15           HA       GLN  15   7.303  -6.978   0.777
  125   1HB   GLN  15          1HB       GLN  15   6.576  -9.758   1.734
  126   2HB   GLN  15          2HB       GLN  15   8.230  -9.252   1.313
  127   1HG   GLN  15          1HG       GLN  15   8.025  -7.328   2.891
  128   2HG   GLN  15          2HG       GLN  15   6.418  -7.912   3.366
  129   1HE2  GLN  15          1HE2      GLN  15   6.574  -8.819   5.388
  130   2HE2  GLN  15          2HE2      GLN  15   7.718 -10.084   5.763
  131    H    ALA  16           H        ALA  16   6.345  -6.418  -1.273
  132    HA   ALA  16           HA       ALA  16   6.571  -6.428  -3.537
  133   1HB   ALA  16          1HB       ALA  16   8.873  -7.114  -3.020
  134   2HB   ALA  16          2HB       ALA  16   8.374  -8.822  -3.076
  135   3HB   ALA  16          3HB       ALA  16   8.298  -7.825  -4.548
  136    H    ARG  17           H        ARG  17   6.509  -9.924  -2.781
  137    HA   ARG  17           HA       ARG  17   4.953 -10.523  -5.154
  138   1HB   ARG  17          1HB       ARG  17   5.546 -12.272  -2.742
  139   2HB   ARG  17          2HB       ARG  17   4.912 -12.801  -4.318
  140   1HG   ARG  17          1HG       ARG  17   7.633 -11.545  -3.786
  141   2HG   ARG  17          2HG       ARG  17   7.290 -13.218  -4.282
  142   1HD   ARG  17          1HD       ARG  17   6.868 -10.664  -5.869
  143   2HD   ARG  17          2HD       ARG  17   7.952 -12.004  -6.268
  144    HE   ARG  17           HE       ARG  17   5.940 -13.395  -6.652
  145   1HH1  ARG  17          2HH1      ARG  17   5.588  -9.858  -6.690
  146   2HH1  ARG  17          1HH1      ARG  17   4.065  -9.892  -7.520
  147   1HH2  ARG  17          1HH2      ARG  17   3.949 -13.422  -7.765
  148   2HH2  ARG  17          2HH2      ARG  17   3.127 -11.940  -8.167
  149    HA   PRO  18           HA       PRO  18   1.275 -11.365  -2.126
  150   1HB   PRO  18          1HB       PRO  18   1.582 -10.344   0.441
  151   2HB   PRO  18          2HB       PRO  18   2.014 -12.023  -0.006
  152   1HG   PRO  18          1HG       PRO  18   3.842  -9.614   0.171
  153   2HG   PRO  18          2HG       PRO  18   4.096 -11.244   0.858
  154   1HD   PRO  18          1HD       PRO  18   5.225 -10.534  -1.502
  155   2HD   PRO  18          2HD       PRO  18   4.520 -12.168  -1.306
  156    H    ALA  19           H        ALA  19   3.301  -8.589  -1.377
  157    HA   ALA  19           HA       ALA  19   1.375  -6.556  -1.114
  158   1HB   ALA  19          1HB       ALA  19   4.143  -6.671  -2.346
  159   2HB   ALA  19          2HB       ALA  19   3.238  -5.162  -2.004
  160   3HB   ALA  19          3HB       ALA  19   3.716  -6.242  -0.663
  161    H    ALA  20           H        ALA  20   3.030  -7.869  -4.015
  162    HA   ALA  20           HA       ALA  20   1.997  -6.070  -5.919
  163   1HB   ALA  20          1HB       ALA  20   3.821  -7.687  -6.350
  164   2HB   ALA  20          2HB       ALA  20   2.659  -9.028  -6.203
  165   3HB   ALA  20          3HB       ALA  20   2.503  -7.859  -7.540
  166    H    LEU  21           H        LEU  21   0.745  -9.253  -4.800
  167    HA   LEU  21           HA       LEU  21  -1.620  -9.224  -6.389
  168   1HB   LEU  21          1HB       LEU  21  -0.579 -11.094  -4.947
  169   2HB   LEU  21          2HB       LEU  21  -1.474 -10.370  -3.596
  170    HG   LEU  21           HG       LEU  21  -2.731 -12.231  -4.628
  171   1HD1  LEU  21          1HD2      LEU  21  -3.955  -9.530  -5.309
  172   2HD1  LEU  21          2HD2      LEU  21  -4.845 -11.066  -5.192
  173   3HD1  LEU  21          3HD2      LEU  21  -4.072 -10.371  -3.746
  174   1HD2  LEU  21          1HD1      LEU  21  -2.555 -10.550  -7.160
  175   2HD2  LEU  21          2HD1      LEU  21  -1.738 -12.104  -6.870
  176   3HD2  LEU  21          3HD1      LEU  21  -3.514 -12.037  -6.972
  177    H    PHE  22           H        PHE  22  -1.058  -8.110  -3.069
  178    HA   PHE  22           HA       PHE  22  -3.561  -7.160  -2.263
  179   1HB   PHE  22          1HB       PHE  22  -1.622  -7.438  -0.876
  180   2HB   PHE  22          2HB       PHE  22  -0.703  -6.254  -1.808
  181    HD1  PHE  22           HD1      PHE  22  -1.779  -3.781  -1.841
  182    HD2  PHE  22           HD2      PHE  22  -2.208  -6.737   1.253
  183    HE1  PHE  22           HE1      PHE  22  -2.058  -1.986  -0.195
  184    HE2  PHE  22           HE2      PHE  22  -2.632  -4.941   2.908
  185    HZ   PHE  22           HZ       PHE  22  -2.545  -2.551   2.201
  186    H    VAL  23           H        VAL  23  -0.897  -5.063  -3.335
  187    HA   VAL  23           HA       VAL  23  -2.417  -2.727  -3.714
  188    HB   VAL  23           HB       VAL  23   0.252  -3.700  -4.784
  189   1HG1  VAL  23          1HG2      VAL  23  -0.968  -0.916  -4.985
  190   2HG1  VAL  23          2HG2      VAL  23   0.728  -1.323  -5.327
  191   3HG1  VAL  23          3HG2      VAL  23  -0.568  -1.997  -6.339
  192   1HG2  VAL  23          1HG1      VAL  23  -0.589  -1.744  -2.589
  193   2HG2  VAL  23          2HG1      VAL  23   0.049  -3.384  -2.349
  194   3HG2  VAL  23          3HG1      VAL  23   1.090  -2.121  -3.043
  195    H    GLN  24           H        GLN  24  -1.570  -5.390  -5.967
  196    HA   GLN  24           HA       GLN  24  -2.564  -4.262  -8.337
  197   1HB   GLN  24          1HB       GLN  24  -1.188  -6.247  -8.311
  198   2HB   GLN  24          2HB       GLN  24  -2.359  -7.076  -7.272
  199   1HG   GLN  24          1HG       GLN  24  -3.912  -6.342  -9.426
  200   2HG   GLN  24          2HG       GLN  24  -2.381  -6.805 -10.199
  201   1HE2  GLN  24          2HE2      GLN  24  -3.623  -8.104  -7.072
  202   2HE2  GLN  24          1HE2      GLN  24  -4.128  -9.649  -7.732
  203    H    GLU  25           H        GLU  25  -4.370  -6.200  -5.815
  204    HA   GLU  25           HA       GLU  25  -6.806  -5.986  -7.480
  205   1HB   GLU  25          1HB       GLU  25  -6.480  -6.707  -4.514
  206   2HB   GLU  25          2HB       GLU  25  -7.890  -7.104  -5.516
  207   1HG   GLU  25          1HG       GLU  25  -5.109  -8.141  -6.101
  208   2HG   GLU  25          2HG       GLU  25  -6.220  -8.979  -4.997
  209    H    ALA  26           H        ALA  26  -5.521  -4.466  -4.535
  210    HA   ALA  26           HA       ALA  26  -7.678  -2.767  -3.887
  211   1HB   ALA  26          1HB       ALA  26  -4.688  -2.160  -4.029
  212   2HB   ALA  26          2HB       ALA  26  -5.869  -1.209  -3.097
  213   3HB   ALA  26          3HB       ALA  26  -5.512  -2.897  -2.629
  214    H    ASN  27           H        ASN  27  -5.107  -2.444  -6.254
  215    HA   ASN  27           HA       ASN  27  -5.776   0.070  -7.425
  216   1HB   ASN  27          1HB       ASN  27  -4.073  -2.332  -7.842
  217   2HB   ASN  27          2HB       ASN  27  -4.606  -1.613  -9.351
  218   1HD2  ASN  27          2HD2      ASN  27  -2.599  -1.209  -6.557
  219   2HD2  ASN  27          1HD2      ASN  27  -1.839   0.336  -6.918
  220    H    ARG  28           H        ARG  28  -6.334  -3.294  -8.247
  221    HA   ARG  28           HA       ARG  28  -7.476  -3.286 -10.767
  222   1HB   ARG  28          1HB       ARG  28  -7.749  -4.813  -8.198
  223   2HB   ARG  28          2HB       ARG  28  -8.961  -5.118  -9.405
  224   1HG   ARG  28          1HG       ARG  28  -6.915  -5.368 -11.062
  225   2HG   ARG  28          2HG       ARG  28  -5.968  -5.536  -9.574
  226   1HD   ARG  28          1HD       ARG  28  -7.552  -7.384  -8.856
  227   2HD   ARG  28          2HD       ARG  28  -8.345  -7.269 -10.430
  228    HE   ARG  28           HE       ARG  28  -5.808  -8.532  -9.814
  229   1HH1  ARG  28          2HH1      ARG  28  -7.721  -7.009 -12.354
  230   2HH1  ARG  28          1HH1      ARG  28  -6.857  -7.767 -13.665
  231   1HH2  ARG  28          1HH2      ARG  28  -4.509  -9.322 -11.494
  232   2HH2  ARG  28          2HH2      ARG  28  -4.989  -9.142 -13.165
  233    H    PHE  29           H        PHE  29  -9.084  -3.007  -7.610
  234    HA   PHE  29           HA       PHE  29 -11.614  -2.239  -8.853
  235   1HB   PHE  29          1HB       PHE  29 -10.621  -2.281  -5.996
  236   2HB   PHE  29          2HB       PHE  29 -12.296  -1.940  -6.462
  237    HD1  PHE  29           HD1      PHE  29 -13.424  -3.704  -8.042
  238    HD2  PHE  29           HD2      PHE  29  -9.797  -4.510  -5.889
  239    HE1  PHE  29           HE1      PHE  29 -13.638  -6.106  -8.593
  240    HE2  PHE  29           HE2      PHE  29 -10.052  -6.927  -6.351
  241    HZ   PHE  29           HZ       PHE  29 -11.994  -7.734  -7.710
  242    H    THR  30           H        THR  30 -12.081  -0.354  -9.467
  243    HA   THR  30           HA       THR  30 -10.154   1.838  -9.235
  244    HB   THR  30           HB       THR  30 -11.290   1.240 -11.296
  245    HG1  THR  30           HG1      THR  30 -11.650   3.390 -11.914
  246   1HG2  THR  30          1HG2      THR  30 -13.652   1.985 -11.667
  247   2HG2  THR  30          2HG2      THR  30 -13.529   0.729 -10.409
  248   3HG2  THR  30          3HG2      THR  30 -13.725   2.438  -9.945
  249    H    SER  31           H        SER  31 -10.378   1.679  -6.957
  250    HA   SER  31           HA       SER  31 -12.310   3.540  -5.731
  251   1HB   SER  31          1HB       SER  31 -11.216   0.923  -4.590
  252   2HB   SER  31          2HB       SER  31 -12.506   1.933  -3.903
  253    HG   SER  31           HG       SER  31 -12.573   0.497  -6.354
  254    H    ASP  32           H        ASP  32 -11.550   4.743  -4.020
  255    HA   ASP  32           HA       ASP  32  -8.653   5.086  -3.852
  256   1HB   ASP  32          1HB       ASP  32 -10.253   6.948  -3.704
  257   2HB   ASP  32          2HB       ASP  32 -10.973   6.189  -2.268
  258    H    VAL  33           H        VAL  33  -7.978   3.113  -3.261
  259    HA   VAL  33           HA       VAL  33  -9.091   1.637  -1.020
  260    HB   VAL  33           HB       VAL  33  -6.707   1.111  -2.830
  261   1HG1  VAL  33          1HG1      VAL  33  -8.301  -0.751  -1.021
  262   2HG1  VAL  33          2HG1      VAL  33  -7.002  -1.245  -2.137
  263   3HG1  VAL  33          3HG1      VAL  33  -6.638  -0.201  -0.739
  264   1HG2  VAL  33          1HG2      VAL  33  -9.623   0.233  -2.919
  265   2HG2  VAL  33          2HG2      VAL  33  -8.830   1.394  -4.013
  266   3HG2  VAL  33          3HG2      VAL  33  -8.341  -0.316  -4.036
  267    H    PHE  34           H        PHE  34  -8.026   0.962   0.800
  268    HA   PHE  34           HA       PHE  34  -5.601   2.447   1.597
  269   1HB   PHE  34          1HB       PHE  34  -8.155   2.516   3.235
  270   2HB   PHE  34          2HB       PHE  34  -6.563   3.069   3.749
  271    HD1  PHE  34           HD1      PHE  34  -9.276   3.719   1.264
  272    HD2  PHE  34           HD2      PHE  34  -5.685   5.194   3.126
  273    HE1  PHE  34           HE1      PHE  34  -9.709   5.957   0.315
  274    HE2  PHE  34           HE2      PHE  34  -6.119   7.447   2.164
  275    HZ   PHE  34           HZ       PHE  34  -8.137   7.827   0.762
  276    H    LEU  35           H        LEU  35  -4.794   1.745   3.686
  277    HA   LEU  35           HA       LEU  35  -5.697  -0.882   4.613
  278   1HB   LEU  35          1HB       LEU  35  -3.829  -1.401   3.005
  279   2HB   LEU  35          2HB       LEU  35  -2.760  -0.324   3.953
  280    HG   LEU  35           HG       LEU  35  -3.290  -1.682   5.995
  281   1HD1  LEU  35          1HD1      LEU  35  -5.519  -2.438   5.117
  282   2HD1  LEU  35          2HD1      LEU  35  -4.666  -3.516   3.989
  283   3HD1  LEU  35          3HD1      LEU  35  -4.531  -3.782   5.742
  284   1HD2  LEU  35          1HD2      LEU  35  -1.276  -2.246   4.663
  285   2HD2  LEU  35          2HD2      LEU  35  -1.998  -3.691   5.406
  286   3HD2  LEU  35          3HD2      LEU  35  -2.247  -3.363   3.677
  287    H    GLU  36           H        GLU  36  -5.914  -0.660   6.720
  288    HA   GLU  36           HA       GLU  36  -4.559   1.651   8.037
  289   1HB   GLU  36          1HB       GLU  36  -7.057   0.303   9.041
  290   2HB   GLU  36          2HB       GLU  36  -6.575   2.006   9.227
  291   1HG   GLU  36          1HG       GLU  36  -7.122   2.458   6.919
  292   2HG   GLU  36          2HG       GLU  36  -7.393   0.746   6.582
  293    H    LYS  37           H        LYS  37  -2.803   0.732   9.169
  294    HA   LYS  37           HA       LYS  37  -2.827  -1.917  10.304
  295   1HB   LYS  37          1HB       LYS  37  -1.092   0.548  10.299
  296   2HB   LYS  37          2HB       LYS  37  -0.818  -0.704  11.514
  297   1HG   LYS  37          1HG       LYS  37  -0.651  -2.413   9.692
  298   2HG   LYS  37          2HG       LYS  37  -0.884  -1.130   8.498
  299   1HD   LYS  37          1HD       LYS  37   1.465  -1.535   8.618
  300   2HD   LYS  37          2HD       LYS  37   1.213  -0.008   9.485
  301   1HE   LYS  37          1HE       LYS  37   1.422  -2.758  10.836
  302   2HE   LYS  37          2HE       LYS  37   2.791  -1.671  10.556
  303   1HZ   LYS  37          1HZ       LYS  37   1.680  -0.021  11.887
  304   2HZ   LYS  37          2HZ       LYS  37   0.428  -1.054  12.185
  305   3HZ   LYS  37          3HZ       LYS  37   1.936  -1.411  12.735
  306    H    ASP  38           H        ASP  38  -4.504  -2.240  11.670
  307    HA   ASP  38           HA       ASP  38  -5.962  -1.963  13.368
  308   1HB   ASP  38          1HB       ASP  38  -3.588  -0.631  14.706
  309   2HB   ASP  38          2HB       ASP  38  -5.033  -1.247  15.529
  310    H    GLY  39           H        GLY  39  -5.852   0.104  11.284
  311   1HA   GLY  39          1HA       GLY  39  -7.496   1.993  11.410
  312   2HA   GLY  39          2HA       GLY  39  -6.707   2.412  12.952
  313    H    LYS  40           H        LYS  40  -3.946   1.812  11.746
  314    HA   LYS  40           HA       LYS  40  -3.378   4.490  10.871
  315   1HB   LYS  40          1HB       LYS  40  -1.703   1.956  10.756
  316   2HB   LYS  40          2HB       LYS  40  -1.098   3.625  10.672
  317   1HG   LYS  40          1HG       LYS  40  -2.404   2.207  13.022
  318   2HG   LYS  40          2HG       LYS  40  -0.744   2.822  12.930
  319   1HD   LYS  40          1HD       LYS  40  -3.324   4.436  13.008
  320   2HD   LYS  40          2HD       LYS  40  -2.061   4.391  14.252
  321   1HE   LYS  40          1HE       LYS  40  -1.756   5.486  11.415
  322   2HE   LYS  40          2HE       LYS  40  -1.950   6.461  12.885
  323   1HZ   LYS  40          1HZ       LYS  40   0.110   5.529  13.681
  324   2HZ   LYS  40          2HZ       LYS  40   0.287   4.654  12.293
  325   3HZ   LYS  40          3HZ       LYS  40   0.325   6.300  12.240
  326    H    LYS  41           H        LYS  41  -4.910   4.554   9.030
  327    HA   LYS  41           HA       LYS  41  -4.218   2.788   6.848
  328   1HB   LYS  41          1HB       LYS  41  -6.314   2.921   6.385
  329   2HB   LYS  41          2HB       LYS  41  -6.548   4.059   7.717
  330   1HG   LYS  41          1HG       LYS  41  -5.917   4.768   4.829
  331   2HG   LYS  41          2HG       LYS  41  -7.523   4.842   5.572
  332   1HD   LYS  41          1HD       LYS  41  -6.774   6.538   7.172
  333   2HD   LYS  41          2HD       LYS  41  -5.103   6.418   6.561
  334   1HE   LYS  41          1HE       LYS  41  -5.808   7.216   4.358
  335   2HE   LYS  41          2HE       LYS  41  -7.498   7.283   4.882
  336   1HZ   LYS  41          1HZ       LYS  41  -5.275   8.844   6.012
  337   2HZ   LYS  41          2HZ       LYS  41  -6.444   9.424   5.006
  338   3HZ   LYS  41          3HZ       LYS  41  -6.840   8.913   6.522
  339    H    VAL  42           H        VAL  42  -3.831   3.160   4.831
  340    HA   VAL  42           HA       VAL  42  -3.012   5.797   3.766
  341    HB   VAL  42           HB       VAL  42  -0.953   4.610   2.798
  342   1HG1  VAL  42          1HG1      VAL  42  -1.089   4.913   5.817
  343   2HG1  VAL  42          2HG1      VAL  42   0.400   4.854   4.842
  344   3HG1  VAL  42          3HG1      VAL  42  -0.739   6.206   4.643
  345   1HG2  VAL  42          1HG2      VAL  42  -1.716   2.572   4.940
  346   2HG2  VAL  42          2HG2      VAL  42  -1.764   2.320   3.182
  347   3HG2  VAL  42          3HG2      VAL  42  -0.201   2.562   3.999
  348    H    ASN  43           H        ASN  43  -2.669   5.602   1.315
  349    HA   ASN  43           HA       ASN  43  -4.848   4.086   0.235
  350   1HB   ASN  43          1HB       ASN  43  -4.091   6.235  -0.722
  351   2HB   ASN  43          2HB       ASN  43  -2.551   5.466  -1.183
  352   1HD2  ASN  43          2HD2      ASN  43  -5.911   5.948  -2.057
  353   2HD2  ASN  43          1HD2      ASN  43  -5.825   5.005  -3.528
  354    H    ALA  44           H        ALA  44  -4.807   2.153   0.373
  355    HA   ALA  44           HA       ALA  44  -2.882   0.215   0.645
  356   1HB   ALA  44          1HB       ALA  44  -5.564   0.063  -0.770
  357   2HB   ALA  44          2HB       ALA  44  -4.656  -1.359  -0.210
  358   3HB   ALA  44          3HB       ALA  44  -5.292  -0.180   0.968
  359    H    LYS  45           H        LYS  45  -4.089   1.542  -2.421
  360    HA   LYS  45           HA       LYS  45  -2.667  -0.560  -3.938
  361   1HB   LYS  45          1HB       LYS  45  -3.641   0.617  -5.914
  362   2HB   LYS  45          2HB       LYS  45  -4.853  -0.013  -4.774
  363   1HG   LYS  45          1HG       LYS  45  -5.263   2.175  -3.868
  364   2HG   LYS  45          2HG       LYS  45  -3.819   2.830  -4.638
  365   1HD   LYS  45          1HD       LYS  45  -5.664   3.549  -5.984
  366   2HD   LYS  45          2HD       LYS  45  -4.837   2.266  -6.892
  367   1HE   LYS  45          1HE       LYS  45  -6.549   0.637  -5.805
  368   2HE   LYS  45          2HE       LYS  45  -7.467   2.085  -5.352
  369   1HZ   LYS  45          1HZ       LYS  45  -6.710   1.335  -8.094
  370   2HZ   LYS  45          2HZ       LYS  45  -8.177   1.124  -7.397
  371   3HZ   LYS  45          3HZ       LYS  45  -7.604   2.652  -7.656
  372    H    SER  46           H        SER  46  -1.927   2.433  -2.528
  373    HA   SER  46           HA       SER  46   0.187   2.995  -4.519
  374   1HB   SER  46          1HB       SER  46  -0.862   4.632  -2.179
  375   2HB   SER  46          2HB       SER  46   0.393   5.150  -3.326
  376    HG   SER  46           HG       SER  46  -2.281   4.450  -3.981
  377    H    ILE  47           H        ILE  47   2.225   3.750  -3.627
  378    HA   ILE  47           HA       ILE  47   3.791   2.059  -2.197
  379    HB   ILE  47           HB       ILE  47   4.822   3.843  -3.278
  380   1HG1  ILE  47          1HG1      ILE  47   5.640   3.216  -0.835
  381   2HG1  ILE  47          2HG1      ILE  47   6.410   4.528  -1.722
  382   1HG2  ILE  47          1HG2      ILE  47   2.969   5.458  -3.281
  383   2HG2  ILE  47          2HG2      ILE  47   3.288   5.816  -1.566
  384   3HG2  ILE  47          3HG2      ILE  47   4.505   6.218  -2.797
  385   1HD1  ILE  47          1HD1      ILE  47   4.909   6.177  -0.556
  386   2HD1  ILE  47          2HD1      ILE  47   4.172   4.847   0.344
  387   3HD1  ILE  47          3HD1      ILE  47   5.872   5.244   0.615
  388    H    MET  48           H        MET  48   2.153   4.882  -0.678
  389    HA   MET  48           HA       MET  48   3.249   4.132   1.804
  390   1HB   MET  48          1HB       MET  48   2.440   6.400   1.231
  391   2HB   MET  48          2HB       MET  48   0.768   5.836   1.373
  392   1HG   MET  48          1HG       MET  48   1.222   5.226   3.747
  393   2HG   MET  48          2HG       MET  48   2.915   5.698   3.536
  394   1HE   MET  48          1HE       MET  48   0.011   7.654   1.900
  395   2HE   MET  48          2HE       MET  48  -0.791   7.023   3.364
  396   3HE   MET  48          3HE       MET  48  -0.503   8.774   3.187
  397    H    GLY  49           H        GLY  49   0.530   2.729   0.164
  398   1HA   GLY  49          1HA       GLY  49  -0.378   1.438   2.632
  399   2HA   GLY  49          2HA       GLY  49  -0.908   1.041   0.956
  400    H    LEU  50           H        LEU  50   1.107   0.261  -0.480
  401    HA   LEU  50           HA       LEU  50   1.953  -2.225   0.367
  402   1HB   LEU  50          1HB       LEU  50   2.279  -0.523  -1.831
  403   2HB   LEU  50          2HB       LEU  50   3.936  -0.848  -1.271
  404    HG   LEU  50           HG       LEU  50   1.894  -3.030  -1.861
  405   1HD1  LEU  50          1HD1      LEU  50   4.401  -2.214  -3.386
  406   2HD1  LEU  50          2HD1      LEU  50   3.381  -3.634  -3.727
  407   3HD1  LEU  50          3HD1      LEU  50   2.723  -1.992  -3.948
  408   1HD2  LEU  50          1HD2      LEU  50   4.819  -3.055  -0.972
  409   2HD2  LEU  50          2HD2      LEU  50   3.398  -3.676  -0.108
  410   3HD2  LEU  50          3HD2      LEU  50   3.947  -4.473  -1.586
  411    H    MET  51           H        MET  51   4.127   0.566   0.036
  412    HA   MET  51           HA       MET  51   6.365  -0.819   1.141
  413   1HB   MET  51          1HB       MET  51   6.476   1.054  -0.634
  414   2HB   MET  51          2HB       MET  51   5.900   2.146   0.633
  415   1HG   MET  51          1HG       MET  51   7.888   1.271   2.039
  416   2HG   MET  51          2HG       MET  51   8.540   0.682   0.501
  417   1HE   MET  51          1HE       MET  51   6.422   3.820   1.425
  418   2HE   MET  51          2HE       MET  51   7.611   3.694   2.753
  419   3HE   MET  51          3HE       MET  51   7.678   5.071   1.621
  420    H    SER  52           H        SER  52   4.074   1.713   2.184
  421    HA   SER  52           HA       SER  52   5.610   2.120   4.629
  422   1HB   SER  52          1HB       SER  52   2.895   3.291   4.012
  423   2HB   SER  52          2HB       SER  52   4.102   3.896   5.161
  424    HG   SER  52           HG       SER  52   5.505   4.168   3.298
  425    H    LEU  53           H        LEU  53   2.043   1.543   4.554
  426    HA   LEU  53           HA       LEU  53   2.269   0.575   7.304
  427   1HB   LEU  53          1HB       LEU  53  -0.060   0.945   5.443
  428   2HB   LEU  53          2HB       LEU  53  -0.179   0.229   7.063
  429    HG   LEU  53           HG       LEU  53  -0.618   2.544   7.308
  430   1HD1  LEU  53          1HD1      LEU  53   0.775   1.536   9.071
  431   2HD1  LEU  53          2HD1      LEU  53   2.243   1.977   8.163
  432   3HD1  LEU  53          3HD1      LEU  53   1.192   3.249   8.831
  433   1HD2  LEU  53          1HD2      LEU  53   0.526   3.172   5.138
  434   2HD2  LEU  53          2HD2      LEU  53   0.845   4.300   6.490
  435   3HD2  LEU  53          3HD2      LEU  53   2.076   3.102   6.011
  436    H    ALA  54           H        ALA  54   1.037  -0.745   4.289
  437    HA   ALA  54           HA       ALA  54   0.249  -3.299   5.129
  438   1HB   ALA  54          1HB       ALA  54  -0.539  -2.123   3.121
  439   2HB   ALA  54          2HB       ALA  54   1.082  -2.262   2.405
  440   3HB   ALA  54          3HB       ALA  54   0.113  -3.722   2.710
  441    H    VAL  55           H        VAL  55   3.517  -2.151   4.457
  442    HA   VAL  55           HA       VAL  55   4.569  -4.765   3.924
  443    HB   VAL  55           HB       VAL  55   5.667  -2.585   3.364
  444   1HG1  VAL  55          1HG1      VAL  55   6.296  -2.558   6.347
  445   2HG1  VAL  55          2HG1      VAL  55   6.985  -1.466   5.120
  446   3HG1  VAL  55          3HG1      VAL  55   5.251  -1.396   5.490
  447   1HG2  VAL  55          1HG2      VAL  55   7.254  -4.533   5.076
  448   2HG2  VAL  55          2HG2      VAL  55   6.936  -4.680   3.332
  449   3HG2  VAL  55          3HG2      VAL  55   7.957  -3.353   3.939
  450    H    SER  56           H        SER  56   3.283  -3.438   6.830
  451    HA   SER  56           HA       SER  56   5.091  -4.856   8.574
  452   1HB   SER  56          1HB       SER  56   2.358  -3.723   9.246
  453   2HB   SER  56          2HB       SER  56   3.707  -4.012  10.353
  454    HG   SER  56           HG       SER  56   3.514  -2.083   8.263
  455    H    THR  57           H        THR  57   4.727  -6.974   7.285
  456    HA   THR  57           HA       THR  57   2.576  -8.591   7.422
  457    HB   THR  57           HB       THR  57   5.306  -9.586   8.312
  458    HG1  THR  57           HG1      THR  57   5.170 -10.125   5.913
  459   1HG2  THR  57          1HG2      THR  57   4.449 -11.622   7.110
  460   2HG2  THR  57          2HG2      THR  57   3.487 -11.213   8.560
  461   3HG2  THR  57          3HG2      THR  57   2.881 -10.811   6.930
  462    H    GLY  58           H        GLY  58   1.246  -9.406   8.787
  463   1HA   GLY  58          1HA       GLY  58   0.478 -10.441  10.756
  464   2HA   GLY  58          2HA       GLY  58   1.926  -9.940  11.622
  465    H    THR  59           H        THR  59   0.796  -7.141  10.008
  466    HA   THR  59           HA       THR  59  -0.408  -6.404  12.570
  467    HB   THR  59           HB       THR  59  -0.208  -4.694  10.048
  468    HG1  THR  59           HG1      THR  59   1.849  -5.454  10.768
  469   1HG2  THR  59          1HG2      THR  59  -0.290  -2.788  11.616
  470   2HG2  THR  59          2HG2      THR  59  -1.727  -3.824  11.791
  471   3HG2  THR  59          3HG2      THR  59  -0.412  -3.914  12.983
  472    H    GLU  60           H        GLU  60  -2.601  -6.300  12.971
  473    HA   GLU  60           HA       GLU  60  -4.341  -7.209  10.794
  474   1HB   GLU  60          1HB       GLU  60  -5.155  -6.135  13.527
  475   2HB   GLU  60          2HB       GLU  60  -6.132  -7.106  12.386
  476   1HG   GLU  60          1HG       GLU  60  -4.621  -8.998  12.591
  477   2HG   GLU  60          2HG       GLU  60  -3.528  -8.064  13.623
  478    H    VAL  61           H        VAL  61  -4.703  -5.869   9.196
  479    HA   VAL  61           HA       VAL  61  -5.087  -2.989   9.814
  480    HB   VAL  61           HB       VAL  61  -3.821  -2.454   7.762
  481   1HG1  VAL  61          1HG1      VAL  61  -2.655  -2.766   9.988
  482   2HG1  VAL  61          2HG1      VAL  61  -2.318  -4.447   9.516
  483   3HG1  VAL  61          3HG1      VAL  61  -1.610  -3.103   8.583
  484   1HG2  VAL  61          1HG2      VAL  61  -4.244  -4.586   6.515
  485   2HG2  VAL  61          2HG2      VAL  61  -2.506  -4.207   6.651
  486   3HG2  VAL  61          3HG2      VAL  61  -3.231  -5.443   7.713
  487    H    THR  62           H        THR  62  -6.625  -1.919   8.627
  488    HA   THR  62           HA       THR  62  -8.570  -3.763   7.369
  489    HB   THR  62           HB       THR  62  -8.936  -0.808   7.997
  490    HG1  THR  62           HG1      THR  62  -8.477  -2.217   9.875
  491   1HG2  THR  62          1HG2      THR  62 -11.352  -1.493   7.973
  492   2HG2  THR  62          2HG2      THR  62 -10.571  -1.765   6.408
  493   3HG2  THR  62          3HG2      THR  62 -10.856  -3.130   7.508
  494    H    LEU  63           H        LEU  63  -8.772  -3.994   5.252
  495    HA   LEU  63           HA       LEU  63  -7.426  -2.058   3.467
  496   1HB   LEU  63          1HB       LEU  63  -8.555  -4.847   3.125
  497   2HB   LEU  63          2HB       LEU  63  -8.166  -3.815   1.721
  498    HG   LEU  63           HG       LEU  63  -6.211  -4.228   4.000
  499   1HD1  LEU  63          1HD2      LEU  63  -6.674  -6.430   2.975
  500   2HD1  LEU  63          2HD2      LEU  63  -6.325  -5.748   1.369
  501   3HD1  LEU  63          3HD2      LEU  63  -5.037  -5.850   2.588
  502   1HD2  LEU  63          1HD1      LEU  63  -5.928  -2.257   2.500
  503   2HD2  LEU  63          2HD1      LEU  63  -4.606  -3.434   2.284
  504   3HD2  LEU  63          3HD1      LEU  63  -5.922  -3.342   1.089
  505    H    ILE  64           H        ILE  64  -8.446  -0.441   2.864
  506    HA   ILE  64           HA       ILE  64 -11.406  -0.285   2.893
  507    HB   ILE  64           HB       ILE  64  -9.253   1.852   2.492
  508   1HG1  ILE  64          1HG1      ILE  64 -10.892   1.143   4.943
  509   2HG1  ILE  64          2HG1      ILE  64  -9.130   0.957   4.774
  510   1HG2  ILE  64          1HG2      ILE  64 -12.253   2.015   2.972
  511   2HG2  ILE  64          2HG2      ILE  64 -11.150   3.413   2.949
  512   3HG2  ILE  64          3HG2      ILE  64 -11.394   2.445   1.474
  513   1HD1  ILE  64          1HD1      ILE  64  -8.983   3.449   4.493
  514   2HD1  ILE  64          2HD1      ILE  64 -10.746   3.541   4.748
  515   3HD1  ILE  64          3HD1      ILE  64  -9.689   2.952   6.059
  516    H    ALA  65           H        ALA  65 -12.508   0.264   1.013
  517    HA   ALA  65           HA       ALA  65 -10.967   0.891  -1.378
  518   1HB   ALA  65          1HB       ALA  65 -13.153  -1.228  -1.321
  519   2HB   ALA  65          2HB       ALA  65 -12.393  -0.566  -2.786
  520   3HB   ALA  65          3HB       ALA  65 -11.432  -1.538  -1.645
  521    H    GLN  66           H        GLN  66 -11.581   2.893  -1.439
  522    HA   GLN  66           HA       GLN  66 -14.464   3.449  -1.026
  523   1HB   GLN  66          1HB       GLN  66 -12.980   4.325   0.683
  524   2HB   GLN  66          2HB       GLN  66 -11.878   4.979  -0.516
  525   1HG   GLN  66          1HG       GLN  66 -14.548   6.020  -0.924
  526   2HG   GLN  66          2HG       GLN  66 -14.054   6.222   0.773
  527   1HE2  GLN  66          2HE2      GLN  66 -11.645   7.005   1.019
  528   2HE2  GLN  66          1HE2      GLN  66 -11.072   8.179  -0.161
  529    H    GLY  67           H        GLY  67 -14.366   2.471  -3.229
  530   1HA   GLY  67          1HA       GLY  67 -14.012   4.599  -5.296
  531   2HA   GLY  67          2HA       GLY  67 -13.301   3.015  -5.454
  532    H    GLU  68           H        GLU  68 -14.520   3.213  -7.442
  533    HA   GLU  68           HA       GLU  68 -17.296   2.802  -7.680
  534   1HB   GLU  68          1HB       GLU  68 -14.953   1.752  -9.305
  535   2HB   GLU  68          2HB       GLU  68 -16.641   1.809  -9.861
  536   1HG   GLU  68          1HG       GLU  68 -14.902   4.195  -9.091
  537   2HG   GLU  68          2HG       GLU  68 -15.398   3.744 -10.739
  538    H    ASP  69           H        ASP  69 -14.683   0.491  -6.681
  539    HA   ASP  69           HA       ASP  69 -16.756  -1.677  -6.822
  540   1HB   ASP  69          1HB       ASP  69 -13.773  -1.983  -6.805
  541   2HB   ASP  69          2HB       ASP  69 -15.000  -3.230  -7.060
  542    H    GLU  70           H        GLU  70 -16.113   0.525  -4.705
  543    HA   GLU  70           HA       GLU  70 -14.365  -0.036  -2.877
  544   1HB   GLU  70          1HB       GLU  70 -15.747   1.117  -1.272
  545   2HB   GLU  70          2HB       GLU  70 -15.835   1.829  -2.893
  546   1HG   GLU  70          1HG       GLU  70 -18.017   1.863  -2.713
  547   2HG   GLU  70          2HG       GLU  70 -17.993   0.104  -2.913
  548    H    GLN  71           H        GLN  71 -17.596  -1.325  -1.820
  549    HA   GLN  71           HA       GLN  71 -16.597  -2.962   0.105
  550   1HB   GLN  71          1HB       GLN  71 -19.015  -3.003  -1.628
  551   2HB   GLN  71          2HB       GLN  71 -18.604  -4.551  -0.860
  552   1HG   GLN  71          1HG       GLN  71 -18.835  -1.938   0.653
  553   2HG   GLN  71          2HG       GLN  71 -20.147  -3.120   0.501
  554   1HE2  GLN  71          2HE2      GLN  71 -17.252  -4.965   0.633
  555   2HE2  GLN  71          1HE2      GLN  71 -17.284  -5.244   2.352
  556    H    GLU  72           H        GLU  72 -16.600  -3.657  -3.352
  557    HA   GLU  72           HA       GLU  72 -16.063  -6.496  -3.202
  558   1HB   GLU  72          1HB       GLU  72 -17.120  -5.611  -5.151
  559   2HB   GLU  72          2HB       GLU  72 -16.004  -4.226  -5.192
  560   1HG   GLU  72          1HG       GLU  72 -15.496  -5.596  -7.028
  561   2HG   GLU  72          2HG       GLU  72 -14.167  -5.759  -5.872
  562    H    ALA  73           H        ALA  73 -14.178  -3.554  -3.848
  563    HA   ALA  73           HA       ALA  73 -11.598  -4.584  -4.365
  564   1HB   ALA  73          1HB       ALA  73 -12.779  -2.014  -3.236
  565   2HB   ALA  73          2HB       ALA  73 -11.132  -2.134  -3.921
  566   3HB   ALA  73          3HB       ALA  73 -12.574  -2.395  -4.943
  567    H    LEU  74           H        LEU  74 -13.039  -3.137  -1.459
  568    HA   LEU  74           HA       LEU  74 -10.807  -3.573   0.238
  569   1HB   LEU  74          1HB       LEU  74 -12.390  -2.848   2.016
  570   2HB   LEU  74          2HB       LEU  74 -12.412  -1.872   0.527
  571    HG   LEU  74           HG       LEU  74 -14.371  -3.499  -0.158
  572   1HD1  LEU  74          1HD2      LEU  74 -14.562  -3.265   2.868
  573   2HD1  LEU  74          2HD2      LEU  74 -15.869  -3.798   1.778
  574   3HD1  LEU  74          3HD2      LEU  74 -14.386  -4.780   1.930
  575   1HD2  LEU  74          1HD1      LEU  74 -14.326  -1.025  -0.070
  576   2HD2  LEU  74          2HD1      LEU  74 -15.858  -1.676   0.534
  577   3HD2  LEU  74          3HD1      LEU  74 -14.632  -1.077   1.678
  578    H    GLU  75           H        GLU  75 -13.809  -5.597  -0.229
  579    HA   GLU  75           HA       GLU  75 -13.023  -7.537   1.695
  580   1HB   GLU  75          1HB       GLU  75 -14.648  -7.907  -0.845
  581   2HB   GLU  75          2HB       GLU  75 -14.506  -9.072   0.488
  582   1HG   GLU  75          1HG       GLU  75 -15.711  -6.293   0.636
  583   2HG   GLU  75          2HG       GLU  75 -16.586  -7.829   0.717
  584    H    LYS  76           H        LYS  76 -12.413  -7.396  -1.838
  585    HA   LYS  76           HA       LYS  76 -11.015  -9.761  -2.323
  586   1HB   LYS  76          1HB       LYS  76 -10.295  -6.930  -3.197
  587   2HB   LYS  76          2HB       LYS  76  -9.731  -8.410  -4.000
  588   1HG   LYS  76          1HG       LYS  76 -12.661  -7.727  -3.635
  589   2HG   LYS  76          2HG       LYS  76 -11.747  -7.157  -5.038
  590   1HD   LYS  76          1HD       LYS  76 -12.004 -10.100  -4.292
  591   2HD   LYS  76          2HD       LYS  76 -12.956  -9.256  -5.551
  592   1HE   LYS  76          1HE       LYS  76 -10.913  -8.602  -6.719
  593   2HE   LYS  76          2HE       LYS  76  -9.909  -9.341  -5.461
  594   1HZ   LYS  76          1HZ       LYS  76 -11.774 -10.759  -7.237
  595   2HZ   LYS  76          2HZ       LYS  76 -10.130 -10.746  -7.364
  596   3HZ   LYS  76          3HZ       LYS  76 -10.850 -11.461  -6.061
  597    H    LEU  77           H        LEU  77  -9.701  -6.630  -1.359
  598    HA   LEU  77           HA       LEU  77  -7.046  -7.473  -0.947
  599   1HB   LEU  77          1HB       LEU  77  -8.733  -5.133  -0.323
  600   2HB   LEU  77          2HB       LEU  77  -7.206  -5.269   0.595
  601    HG   LEU  77           HG       LEU  77  -7.151  -4.081  -1.776
  602   1HD1  LEU  77          1HD1      LEU  77  -5.244  -4.686  -0.275
  603   2HD1  LEU  77          2HD1      LEU  77  -5.238  -6.313  -1.014
  604   3HD1  LEU  77          3HD1      LEU  77  -4.859  -4.886  -2.011
  605   1HD2  LEU  77          1HD2      LEU  77  -6.865  -7.052  -2.462
  606   2HD2  LEU  77          2HD2      LEU  77  -8.188  -6.016  -3.038
  607   3HD2  LEU  77          3HD2      LEU  77  -6.504  -5.706  -3.556
  608    H    ALA  78           H        ALA  78  -9.488  -6.822   1.709
  609    HA   ALA  78           HA       ALA  78  -7.710  -7.761   3.705
  610   1HB   ALA  78          1HB       ALA  78  -9.709  -6.482   4.235
  611   2HB   ALA  78          2HB       ALA  78 -10.743  -7.826   3.678
  612   3HB   ALA  78          3HB       ALA  78  -9.703  -8.022   5.114
  613    H    ALA  79           H        ALA  79  -9.862  -9.585   1.533
  614    HA   ALA  79           HA       ALA  79  -9.779 -12.110   2.865
  615   1HB   ALA  79          1HB       ALA  79 -11.292 -11.432   0.950
  616   2HB   ALA  79          2HB       ALA  79  -9.846 -11.439  -0.103
  617   3HB   ALA  79          3HB       ALA  79 -10.417 -12.954   0.639
  618    H    TYR  80           H        TYR  80  -7.853 -10.634   0.239
  619    HA   TYR  80           HA       TYR  80  -6.162 -12.922  -0.103
  620   1HB   TYR  80          1HB       TYR  80  -6.727 -11.334  -1.842
  621   2HB   TYR  80          2HB       TYR  80  -5.996 -10.015  -0.929
  622    HD1  TYR  80           HD1      TYR  80  -4.923 -13.431  -2.091
  623    HD2  TYR  80           HD2      TYR  80  -3.846  -9.325  -1.375
  624    HE1  TYR  80           HE1      TYR  80  -2.529 -14.051  -2.149
  625    HE2  TYR  80           HE2      TYR  80  -1.435  -9.939  -1.514
  626    HH   TYR  80           HH       TYR  80  -0.395 -13.339  -1.760
  627    H    VAL  81           H        VAL  81  -5.507  -9.712   1.282
  628    HA   VAL  81           HA       VAL  81  -2.785  -9.934   1.708
  629    HB   VAL  81           HB       VAL  81  -3.099  -8.091   3.300
  630   1HG1  VAL  81          1HG1      VAL  81  -3.397  -7.820   0.829
  631   2HG1  VAL  81          2HG1      VAL  81  -5.143  -8.075   1.048
  632   3HG1  VAL  81          3HG1      VAL  81  -4.359  -6.647   1.775
  633   1HG2  VAL  81          1HG2      VAL  81  -6.033  -8.950   3.163
  634   2HG2  VAL  81          2HG2      VAL  81  -4.973  -9.120   4.572
  635   3HG2  VAL  81          3HG2      VAL  81  -5.436  -7.498   4.009
  636    H    GLN  82           H        GLN  82  -5.299 -11.262   3.751
  637    HA   GLN  82           HA       GLN  82  -3.433 -11.832   5.962
  638   1HB   GLN  82          1HB       GLN  82  -5.572 -12.264   7.124
  639   2HB   GLN  82          2HB       GLN  82  -5.819 -10.815   6.121
  640   1HG   GLN  82          1HG       GLN  82  -6.831 -12.257   4.346
  641   2HG   GLN  82          2HG       GLN  82  -6.272 -13.645   5.255
  642   1HE2  GLN  82          2HE2      GLN  82  -8.836 -11.677   4.710
  643   2HE2  GLN  82          1HE2      GLN  82  -9.954 -12.323   5.928
  644    H    GLU  83           H        GLU  83  -4.509 -13.311   3.122
  645    HA   GLU  83           HA       GLU  83  -5.804 -15.633   3.813
  646   1HB   GLU  83          1HB       GLU  83  -5.797 -14.339   1.777
  647   2HB   GLU  83          2HB       GLU  83  -4.172 -14.928   1.357
  648   1HG   GLU  83          1HG       GLU  83  -5.036 -17.228   1.172
  649   2HG   GLU  83          2HG       GLU  83  -6.646 -16.675   1.701
  650    H    GLU  84           H        GLU  84  -2.393 -15.662   2.603
  651    HA   GLU  84           HA       GLU  84  -2.258 -18.348   3.908
  652   1HB   GLU  84          1HB       GLU  84  -0.413 -18.770   2.196
  653   2HB   GLU  84          2HB       GLU  84  -2.082 -18.749   1.603
  654   1HG   GLU  84          1HG       GLU  84  -0.499 -16.194   1.500
  655   2HG   GLU  84          2HG       GLU  84  -0.228 -17.460   0.269
  656    H    VAL  85           H        VAL  85   0.592 -17.035   2.683
  657    HA   VAL  85           HA       VAL  85   1.378 -15.319   4.822
  658    HB   VAL  85           HB       VAL  85   1.711 -17.273   6.240
  659   1HG1  VAL  85          1HG1      VAL  85   3.283 -18.724   3.996
  660   2HG1  VAL  85          2HG1      VAL  85   3.110 -19.288   5.677
  661   3HG1  VAL  85          3HG1      VAL  85   1.696 -19.202   4.643
  662   1HG2  VAL  85          1HG2      VAL  85   3.686 -15.684   6.288
  663   2HG2  VAL  85          2HG2      VAL  85   4.156 -17.343   6.675
  664   3HG2  VAL  85          3HG2      VAL  85   4.515 -16.673   5.062
  Start of MODEL    3
    1   1H    VAL   2          1H        VAL   2 -17.151   6.551  -1.298
    2   2H    VAL   2          2H        VAL   2 -16.994   5.814  -2.802
    3   3H    VAL   2          3H        VAL   2 -18.404   6.643  -2.415
    4    HA   VAL   2           HA       VAL   2 -18.942   5.087  -0.729
    5    HB   VAL   2           HB       VAL   2 -18.254   3.755  -3.374
    6   1HG1  VAL   2          1HG2      VAL   2 -18.964   2.194  -1.584
    7   2HG1  VAL   2          2HG2      VAL   2 -20.429   3.164  -1.312
    8   3HG1  VAL   2          3HG2      VAL   2 -20.198   2.322  -2.865
    9   1HG2  VAL   2          1HG1      VAL   2 -19.532   5.863  -3.657
   10   2HG2  VAL   2          2HG1      VAL   2 -20.534   4.444  -4.049
   11   3HG2  VAL   2          3HG1      VAL   2 -20.740   5.281  -2.491
   12    H    GLN   3           H        GLN   3 -17.418   4.807   0.975
   13    HA   GLN   3           HA       GLN   3 -15.036   3.199   0.264
   14   1HB   GLN   3          1HB       GLN   3 -14.864   5.611   1.154
   15   2HB   GLN   3          2HB       GLN   3 -15.390   4.951   2.719
   16   1HG   GLN   3          1HG       GLN   3 -13.447   3.313   2.560
   17   2HG   GLN   3          2HG       GLN   3 -12.938   4.140   1.106
   18   1HE2  GLN   3          2HE2      GLN   3 -13.417   4.592   4.615
   19   2HE2  GLN   3          1HE2      GLN   3 -12.371   5.994   4.719
   20    H    GLN   4           H        GLN   4 -14.808   1.171   1.057
   21    HA   GLN   4           HA       GLN   4 -15.843   0.634   3.784
   22   1HB   GLN   4          1HB       GLN   4 -17.530  -0.388   2.329
   23   2HB   GLN   4          2HB       GLN   4 -16.261  -1.062   1.294
   24   1HG   GLN   4          1HG       GLN   4 -17.090  -2.838   2.679
   25   2HG   GLN   4          2HG       GLN   4 -15.450  -2.435   3.220
   26   1HE2  GLN   4          2HE2      GLN   4 -18.749  -2.713   4.036
   27   2HE2  GLN   4          1HE2      GLN   4 -18.655  -2.116   5.702
   28    H    LYS   5           H        LYS   5 -14.499  -1.163   4.854
   29    HA   LYS   5           HA       LYS   5 -12.084  -1.964   3.410
   30   1HB   LYS   5          1HB       LYS   5 -10.665  -1.074   5.220
   31   2HB   LYS   5          2HB       LYS   5 -11.454   0.222   4.310
   32   1HG   LYS   5          1HG       LYS   5 -12.658  -0.883   6.854
   33   2HG   LYS   5          2HG       LYS   5 -11.403   0.385   6.917
   34   1HD   LYS   5          1HD       LYS   5 -12.768   1.954   5.751
   35   2HD   LYS   5          2HD       LYS   5 -13.890   0.687   5.215
   36   1HE   LYS   5          1HE       LYS   5 -13.536   1.580   8.103
   37   2HE   LYS   5          2HE       LYS   5 -14.880   2.016   7.023
   38   1HZ   LYS   5          1HZ       LYS   5 -15.413  -0.316   6.847
   39   2HZ   LYS   5          2HZ       LYS   5 -14.210  -0.703   7.900
   40   3HZ   LYS   5          3HZ       LYS   5 -15.489   0.204   8.409
   41    H    VAL   6           H        VAL   6 -11.248  -3.866   4.305
   42    HA   VAL   6           HA       VAL   6 -12.713  -4.883   6.677
   43    HB   VAL   6           HB       VAL   6 -12.725  -7.155   5.744
   44   1HG1  VAL   6          1HG2      VAL   6 -14.688  -5.678   5.444
   45   2HG1  VAL   6          2HG2      VAL   6 -14.010  -5.098   3.907
   46   3HG1  VAL   6          3HG2      VAL   6 -14.502  -6.799   4.074
   47   1HG2  VAL   6          1HG1      VAL   6 -11.680  -5.807   3.219
   48   2HG2  VAL   6          2HG1      VAL   6 -10.848  -7.039   4.196
   49   3HG2  VAL   6          3HG1      VAL   6 -12.327  -7.464   3.298
   50    H    GLU   7           H        GLU   7 -11.288  -5.742   8.259
   51    HA   GLU   7           HA       GLU   7  -8.580  -4.932   7.616
   52   1HB   GLU   7          1HB       GLU   7  -9.757  -4.286   9.723
   53   2HB   GLU   7          2HB       GLU   7  -9.613  -5.972  10.299
   54   1HG   GLU   7          1HG       GLU   7  -7.189  -5.803  10.281
   55   2HG   GLU   7          2HG       GLU   7  -7.264  -4.271   9.379
   56    H    VAL   8           H        VAL   8  -6.649  -6.071   8.175
   57    HA   VAL   8           HA       VAL   8  -6.899  -9.014   7.957
   58    HB   VAL   8           HB       VAL   8  -5.551  -9.069   6.011
   59   1HG1  VAL   8          1HG1      VAL   8  -7.215  -6.528   5.745
   60   2HG1  VAL   8          2HG1      VAL   8  -6.579  -7.506   4.387
   61   3HG1  VAL   8          3HG1      VAL   8  -7.787  -8.194   5.491
   62   1HG2  VAL   8          1HG2      VAL   8  -3.798  -7.506   6.766
   63   2HG2  VAL   8          2HG2      VAL   8  -4.315  -7.145   5.101
   64   3HG2  VAL   8          3HG2      VAL   8  -4.897  -6.136   6.455
   65    H    ARG   9           H        ARG   9  -5.043 -10.104   8.875
   66    HA   ARG   9           HA       ARG   9  -3.180  -8.224  10.271
   67   1HB   ARG   9          1HB       ARG   9  -3.897 -10.251  11.579
   68   2HB   ARG   9          2HB       ARG   9  -3.220 -11.272  10.272
   69   1HG   ARG   9          1HG       ARG   9  -1.009 -10.020  10.659
   70   2HG   ARG   9          2HG       ARG   9  -1.742  -9.440  12.178
   71   1HD   ARG   9          1HD       ARG   9  -0.414 -11.598  12.427
   72   2HD   ARG   9          2HD       ARG   9  -2.112 -11.736  12.906
   73    HE   ARG   9           HE       ARG   9  -2.428 -13.275  11.224
   74   1HH1  ARG   9          1HH2      ARG   9   0.455 -11.413  10.542
   75   2HH1  ARG   9          2HH2      ARG   9   0.728 -12.030   8.945
   76   1HH2  ARG   9          2HH1      ARG   9  -2.114 -14.223   9.156
   77   2HH2  ARG   9          1HH1      ARG   9  -0.737 -13.796   8.186
   78    H    LEU  10           H        LEU  10  -1.185  -7.849   9.272
   79    HA   LEU  10           HA       LEU  10  -0.969  -8.544   6.536
   80   1HB   LEU  10          1HB       LEU  10   0.989  -7.390   8.530
   81   2HB   LEU  10          2HB       LEU  10   1.559  -7.987   6.963
   82    HG   LEU  10           HG       LEU  10   1.161  -5.754   6.523
   83   1HD1  LEU  10          1HD1      LEU  10   0.112  -7.314   4.894
   84   2HD1  LEU  10          2HD1      LEU  10  -1.436  -7.157   5.760
   85   3HD1  LEU  10          3HD1      LEU  10  -0.703  -5.738   4.970
   86   1HD2  LEU  10          1HD2      LEU  10  -1.430  -6.011   8.078
   87   2HD2  LEU  10          2HD2      LEU  10   0.052  -5.159   8.583
   88   3HD2  LEU  10          3HD2      LEU  10  -0.886  -4.563   7.194
   89    H    LYS  11           H        LYS  11  -1.344 -10.771   6.364
   90    HA   LYS  11           HA       LYS  11   0.656 -12.666   7.244
   91   1HB   LYS  11          1HB       LYS  11  -1.524 -13.491   6.668
   92   2HB   LYS  11          2HB       LYS  11  -1.493 -12.717   5.074
   93   1HG   LYS  11          1HG       LYS  11   0.570 -14.807   5.681
   94   2HG   LYS  11          2HG       LYS  11  -1.090 -15.236   5.182
   95   1HD   LYS  11          1HD       LYS  11   0.849 -13.428   3.668
   96   2HD   LYS  11          2HD       LYS  11   0.182 -14.986   3.129
   97   1HE   LYS  11          1HE       LYS  11  -1.517 -12.517   3.740
   98   2HE   LYS  11          2HE       LYS  11  -0.942 -13.007   2.122
   99   1HZ   LYS  11          1HZ       LYS  11  -2.628 -14.662   3.782
  100   2HZ   LYS  11          2HZ       LYS  11  -3.112 -13.737   2.484
  101   3HZ   LYS  11          3HZ       LYS  11  -2.082 -14.998   2.265
  102    H    THR  12           H        THR  12   0.107 -10.742   4.298
  103    HA   THR  12           HA       THR  12   2.639 -11.459   3.014
  104    HB   THR  12           HB       THR  12   2.179  -9.161   1.931
  105    HG1  THR  12           HG1      THR  12  -0.466  -9.733   2.904
  106   1HG2  THR  12          1HG2      THR  12   0.257 -11.462   1.562
  107   2HG2  THR  12          2HG2      THR  12   0.706 -10.230   0.346
  108   3HG2  THR  12          3HG2      THR  12   1.930 -11.365   0.955
  109    H    GLY  13           H        GLY  13   1.317  -8.542   4.467
  110   1HA   GLY  13          1HA       GLY  13   2.334  -6.786   5.730
  111   2HA   GLY  13          2HA       GLY  13   3.830  -7.760   5.850
  112    H    LEU  14           H        LEU  14   1.842  -7.218   3.040
  113    HA   LEU  14           HA       LEU  14   2.416  -6.638   0.852
  114   1HB   LEU  14          1HB       LEU  14   2.597  -4.274   2.697
  115   2HB   LEU  14          2HB       LEU  14   2.825  -4.078   0.960
  116    HG   LEU  14           HG       LEU  14   0.477  -3.693   1.683
  117   1HD1  LEU  14          1HD1      LEU  14   0.974  -4.405  -0.620
  118   2HD1  LEU  14          2HD1      LEU  14   0.740  -6.099  -0.120
  119   3HD1  LEU  14          3HD1      LEU  14  -0.620  -4.952  -0.050
  120   1HD2  LEU  14          1HD2      LEU  14   0.362  -5.365   3.495
  121   2HD2  LEU  14          2HD2      LEU  14  -0.969  -5.544   2.324
  122   3HD2  LEU  14          3HD2      LEU  14   0.411  -6.665   2.282
  123    H    GLN  15           H        GLN  15   4.404  -8.132   1.039
  124    HA   GLN  15           HA       GLN  15   6.891  -6.592   1.332
  125   1HB   GLN  15          1HB       GLN  15   6.461  -9.545   0.761
  126   2HB   GLN  15          2HB       GLN  15   8.008  -8.747   1.148
  127   1HG   GLN  15          1HG       GLN  15   6.983  -7.944   3.302
  128   2HG   GLN  15          2HG       GLN  15   5.571  -8.958   2.949
  129   1HE2  GLN  15          2HE2      GLN  15   5.838 -10.418   4.634
  130   2HE2  GLN  15          1HE2      GLN  15   7.243 -11.468   4.823
  131    H    ALA  16           H        ALA  16   5.613  -8.846  -1.278
  132    HA   ALA  16           HA       ALA  16   6.541  -6.806  -3.194
  133   1HB   ALA  16          1HB       ALA  16   8.681  -7.657  -2.421
  134   2HB   ALA  16          2HB       ALA  16   8.194  -9.320  -2.835
  135   3HB   ALA  16          3HB       ALA  16   8.406  -8.112  -4.124
  136    H    ARG  17           H        ARG  17   5.135  -9.999  -2.638
  137    HA   ARG  17           HA       ARG  17   4.751 -10.039  -5.612
  138   1HB   ARG  17          1HB       ARG  17   5.018 -12.376  -3.698
  139   2HB   ARG  17          2HB       ARG  17   4.602 -12.529  -5.428
  140   1HG   ARG  17          1HG       ARG  17   6.771 -12.234  -6.029
  141   2HG   ARG  17          2HG       ARG  17   6.822 -10.714  -5.115
  142   1HD   ARG  17          1HD       ARG  17   7.328 -13.483  -3.961
  143   2HD   ARG  17          2HD       ARG  17   8.530 -12.217  -4.286
  144    HE   ARG  17           HE       ARG  17   6.268 -11.672  -2.418
  145   1HH1  ARG  17          1HH2      ARG  17   9.752 -12.063  -2.911
  146   2HH1  ARG  17          2HH2      ARG  17  10.163 -11.293  -1.400
  147   1HH2  ARG  17          2HH1      ARG  17   6.768 -10.644  -0.597
  148   2HH2  ARG  17          1HH1      ARG  17   8.404 -10.550   0.044
  149    HA   PRO  18           HA       PRO  18   0.440 -11.663  -4.015
  150   1HB   PRO  18          1HB       PRO  18   0.055 -11.558  -1.327
  151   2HB   PRO  18          2HB       PRO  18   0.870 -12.992  -2.060
  152   1HG   PRO  18          1HG       PRO  18   2.217 -10.463  -1.032
  153   2HG   PRO  18          2HG       PRO  18   2.576 -12.023  -0.359
  154   1HD   PRO  18          1HD       PRO  18   4.123 -11.213  -2.268
  155   2HD   PRO  18          2HD       PRO  18   3.369 -12.808  -2.593
  156    H    ALA  19           H        ALA  19   2.194  -9.347  -1.882
  157    HA   ALA  19           HA       ALA  19   0.122  -7.459  -1.547
  158   1HB   ALA  19          1HB       ALA  19   3.135  -7.197  -1.661
  159   2HB   ALA  19          2HB       ALA  19   1.992  -6.007  -0.962
  160   3HB   ALA  19          3HB       ALA  19   2.178  -7.638  -0.213
  161    H    ALA  20           H        ALA  20   2.472  -7.905  -4.150
  162    HA   ALA  20           HA       ALA  20   2.081  -5.342  -5.441
  163   1HB   ALA  20          1HB       ALA  20   2.847  -8.090  -6.538
  164   2HB   ALA  20          2HB       ALA  20   3.013  -6.542  -7.406
  165   3HB   ALA  20          3HB       ALA  20   3.997  -6.862  -5.954
  166    H    LEU  21           H        LEU  21   0.691  -8.611  -5.581
  167    HA   LEU  21           HA       LEU  21  -1.333  -8.172  -7.532
  168   1HB   LEU  21          1HB       LEU  21  -0.415 -10.267  -6.283
  169   2HB   LEU  21          2HB       LEU  21  -1.708  -9.951  -5.128
  170    HG   LEU  21           HG       LEU  21  -2.254 -10.069  -8.126
  171   1HD1  LEU  21          1HD1      LEU  21  -2.282 -12.348  -6.108
  172   2HD1  LEU  21          2HD1      LEU  21  -3.067 -12.408  -7.703
  173   3HD1  LEU  21          3HD1      LEU  21  -1.302 -12.221  -7.584
  174   1HD2  LEU  21          1HD2      LEU  21  -3.917  -8.984  -6.646
  175   2HD2  LEU  21          2HD2      LEU  21  -4.553 -10.501  -7.334
  176   3HD2  LEU  21          3HD2      LEU  21  -3.990 -10.448  -5.644
  177    H    PHE  22           H        PHE  22  -1.337  -7.812  -3.969
  178    HA   PHE  22           HA       PHE  22  -4.078  -7.045  -3.515
  179   1HB   PHE  22          1HB       PHE  22  -1.513  -5.970  -2.276
  180   2HB   PHE  22          2HB       PHE  22  -3.119  -5.868  -1.556
  181    HD1  PHE  22           HD1      PHE  22  -3.458  -8.931  -2.822
  182    HD2  PHE  22           HD2      PHE  22  -0.915  -6.892  -0.032
  183    HE1  PHE  22           HE1      PHE  22  -2.886 -11.118  -1.761
  184    HE2  PHE  22           HE2      PHE  22  -0.343  -9.053   1.051
  185    HZ   PHE  22           HZ       PHE  22  -1.303 -11.185   0.150
  186    H    VAL  23           H        VAL  23  -1.218  -4.896  -3.827
  187    HA   VAL  23           HA       VAL  23  -2.689  -2.519  -4.070
  188    HB   VAL  23           HB       VAL  23   0.063  -3.391  -4.941
  189   1HG1  VAL  23          1HG2      VAL  23  -0.644  -1.609  -6.497
  190   2HG1  VAL  23          2HG2      VAL  23  -1.078  -0.571  -5.115
  191   3HG1  VAL  23          3HG2      VAL  23   0.616  -1.052  -5.371
  192   1HG2  VAL  23          1HG1      VAL  23  -1.042  -1.535  -2.749
  193   2HG2  VAL  23          2HG1      VAL  23  -0.343  -3.154  -2.518
  194   3HG2  VAL  23          3HG1      VAL  23   0.671  -1.817  -3.076
  195    H    GLN  24           H        GLN  24  -1.605  -4.761  -6.722
  196    HA   GLN  24           HA       GLN  24  -2.743  -2.923  -8.625
  197   1HB   GLN  24          1HB       GLN  24  -2.263  -4.597 -10.364
  198   2HB   GLN  24          2HB       GLN  24  -0.906  -4.063  -9.373
  199   1HG   GLN  24          1HG       GLN  24  -0.400  -6.235  -9.479
  200   2HG   GLN  24          2HG       GLN  24  -1.400  -6.282  -8.016
  201   1HE2  GLN  24          2HE2      GLN  24  -3.290  -7.504  -8.091
  202   2HE2  GLN  24          1HE2      GLN  24  -3.824  -8.393  -9.516
  203    H    GLU  25           H        GLU  25  -4.226  -5.689  -6.939
  204    HA   GLU  25           HA       GLU  25  -6.472  -5.693  -8.813
  205   1HB   GLU  25          1HB       GLU  25  -6.213  -6.772  -5.961
  206   2HB   GLU  25          2HB       GLU  25  -7.605  -7.053  -7.037
  207   1HG   GLU  25          1HG       GLU  25  -4.768  -7.879  -7.632
  208   2HG   GLU  25          2HG       GLU  25  -6.004  -8.958  -6.952
  209    H    ALA  26           H        ALA  26  -5.773  -4.576  -5.559
  210    HA   ALA  26           HA       ALA  26  -7.987  -3.112  -4.762
  211   1HB   ALA  26          1HB       ALA  26  -5.055  -2.305  -4.724
  212   2HB   ALA  26          2HB       ALA  26  -6.321  -1.602  -3.686
  213   3HB   ALA  26          3HB       ALA  26  -5.852  -3.317  -3.498
  214    H    ASN  27           H        ASN  27  -5.250  -2.077  -6.712
  215    HA   ASN  27           HA       ASN  27  -6.016   0.413  -7.729
  216   1HB   ASN  27          1HB       ASN  27  -4.099  -1.739  -8.211
  217   2HB   ASN  27          2HB       ASN  27  -4.622  -1.015  -9.735
  218   1HD2  ASN  27          2HD2      ASN  27  -2.656  -0.671  -6.976
  219   2HD2  ASN  27          1HD2      ASN  27  -2.063   0.968  -7.222
  220    H    ARG  28           H        ARG  28  -6.550  -2.866  -9.103
  221    HA   ARG  28           HA       ARG  28  -7.636  -2.053 -11.624
  222   1HB   ARG  28          1HB       ARG  28  -8.338  -4.452  -9.878
  223   2HB   ARG  28          2HB       ARG  28  -8.820  -4.237 -11.573
  224   1HG   ARG  28          1HG       ARG  28  -6.436  -4.114 -12.256
  225   2HG   ARG  28          2HG       ARG  28  -5.949  -4.331 -10.567
  226   1HD   ARG  28          1HD       ARG  28  -7.086  -6.557 -10.534
  227   2HD   ARG  28          2HD       ARG  28  -7.512  -6.354 -12.239
  228    HE   ARG  28           HE       ARG  28  -4.932  -7.092 -11.145
  229   1HH1  ARG  28          2HH1      ARG  28  -6.565  -5.517 -13.829
  230   2HH1  ARG  28          1HH1      ARG  28  -5.292  -5.806 -14.988
  231   1HH2  ARG  28          1HH2      ARG  28  -3.148  -7.292 -12.559
  232   2HH2  ARG  28          2HH2      ARG  28  -3.296  -6.862 -14.245
  233    H    PHE  29           H        PHE  29  -9.159  -2.776  -8.481
  234    HA   PHE  29           HA       PHE  29 -11.776  -2.022  -9.456
  235   1HB   PHE  29          1HB       PHE  29 -10.660  -2.420  -6.669
  236   2HB   PHE  29          2HB       PHE  29 -12.351  -2.004  -7.019
  237    HD1  PHE  29           HD1      PHE  29 -11.219  -4.609  -5.713
  238    HD2  PHE  29           HD2      PHE  29 -12.381  -3.625  -9.728
  239    HE1  PHE  29           HE1      PHE  29 -11.861  -6.988  -6.116
  240    HE2  PHE  29           HE2      PHE  29 -12.990  -5.984 -10.146
  241    HZ   PHE  29           HZ       PHE  29 -12.695  -7.680  -8.346
  242    H    THR  30           H        THR  30 -12.717  -0.217  -9.516
  243    HA   THR  30           HA       THR  30 -11.023   2.166  -9.547
  244    HB   THR  30           HB       THR  30 -13.952   1.676 -10.190
  245    HG1  THR  30           HG1      THR  30 -11.889   0.826 -11.427
  246   1HG2  THR  30          1HG2      THR  30 -13.811   3.800 -11.396
  247   2HG2  THR  30          2HG2      THR  30 -13.501   4.020  -9.646
  248   3HG2  THR  30          3HG2      THR  30 -12.132   4.019 -10.791
  249    H    SER  31           H        SER  31 -10.866   1.545  -7.062
  250    HA   SER  31           HA       SER  31 -12.751   3.176  -5.475
  251   1HB   SER  31          1HB       SER  31 -11.106   0.717  -4.756
  252   2HB   SER  31          2HB       SER  31 -12.282   1.526  -3.694
  253    HG   SER  31           HG       SER  31 -13.068  -0.415  -4.882
  254    H    ASP  32           H        ASP  32 -11.847   4.590  -3.991
  255    HA   ASP  32           HA       ASP  32  -8.968   5.092  -4.158
  256   1HB   ASP  32          1HB       ASP  32 -10.507   6.944  -3.888
  257   2HB   ASP  32          2HB       ASP  32 -11.245   6.164  -2.468
  258    H    VAL  33           H        VAL  33  -8.006   3.300  -3.534
  259    HA   VAL  33           HA       VAL  33  -8.996   1.663  -1.338
  260    HB   VAL  33           HB       VAL  33  -6.766   1.324  -3.360
  261   1HG1  VAL  33          1HG1      VAL  33  -6.428   0.105  -1.186
  262   2HG1  VAL  33          2HG1      VAL  33  -7.968  -0.738  -1.477
  263   3HG1  VAL  33          3HG1      VAL  33  -6.604  -0.973  -2.606
  264   1HG2  VAL  33          1HG2      VAL  33  -9.119   1.412  -4.201
  265   2HG2  VAL  33          2HG2      VAL  33  -8.405  -0.203  -4.406
  266   3HG2  VAL  33          3HG2      VAL  33  -9.562   0.104  -3.085
  267    H    PHE  34           H        PHE  34  -7.905   1.019   0.463
  268    HA   PHE  34           HA       PHE  34  -5.576   2.624   1.330
  269   1HB   PHE  34          1HB       PHE  34  -8.274   2.508   2.721
  270   2HB   PHE  34          2HB       PHE  34  -6.820   3.124   3.465
  271    HD1  PHE  34           HD1      PHE  34  -9.695   3.952   1.554
  272    HD2  PHE  34           HD2      PHE  34  -5.538   4.975   1.937
  273    HE1  PHE  34           HE1      PHE  34 -10.155   6.191   0.603
  274    HE2  PHE  34           HE2      PHE  34  -6.036   7.293   1.142
  275    HZ   PHE  34           HZ       PHE  34  -8.386   7.928   0.610
  276    H    LEU  35           H        LEU  35  -4.871   2.032   3.537
  277    HA   LEU  35           HA       LEU  35  -5.705  -0.579   4.565
  278   1HB   LEU  35          1HB       LEU  35  -3.962  -1.089   2.904
  279   2HB   LEU  35          2HB       LEU  35  -2.820  -0.010   3.751
  280    HG   LEU  35           HG       LEU  35  -4.231  -2.043   5.426
  281   1HD1  LEU  35          1HD2      LEU  35  -2.118  -2.802   3.365
  282   2HD1  LEU  35          2HD2      LEU  35  -2.673  -3.834   4.709
  283   3HD1  LEU  35          3HD2      LEU  35  -3.805  -3.362   3.421
  284   1HD2  LEU  35          1HD1      LEU  35  -1.333  -1.116   5.134
  285   2HD2  LEU  35          2HD1      LEU  35  -2.508  -0.508   6.326
  286   3HD2  LEU  35          3HD1      LEU  35  -1.956  -2.197   6.403
  287    H    GLU  36           H        GLU  36  -5.869  -0.390   6.653
  288    HA   GLU  36           HA       GLU  36  -4.752   2.039   7.998
  289   1HB   GLU  36          1HB       GLU  36  -7.214   0.433   8.712
  290   2HB   GLU  36          2HB       GLU  36  -6.859   2.121   9.165
  291   1HG   GLU  36          1HG       GLU  36  -7.140   2.822   6.853
  292   2HG   GLU  36          2HG       GLU  36  -7.368   1.154   6.337
  293    H    LYS  37           H        LYS  37  -2.918   1.094   9.038
  294    HA   LYS  37           HA       LYS  37  -2.839  -1.454  10.367
  295   1HB   LYS  37          1HB       LYS  37  -1.233   1.123  10.593
  296   2HB   LYS  37          2HB       LYS  37  -0.858  -0.344  11.509
  297   1HG   LYS  37          1HG       LYS  37  -0.531  -1.650   9.523
  298   2HG   LYS  37          2HG       LYS  37  -0.879  -0.232   8.519
  299   1HD   LYS  37          1HD       LYS  37   1.617  -0.645   8.925
  300   2HD   LYS  37          2HD       LYS  37   1.074   0.944   9.531
  301   1HE   LYS  37          1HE       LYS  37   0.776  -0.024  11.789
  302   2HE   LYS  37          2HE       LYS  37   1.316  -1.607  11.179
  303   1HZ   LYS  37          1HZ       LYS  37   2.945   0.834  11.175
  304   2HZ   LYS  37          2HZ       LYS  37   3.066  -0.402  12.259
  305   3HZ   LYS  37          3HZ       LYS  37   3.404  -0.669  10.661
  306    H    ASP  38           H        ASP  38  -4.712  -1.626  11.658
  307    HA   ASP  38           HA       ASP  38  -6.103  -1.247  13.428
  308   1HB   ASP  38          1HB       ASP  38  -3.455  -0.363  14.635
  309   2HB   ASP  38          2HB       ASP  38  -4.954  -0.614  15.556
  310    H    GLY  39           H        GLY  39  -5.788   0.859  11.429
  311   1HA   GLY  39          1HA       GLY  39  -7.229   2.905  11.699
  312   2HA   GLY  39          2HA       GLY  39  -6.288   3.211  13.179
  313    H    LYS  40           H        LYS  40  -3.702   2.287  11.694
  314    HA   LYS  40           HA       LYS  40  -2.994   4.914  10.719
  315   1HB   LYS  40          1HB       LYS  40  -1.455   2.348  10.319
  316   2HB   LYS  40          2HB       LYS  40  -0.810   3.992  10.420
  317   1HG   LYS  40          1HG       LYS  40  -1.884   2.251  12.698
  318   2HG   LYS  40          2HG       LYS  40  -0.217   2.750  12.391
  319   1HD   LYS  40          1HD       LYS  40  -0.785   4.256  14.042
  320   2HD   LYS  40          2HD       LYS  40  -1.179   5.205  12.598
  321   1HE   LYS  40          1HE       LYS  40  -3.025   5.280  14.275
  322   2HE   LYS  40          2HE       LYS  40  -3.537   4.451  12.785
  323   1HZ   LYS  40          1HZ       LYS  40  -3.132   2.363  13.880
  324   2HZ   LYS  40          2HZ       LYS  40  -2.666   3.133  15.263
  325   3HZ   LYS  40          3HZ       LYS  40  -4.221   3.248  14.733
  326    H    LYS  41           H        LYS  41  -4.657   5.051   9.017
  327    HA   LYS  41           HA       LYS  41  -4.359   3.174   6.778
  328   1HB   LYS  41          1HB       LYS  41  -6.507   3.459   7.548
  329   2HB   LYS  41          2HB       LYS  41  -6.341   5.195   7.696
  330   1HG   LYS  41          1HG       LYS  41  -6.261   3.957   4.928
  331   2HG   LYS  41          2HG       LYS  41  -7.799   4.230   5.771
  332   1HD   LYS  41          1HD       LYS  41  -6.932   6.602   6.305
  333   2HD   LYS  41          2HD       LYS  41  -5.698   6.309   5.072
  334   1HE   LYS  41          1HE       LYS  41  -7.640   7.490   4.117
  335   2HE   LYS  41          2HE       LYS  41  -7.469   5.879   3.400
  336   1HZ   LYS  41          1HZ       LYS  41  -9.158   5.101   4.895
  337   2HZ   LYS  41          2HZ       LYS  41  -9.368   6.608   5.525
  338   3HZ   LYS  41          3HZ       LYS  41  -9.717   6.314   3.938
  339    H    VAL  42           H        VAL  42  -3.788   3.487   4.847
  340    HA   VAL  42           HA       VAL  42  -3.169   6.133   3.642
  341    HB   VAL  42           HB       VAL  42  -1.070   5.018   2.690
  342   1HG1  VAL  42          1HG1      VAL  42  -0.879   6.694   4.485
  343   2HG1  VAL  42          2HG1      VAL  42  -1.066   5.397   5.697
  344   3HG1  VAL  42          3HG1      VAL  42   0.357   5.422   4.624
  345   1HG2  VAL  42          1HG2      VAL  42  -1.763   2.697   3.255
  346   2HG2  VAL  42          2HG2      VAL  42  -0.149   3.098   3.900
  347   3HG2  VAL  42          3HG2      VAL  42  -1.565   3.087   4.984
  348    H    ASN  43           H        ASN  43  -2.725   5.884   1.245
  349    HA   ASN  43           HA       ASN  43  -4.740   4.300  -0.001
  350   1HB   ASN  43          1HB       ASN  43  -2.436   6.031  -0.888
  351   2HB   ASN  43          2HB       ASN  43  -3.207   4.944  -2.060
  352   1HD2  ASN  43          2HD2      ASN  43  -5.845   4.905  -1.459
  353   2HD2  ASN  43          1HD2      ASN  43  -6.506   6.517  -1.547
  354    H    ALA  44           H        ALA  44  -4.747   2.401   0.188
  355    HA   ALA  44           HA       ALA  44  -2.904   0.431   0.734
  356   1HB   ALA  44          1HB       ALA  44  -5.343   0.306  -1.090
  357   2HB   ALA  44          2HB       ALA  44  -4.618  -1.108  -0.303
  358   3HB   ALA  44          3HB       ALA  44  -5.390   0.163   0.673
  359    H    LYS  45           H        LYS  45  -3.948   1.629  -2.392
  360    HA   LYS  45           HA       LYS  45  -2.373  -0.312  -3.952
  361   1HB   LYS  45          1HB       LYS  45  -3.400   1.016  -5.859
  362   2HB   LYS  45          2HB       LYS  45  -4.565   0.177  -4.806
  363   1HG   LYS  45          1HG       LYS  45  -5.025   2.252  -3.594
  364   2HG   LYS  45          2HG       LYS  45  -3.745   3.111  -4.489
  365   1HD   LYS  45          1HD       LYS  45  -5.918   3.565  -5.428
  366   2HD   LYS  45          2HD       LYS  45  -4.934   2.654  -6.606
  367   1HE   LYS  45          1HE       LYS  45  -5.982   0.530  -5.891
  368   2HE   LYS  45          2HE       LYS  45  -7.000   1.403  -4.729
  369   1HZ   LYS  45          1HZ       LYS  45  -7.067   1.846  -7.641
  370   2HZ   LYS  45          2HZ       LYS  45  -8.105   0.879  -6.801
  371   3HZ   LYS  45          3HZ       LYS  45  -8.067   2.495  -6.495
  372    H    SER  46           H        SER  46  -1.710   2.603  -2.417
  373    HA   SER  46           HA       SER  46   0.191   3.505  -4.483
  374   1HB   SER  46          1HB       SER  46  -0.657   4.764  -1.840
  375   2HB   SER  46          2HB       SER  46   0.305   5.547  -3.111
  376    HG   SER  46           HG       SER  46  -1.545   5.314  -4.492
  377    H    ILE  47           H        ILE  47   2.299   3.844  -3.954
  378    HA   ILE  47           HA       ILE  47   3.965   2.200  -2.801
  379    HB   ILE  47           HB       ILE  47   4.515   4.245  -4.028
  380   1HG1  ILE  47          1HG1      ILE  47   6.298   2.978  -2.797
  381   2HG1  ILE  47          2HG1      ILE  47   6.653   4.692  -3.112
  382   1HG2  ILE  47          1HG2      ILE  47   3.100   5.824  -2.717
  383   2HG2  ILE  47          2HG2      ILE  47   4.252   5.696  -1.371
  384   3HG2  ILE  47          3HG2      ILE  47   4.774   6.406  -2.913
  385   1HD1  ILE  47          1HD1      ILE  47   5.908   5.254  -0.796
  386   2HD1  ILE  47          2HD1      ILE  47   5.715   3.519  -0.469
  387   3HD1  ILE  47          3HD1      ILE  47   7.323   4.181  -0.841
  388    H    MET  48           H        MET  48   2.806   4.964  -0.757
  389    HA   MET  48           HA       MET  48   4.014   3.836   1.586
  390   1HB   MET  48          1HB       MET  48   3.706   6.231   1.353
  391   2HB   MET  48          2HB       MET  48   1.956   6.030   1.130
  392   1HG   MET  48          1HG       MET  48   1.850   5.019   3.439
  393   2HG   MET  48          2HG       MET  48   3.586   5.323   3.609
  394   1HE   MET  48          1HE       MET  48   3.813   8.033   2.087
  395   2HE   MET  48          2HE       MET  48   3.729   9.218   3.418
  396   3HE   MET  48          3HE       MET  48   4.660   7.709   3.620
  397    H    GLY  49           H        GLY  49   0.902   3.343   0.041
  398   1HA   GLY  49          1HA       GLY  49  -0.449   2.365   2.409
  399   2HA   GLY  49          2HA       GLY  49  -0.951   2.157   0.705
  400    H    LEU  50           H        LEU  50   1.014   0.787  -0.532
  401    HA   LEU  50           HA       LEU  50   0.835  -1.818   0.578
  402   1HB   LEU  50          1HB       LEU  50   0.977  -0.993  -1.863
  403   2HB   LEU  50          2HB       LEU  50   2.716  -0.779  -1.578
  404    HG   LEU  50           HG       LEU  50   1.143  -3.382  -1.474
  405   1HD1  LEU  50          1HD1      LEU  50   1.700  -2.442  -3.730
  406   2HD1  LEU  50          2HD1      LEU  50   3.412  -2.390  -3.256
  407   3HD1  LEU  50          3HD1      LEU  50   2.572  -3.963  -3.389
  408   1HD2  LEU  50          1HD2      LEU  50   2.968  -3.334   0.213
  409   2HD2  LEU  50          2HD2      LEU  50   3.301  -4.473  -1.127
  410   3HD2  LEU  50          3HD2      LEU  50   4.112  -2.881  -1.068
  411    H    MET  51           H        MET  51   3.705   0.231  -0.156
  412    HA   MET  51           HA       MET  51   5.458  -1.687   1.070
  413   1HB   MET  51          1HB       MET  51   5.954  -0.405  -0.967
  414   2HB   MET  51          2HB       MET  51   5.970   1.108  -0.048
  415   1HG   MET  51          1HG       MET  51   7.823  -1.205   0.605
  416   2HG   MET  51          2HG       MET  51   8.202  -0.016  -0.645
  417   1HE   MET  51          1HE       MET  51   8.262   2.609  -0.216
  418   2HE   MET  51          2HE       MET  51   6.785   2.550   0.778
  419   3HE   MET  51          3HE       MET  51   8.258   3.334   1.412
  420    H    SER  52           H        SER  52   4.097   1.506   2.055
  421    HA   SER  52           HA       SER  52   5.959   1.520   4.301
  422   1HB   SER  52          1HB       SER  52   3.583   3.335   3.825
  423   2HB   SER  52          2HB       SER  52   4.961   3.627   4.918
  424    HG   SER  52           HG       SER  52   6.253   3.317   2.876
  425    H    LEU  53           H        LEU  53   2.348   1.714   4.372
  426    HA   LEU  53           HA       LEU  53   2.463   0.759   7.124
  427   1HB   LEU  53          1HB       LEU  53   0.190   1.581   5.293
  428   2HB   LEU  53          2HB       LEU  53  -0.012   1.065   6.983
  429    HG   LEU  53           HG       LEU  53   1.540   2.873   7.720
  430   1HD1  LEU  53          1HD2      LEU  53   1.311   3.843   4.839
  431   2HD1  LEU  53          2HD2      LEU  53   2.050   4.735   6.190
  432   3HD1  LEU  53          3HD2      LEU  53   2.795   3.227   5.607
  433   1HD2  LEU  53          1HD1      LEU  53  -0.921   3.101   7.648
  434   2HD2  LEU  53          2HD1      LEU  53  -0.100   4.662   7.353
  435   3HD2  LEU  53          3HD1      LEU  53  -0.797   3.744   5.993
  436    H    ALA  54           H        ALA  54   0.925  -0.439   4.125
  437    HA   ALA  54           HA       ALA  54  -0.139  -2.820   5.138
  438   1HB   ALA  54          1HB       ALA  54  -0.647  -1.745   2.904
  439   2HB   ALA  54          2HB       ALA  54   0.917  -2.322   2.325
  440   3HB   ALA  54          3HB       ALA  54  -0.328  -3.487   2.800
  441    H    VAL  55           H        VAL  55   3.187  -2.053   4.210
  442    HA   VAL  55           HA       VAL  55   4.157  -4.675   4.154
  443    HB   VAL  55           HB       VAL  55   5.253  -2.395   3.519
  444   1HG1  VAL  55          1HG2      VAL  55   5.204  -1.517   5.872
  445   2HG1  VAL  55          2HG2      VAL  55   6.336  -2.810   6.345
  446   3HG1  VAL  55          3HG2      VAL  55   6.841  -1.554   5.184
  447   1HG2  VAL  55          1HG1      VAL  55   6.228  -4.656   3.172
  448   2HG2  VAL  55          2HG1      VAL  55   7.456  -3.428   3.570
  449   3HG2  VAL  55          3HG1      VAL  55   6.918  -4.587   4.811
  450    H    SER  56           H        SER  56   2.833  -3.160   6.914
  451    HA   SER  56           HA       SER  56   4.711  -4.253   8.790
  452   1HB   SER  56          1HB       SER  56   1.871  -3.309   9.260
  453   2HB   SER  56          2HB       SER  56   3.140  -3.473  10.479
  454    HG   SER  56           HG       SER  56   3.096  -1.706   8.237
  455    H    THR  57           H        THR  57   4.509  -6.496   7.525
  456    HA   THR  57           HA       THR  57   2.648  -8.415   7.815
  457    HB   THR  57           HB       THR  57   5.512  -8.746   8.749
  458    HG1  THR  57           HG1      THR  57   4.720  -9.133   6.077
  459   1HG2  THR  57          1HG2      THR  57   5.204 -10.991   7.630
  460   2HG2  THR  57          2HG2      THR  57   4.175 -10.745   9.066
  461   3HG2  THR  57          3HG2      THR  57   3.474 -10.601   7.438
  462    H    GLY  58           H        GLY  58   1.385  -9.204   9.404
  463   1HA   GLY  58          1HA       GLY  58   0.888 -10.034  11.547
  464   2HA   GLY  58          2HA       GLY  58   2.373  -9.298  12.167
  465    H    THR  59           H        THR  59   0.829  -6.784  10.479
  466    HA   THR  59           HA       THR  59  -0.337  -5.890  13.057
  467    HB   THR  59           HB       THR  59  -0.079  -4.276  10.485
  468    HG1  THR  59           HG1      THR  59   1.950  -5.117  11.192
  469   1HG2  THR  59          1HG2      THR  59  -0.018  -2.370  12.057
  470   2HG2  THR  59          2HG2      THR  59  -1.529  -3.294  12.218
  471   3HG2  THR  59          3HG2      THR  59  -0.232  -3.484  13.422
  472    H    GLU  60           H        GLU  60  -2.637  -5.277  13.163
  473    HA   GLU  60           HA       GLU  60  -4.166  -6.606  11.018
  474   1HB   GLU  60          1HB       GLU  60  -5.469  -5.185  13.321
  475   2HB   GLU  60          2HB       GLU  60  -5.977  -6.647  12.423
  476   1HG   GLU  60          1HG       GLU  60  -3.677  -6.487  14.424
  477   2HG   GLU  60          2HG       GLU  60  -5.272  -7.174  14.739
  478    H    VAL  61           H        VAL  61  -4.048  -5.305   9.294
  479    HA   VAL  61           HA       VAL  61  -4.814  -2.454   9.691
  480    HB   VAL  61           HB       VAL  61  -3.413  -1.905   7.770
  481   1HG1  VAL  61          1HG1      VAL  61  -2.031  -3.899   9.639
  482   2HG1  VAL  61          2HG1      VAL  61  -1.198  -2.667   8.660
  483   3HG1  VAL  61          3HG1      VAL  61  -2.263  -2.178  10.003
  484   1HG2  VAL  61          1HG2      VAL  61  -2.765  -4.872   7.722
  485   2HG2  VAL  61          2HG2      VAL  61  -3.733  -4.004   6.481
  486   3HG2  VAL  61          3HG2      VAL  61  -2.004  -3.603   6.734
  487    H    THR  62           H        THR  62  -6.561  -1.717   8.657
  488    HA   THR  62           HA       THR  62  -8.185  -3.753   7.271
  489    HB   THR  62           HB       THR  62  -8.854  -0.851   7.891
  490    HG1  THR  62           HG1      THR  62  -8.565  -2.231   9.776
  491   1HG2  THR  62          1HG2      THR  62 -10.618  -3.247   7.207
  492   2HG2  THR  62          2HG2      THR  62 -11.159  -1.572   7.434
  493   3HG2  THR  62          3HG2      THR  62 -10.156  -1.993   6.036
  494    H    LEU  63           H        LEU  63  -8.394  -4.035   5.124
  495    HA   LEU  63           HA       LEU  63  -7.049  -2.156   3.311
  496   1HB   LEU  63          1HB       LEU  63  -6.821  -4.703   3.315
  497   2HB   LEU  63          2HB       LEU  63  -8.484  -4.768   2.706
  498    HG   LEU  63           HG       LEU  63  -6.755  -4.916   0.957
  499   1HD1  LEU  63          1HD2      LEU  63  -8.964  -3.958   0.377
  500   2HD1  LEU  63          2HD2      LEU  63  -8.358  -2.331   0.780
  501   3HD1  LEU  63          3HD2      LEU  63  -7.657  -3.227  -0.585
  502   1HD2  LEU  63          1HD1      LEU  63  -5.068  -3.460   2.075
  503   2HD2  LEU  63          2HD1      LEU  63  -5.369  -2.980   0.389
  504   3HD2  LEU  63          3HD1      LEU  63  -6.087  -2.044   1.718
  505    H    ILE  64           H        ILE  64  -8.190  -0.589   2.482
  506    HA   ILE  64           HA       ILE  64 -11.166  -0.595   2.502
  507    HB   ILE  64           HB       ILE  64  -9.249   1.717   2.045
  508   1HG1  ILE  64          1HG1      ILE  64 -10.442   0.831   4.680
  509   2HG1  ILE  64          2HG1      ILE  64  -8.721   0.971   4.259
  510   1HG2  ILE  64          1HG2      ILE  64 -12.180   1.581   2.840
  511   2HG2  ILE  64          2HG2      ILE  64 -11.228   3.075   2.653
  512   3HG2  ILE  64          3HG2      ILE  64 -11.531   2.033   1.244
  513   1HD1  ILE  64          1HD1      ILE  64 -10.745   3.252   4.254
  514   2HD1  ILE  64          2HD1      ILE  64  -9.598   2.926   5.581
  515   3HD1  ILE  64          3HD1      ILE  64  -8.997   3.408   3.968
  516    H    ALA  65           H        ALA  65 -12.274  -0.111   0.625
  517    HA   ALA  65           HA       ALA  65 -10.777   0.778  -1.733
  518   1HB   ALA  65          1HB       ALA  65 -12.774  -1.520  -1.840
  519   2HB   ALA  65          2HB       ALA  65 -12.031  -0.717  -3.244
  520   3HB   ALA  65          3HB       ALA  65 -11.020  -1.661  -2.133
  521    H    GLN  66           H        GLN  66 -11.651   2.760  -1.869
  522    HA   GLN  66           HA       GLN  66 -14.574   2.877  -1.412
  523   1HB   GLN  66          1HB       GLN  66 -14.171   4.703  -0.086
  524   2HB   GLN  66          2HB       GLN  66 -12.604   3.940  -0.009
  525   1HG   GLN  66          1HG       GLN  66 -11.630   5.787  -0.666
  526   2HG   GLN  66          2HG       GLN  66 -12.391   5.554  -2.260
  527   1HE2  GLN  66          2HE2      GLN  66 -12.736   7.139   0.922
  528   2HE2  GLN  66          1HE2      GLN  66 -13.851   8.373   0.359
  529    H    GLY  67           H        GLY  67 -14.614   2.010  -3.619
  530   1HA   GLY  67          1HA       GLY  67 -14.741   4.229  -5.588
  531   2HA   GLY  67          2HA       GLY  67 -13.756   2.824  -5.913
  532    H    GLU  68           H        GLU  68 -15.081   2.755  -7.764
  533    HA   GLU  68           HA       GLU  68 -17.737   1.903  -7.950
  534   1HB   GLU  68          1HB       GLU  68 -15.315   0.985  -9.566
  535   2HB   GLU  68          2HB       GLU  68 -17.014   0.893 -10.069
  536   1HG   GLU  68          1HG       GLU  68 -15.440   3.450  -9.551
  537   2HG   GLU  68          2HG       GLU  68 -15.984   2.825 -11.125
  538    H    ASP  69           H        ASP  69 -14.731   0.015  -7.027
  539    HA   ASP  69           HA       ASP  69 -16.632  -2.245  -6.613
  540   1HB   ASP  69          1HB       ASP  69 -13.675  -2.636  -6.879
  541   2HB   ASP  69          2HB       ASP  69 -14.970  -3.812  -7.051
  542    H    GLU  70           H        GLU  70 -16.622  -0.179  -4.756
  543    HA   GLU  70           HA       GLU  70 -14.454  -0.271  -3.012
  544   1HB   GLU  70          1HB       GLU  70 -16.030   0.675  -1.352
  545   2HB   GLU  70          2HB       GLU  70 -16.033   1.482  -2.920
  546   1HG   GLU  70          1HG       GLU  70 -18.204   1.391  -2.902
  547   2HG   GLU  70          2HG       GLU  70 -18.063  -0.337  -3.267
  548    H    GLN  71           H        GLN  71 -17.568  -1.853  -2.128
  549    HA   GLN  71           HA       GLN  71 -16.595  -3.510  -0.162
  550   1HB   GLN  71          1HB       GLN  71 -18.836  -3.689  -2.178
  551   2HB   GLN  71          2HB       GLN  71 -18.429  -5.141  -1.236
  552   1HG   GLN  71          1HG       GLN  71 -19.186  -2.450  -0.050
  553   2HG   GLN  71          2HG       GLN  71 -20.194  -3.909  -0.116
  554   1HE2  GLN  71          2HE2      GLN  71 -17.534  -5.539   0.361
  555   2HE2  GLN  71          1HE2      GLN  71 -17.349  -5.390   2.102
  556    H    GLU  72           H        GLU  72 -16.705  -4.173  -3.649
  557    HA   GLU  72           HA       GLU  72 -15.963  -6.881  -3.523
  558   1HB   GLU  72          1HB       GLU  72 -16.936  -5.924  -5.544
  559   2HB   GLU  72          2HB       GLU  72 -15.750  -4.609  -5.535
  560   1HG   GLU  72          1HG       GLU  72 -15.272  -6.066  -7.367
  561   2HG   GLU  72          2HG       GLU  72 -13.962  -6.146  -6.194
  562    H    ALA  73           H        ALA  73 -14.023  -3.894  -4.057
  563    HA   ALA  73           HA       ALA  73 -11.532  -5.203  -4.452
  564   1HB   ALA  73          1HB       ALA  73 -12.238  -2.963  -5.197
  565   2HB   ALA  73          2HB       ALA  73 -12.422  -2.471  -3.516
  566   3HB   ALA  73          3HB       ALA  73 -10.777  -2.821  -4.155
  567    H    LEU  74           H        LEU  74 -12.924  -3.466  -1.659
  568    HA   LEU  74           HA       LEU  74 -10.718  -3.879   0.075
  569   1HB   LEU  74          1HB       LEU  74 -12.298  -3.147   1.810
  570   2HB   LEU  74          2HB       LEU  74 -12.411  -2.214   0.289
  571    HG   LEU  74           HG       LEU  74 -14.242  -3.948  -0.364
  572   1HD1  LEU  74          1HD1      LEU  74 -14.049  -5.286   1.743
  573   2HD1  LEU  74          2HD1      LEU  74 -14.587  -3.849   2.658
  574   3HD1  LEU  74          3HD1      LEU  74 -15.673  -4.605   1.465
  575   1HD2  LEU  74          1HD2      LEU  74 -14.439  -1.523  -0.221
  576   2HD2  LEU  74          2HD2      LEU  74 -15.890  -2.312   0.416
  577   3HD2  LEU  74          3HD2      LEU  74 -14.686  -1.627   1.537
  578    H    GLU  75           H        GLU  75 -13.674  -5.891  -0.442
  579    HA   GLU  75           HA       GLU  75 -12.976  -7.816   1.525
  580   1HB   GLU  75          1HB       GLU  75 -14.536  -8.095  -1.097
  581   2HB   GLU  75          2HB       GLU  75 -14.493  -9.327   0.179
  582   1HG   GLU  75          1HG       GLU  75 -15.509  -7.769   1.776
  583   2HG   GLU  75          2HG       GLU  75 -15.497  -6.487   0.536
  584    H    LYS  76           H        LYS  76 -12.506  -8.105  -2.078
  585    HA   LYS  76           HA       LYS  76 -11.069 -10.556  -1.660
  586   1HB   LYS  76          1HB       LYS  76 -10.213 -10.141  -4.049
  587   2HB   LYS  76          2HB       LYS  76 -11.935 -10.446  -3.755
  588   1HG   LYS  76          1HG       LYS  76 -11.900  -8.749  -5.361
  589   2HG   LYS  76          2HG       LYS  76 -12.328  -7.983  -3.832
  590   1HD   LYS  76          1HD       LYS  76 -10.777  -6.482  -4.669
  591   2HD   LYS  76          2HD       LYS  76  -9.756  -7.479  -3.629
  592   1HE   LYS  76          1HE       LYS  76 -10.090  -7.683  -6.669
  593   2HE   LYS  76          2HE       LYS  76  -8.677  -7.065  -5.797
  594   1HZ   LYS  76          1HZ       LYS  76  -8.406  -9.250  -4.840
  595   2HZ   LYS  76          2HZ       LYS  76  -9.692  -9.812  -5.704
  596   3HZ   LYS  76          3HZ       LYS  76  -8.332  -9.310  -6.490
  597    H    LEU  77           H        LEU  77  -9.886  -7.199  -1.875
  598    HA   LEU  77           HA       LEU  77  -7.153  -7.912  -1.994
  599   1HB   LEU  77          1HB       LEU  77  -8.847  -5.684  -2.090
  600   2HB   LEU  77          2HB       LEU  77  -7.680  -5.331  -0.787
  601    HG   LEU  77           HG       LEU  77  -7.115  -4.665  -3.256
  602   1HD1  LEU  77          1HD1      LEU  77  -5.692  -4.768  -1.295
  603   2HD1  LEU  77          2HD1      LEU  77  -5.383  -6.508  -1.618
  604   3HD1  LEU  77          3HD1      LEU  77  -4.827  -5.261  -2.794
  605   1HD2  LEU  77          1HD2      LEU  77  -6.646  -7.687  -3.275
  606   2HD2  LEU  77          2HD2      LEU  77  -7.823  -6.831  -4.296
  607   3HD2  LEU  77          3HD2      LEU  77  -6.073  -6.568  -4.532
  608    H    ALA  78           H        ALA  78  -9.154  -6.723   0.869
  609    HA   ALA  78           HA       ALA  78  -6.955  -7.126   2.661
  610   1HB   ALA  78          1HB       ALA  78  -9.944  -7.093   3.240
  611   2HB   ALA  78          2HB       ALA  78  -8.653  -6.974   4.448
  612   3HB   ALA  78          3HB       ALA  78  -8.858  -5.680   3.262
  613    H    ALA  79           H        ALA  79  -9.550  -9.300   1.478
  614    HA   ALA  79           HA       ALA  79  -9.076 -11.413   3.333
  615   1HB   ALA  79          1HB       ALA  79 -10.946 -11.254   1.711
  616   2HB   ALA  79          2HB       ALA  79  -9.749 -11.459   0.384
  617   3HB   ALA  79          3HB       ALA  79 -10.051 -12.796   1.541
  618    H    TYR  80           H        TYR  80  -7.689 -10.688   0.063
  619    HA   TYR  80           HA       TYR  80  -6.059 -12.991  -0.038
  620   1HB   TYR  80          1HB       TYR  80  -6.974 -11.535  -1.805
  621   2HB   TYR  80          2HB       TYR  80  -5.770 -10.312  -1.404
  622    HD1  TYR  80           HD1      TYR  80  -4.868 -10.350  -3.697
  623    HD2  TYR  80           HD2      TYR  80  -4.765 -13.838  -1.177
  624    HE1  TYR  80           HE1      TYR  80  -2.952 -11.247  -5.004
  625    HE2  TYR  80           HE2      TYR  80  -2.874 -14.742  -2.500
  626    HH   TYR  80           HH       TYR  80  -1.467 -14.399  -4.267
  627    H    VAL  81           H        VAL  81  -5.430  -9.732   1.302
  628    HA   VAL  81           HA       VAL  81  -2.595 -10.002   1.311
  629    HB   VAL  81           HB       VAL  81  -2.635  -8.050   2.793
  630   1HG1  VAL  81          1HG1      VAL  81  -3.199  -7.804   0.369
  631   2HG1  VAL  81          2HG1      VAL  81  -4.908  -8.007   0.772
  632   3HG1  VAL  81          3HG1      VAL  81  -4.024  -6.578   1.378
  633   1HG2  VAL  81          1HG2      VAL  81  -5.596  -8.739   2.971
  634   2HG2  VAL  81          2HG2      VAL  81  -4.437  -8.809   4.309
  635   3HG2  VAL  81          3HG2      VAL  81  -4.882  -7.234   3.602
  636    H    GLN  82           H        GLN  82  -5.041 -11.154   3.545
  637    HA   GLN  82           HA       GLN  82  -2.917 -11.840   5.482
  638   1HB   GLN  82          1HB       GLN  82  -4.751 -11.454   7.059
  639   2HB   GLN  82          2HB       GLN  82  -4.747 -10.171   5.852
  640   1HG   GLN  82          1HG       GLN  82  -6.580 -11.413   4.649
  641   2HG   GLN  82          2HG       GLN  82  -6.457 -12.704   5.844
  642   1HE2  GLN  82          2HE2      GLN  82  -8.078 -10.002   5.018
  643   2HE2  GLN  82          1HE2      GLN  82  -8.614  -9.441   6.601
  644    H    GLU  83           H        GLU  83  -5.489 -13.277   3.504
  645    HA   GLU  83           HA       GLU  83  -6.201 -15.337   5.252
  646   1HB   GLU  83          1HB       GLU  83  -7.424 -16.274   3.358
  647   2HB   GLU  83          2HB       GLU  83  -7.584 -14.491   3.484
  648   1HG   GLU  83          1HG       GLU  83  -5.937 -14.173   1.733
  649   2HG   GLU  83          2HG       GLU  83  -5.681 -15.922   1.593
  650    H    GLU  84           H        GLU  84  -3.999 -15.899   2.351
  651    HA   GLU  84           HA       GLU  84  -3.513 -18.546   3.559
  652   1HB   GLU  84          1HB       GLU  84  -2.180 -18.945   1.524
  653   2HB   GLU  84          2HB       GLU  84  -3.838 -18.473   1.128
  654   1HG   GLU  84          1HG       GLU  84  -1.788 -16.251   1.270
  655   2HG   GLU  84          2HG       GLU  84  -1.704 -17.403  -0.094
  656    H    VAL  85           H        VAL  85  -0.731 -17.915   2.066
  657    HA   VAL  85           HA       VAL  85   0.673 -16.248   4.067
  658    HB   VAL  85           HB       VAL  85   2.485 -18.031   4.239
  659   1HG1  VAL  85          1HG1      VAL  85  -0.133 -18.949   5.625
  660   2HG1  VAL  85          2HG1      VAL  85   1.512 -19.488   6.046
  661   3HG1  VAL  85          3HG1      VAL  85   1.063 -17.810   6.289
  662   1HG2  VAL  85          1HG2      VAL  85   1.762 -19.566   2.356
  663   2HG2  VAL  85          2HG2      VAL  85   2.001 -20.440   3.873
  664   3HG2  VAL  85          3HG2      VAL  85   0.349 -20.076   3.310
  Start of MODEL    4
    1   1H    VAL   2          1H        VAL   2 -16.822   6.303  -2.419
    2   2H    VAL   2          2H        VAL   2 -17.350   5.097  -3.466
    3   3H    VAL   2          3H        VAL   2 -18.324   6.434  -3.163
    4    HA   VAL   2           HA       VAL   2 -18.580   5.807  -0.889
    5    HB   VAL   2           HB       VAL   2 -19.850   3.671  -1.293
    6   1HG1  VAL   2          1HG2      VAL   2 -20.849   5.897  -1.675
    7   2HG1  VAL   2          2HG2      VAL   2 -20.227   5.893  -3.343
    8   3HG1  VAL   2          3HG2      VAL   2 -21.461   4.709  -2.850
    9   1HG2  VAL   2          1HG1      VAL   2 -18.328   2.730  -3.032
   10   2HG2  VAL   2          2HG1      VAL   2 -20.017   2.822  -3.591
   11   3HG2  VAL   2          3HG1      VAL   2 -18.826   4.023  -4.146
   12    H    GLN   3           H        GLN   3 -17.696   4.798   0.899
   13    HA   GLN   3           HA       GLN   3 -15.358   3.105   0.224
   14   1HB   GLN   3          1HB       GLN   3 -14.929   5.350   1.282
   15   2HB   GLN   3          2HB       GLN   3 -15.842   4.794   2.705
   16   1HG   GLN   3          1HG       GLN   3 -14.234   2.817   2.818
   17   2HG   GLN   3          2HG       GLN   3 -13.230   3.655   1.618
   18   1HE2  GLN   3          2HE2      GLN   3 -13.728   6.369   2.642
   19   2HE2  GLN   3          1HE2      GLN   3 -12.854   6.441   4.164
   20    H    GLN   4           H        GLN   4 -14.903   1.263   1.220
   21    HA   GLN   4           HA       GLN   4 -16.229   0.459   3.681
   22   1HB   GLN   4          1HB       GLN   4 -16.140  -1.292   1.186
   23   2HB   GLN   4          2HB       GLN   4 -16.614  -1.827   2.805
   24   1HG   GLN   4          1HG       GLN   4 -18.537  -0.264   2.741
   25   2HG   GLN   4          2HG       GLN   4 -18.052   0.234   1.103
   26   1HE2  GLN   4          2HE2      GLN   4 -20.094  -0.582   0.230
   27   2HE2  GLN   4          1HE2      GLN   4 -20.359  -2.306   0.083
   28    H    LYS   5           H        LYS   5 -14.807  -1.318   4.675
   29    HA   LYS   5           HA       LYS   5 -12.300  -1.890   3.349
   30   1HB   LYS   5          1HB       LYS   5 -11.030  -0.931   5.348
   31   2HB   LYS   5          2HB       LYS   5 -11.714   0.222   4.189
   32   1HG   LYS   5          1HG       LYS   5 -13.786   0.297   5.728
   33   2HG   LYS   5          2HG       LYS   5 -12.731  -0.434   6.958
   34   1HD   LYS   5          1HD       LYS   5 -11.077   1.454   6.480
   35   2HD   LYS   5          2HD       LYS   5 -12.312   2.194   5.433
   36   1HE   LYS   5          1HE       LYS   5 -12.347   3.204   7.649
   37   2HE   LYS   5          2HE       LYS   5 -13.855   2.298   7.396
   38   1HZ   LYS   5          1HZ       LYS   5 -11.485   1.306   8.829
   39   2HZ   LYS   5          2HZ       LYS   5 -12.842   1.905   9.560
   40   3HZ   LYS   5          3HZ       LYS   5 -12.922   0.514   8.676
   41    H    VAL   6           H        VAL   6 -11.630  -3.856   4.031
   42    HA   VAL   6           HA       VAL   6 -13.082  -4.986   6.383
   43    HB   VAL   6           HB       VAL   6 -12.708  -7.227   5.218
   44   1HG1  VAL   6          1HG2      VAL   6 -14.472  -5.124   3.897
   45   2HG1  VAL   6          2HG2      VAL   6 -14.691  -6.885   3.764
   46   3HG1  VAL   6          3HG2      VAL   6 -14.889  -6.078   5.340
   47   1HG2  VAL   6          1HG1      VAL   6 -11.033  -6.412   3.548
   48   2HG2  VAL   6          2HG1      VAL   6 -12.449  -7.161   2.769
   49   3HG2  VAL   6          3HG1      VAL   6 -12.290  -5.389   2.817
   50    H    GLU   7           H        GLU   7 -11.814  -5.654   8.065
   51    HA   GLU   7           HA       GLU   7  -8.940  -5.298   7.580
   52   1HB   GLU   7          1HB       GLU   7  -9.843  -4.118   9.451
   53   2HB   GLU   7          2HB       GLU   7 -10.529  -5.598  10.176
   54   1HG   GLU   7          1HG       GLU   7  -7.552  -5.339   9.675
   55   2HG   GLU   7          2HG       GLU   7  -8.306  -4.588  11.095
   56    H    VAL   8           H        VAL   8  -7.403  -6.676   8.017
   57    HA   VAL   8           HA       VAL   8  -7.802  -9.503   8.625
   58    HB   VAL   8           HB       VAL   8  -6.610 -10.019   6.377
   59   1HG1  VAL   8          1HG1      VAL   8  -9.477  -9.022   6.507
   60   2HG1  VAL   8          2HG1      VAL   8  -8.793 -10.081   5.229
   61   3HG1  VAL   8          3HG1      VAL   8  -8.870 -10.654   6.910
   62   1HG2  VAL   8          1HG2      VAL   8  -7.810  -7.281   5.739
   63   2HG2  VAL   8          2HG2      VAL   8  -6.076  -7.683   5.731
   64   3HG2  VAL   8          3HG2      VAL   8  -7.175  -8.422   4.534
   65    H    ARG   9           H        ARG   9  -5.582 -10.550   8.745
   66    HA   ARG   9           HA       ARG   9  -3.731  -8.471   9.706
   67   1HB   ARG   9          1HB       ARG   9  -3.849 -10.567  10.977
   68   2HB   ARG   9          2HB       ARG   9  -3.222 -11.461   9.551
   69   1HG   ARG   9          1HG       ARG   9  -1.127 -10.160   9.677
   70   2HG   ARG   9          2HG       ARG   9  -1.820  -9.181  10.996
   71   1HD   ARG   9          1HD       ARG   9  -1.436 -12.196  11.119
   72   2HD   ARG   9          2HD       ARG   9  -0.325 -11.001  11.837
   73    HE   ARG   9           HE       ARG   9  -2.831 -10.314  12.784
   74   1HH1  ARG   9          1HH2      ARG   9  -0.753 -13.156  12.933
   75   2HH1  ARG   9          2HH2      ARG   9  -1.341 -13.697  14.483
   76   1HH2  ARG   9          2HH1      ARG   9  -3.594 -10.954  14.807
   77   2HH2  ARG   9          1HH1      ARG   9  -3.016 -12.412  15.583
   78    H    LEU  10           H        LEU  10  -1.912  -7.878   8.813
   79    HA   LEU  10           HA       LEU  10  -1.702  -8.038   5.982
   80   1HB   LEU  10          1HB       LEU  10  -1.162  -6.150   7.624
   81   2HB   LEU  10          2HB       LEU  10   0.298  -7.040   8.090
   82    HG   LEU  10           HG       LEU  10   1.270  -6.695   5.899
   83   1HD1  LEU  10          1HD1      LEU  10  -1.447  -5.505   5.163
   84   2HD1  LEU  10          2HD1      LEU  10   0.006  -5.513   4.134
   85   3HD1  LEU  10          3HD1      LEU  10  -0.795  -7.047   4.553
   86   1HD2  LEU  10          1HD2      LEU  10   1.247  -4.856   7.591
   87   2HD2  LEU  10          2HD2      LEU  10   1.301  -4.257   5.921
   88   3HD2  LEU  10          3HD2      LEU  10  -0.231  -4.205   6.836
   89    H    LYS  11           H        LYS  11  -1.625 -10.403   5.886
   90    HA   LYS  11           HA       LYS  11   0.573 -11.893   6.992
   91   1HB   LYS  11          1HB       LYS  11  -1.515 -12.956   6.679
   92   2HB   LYS  11          2HB       LYS  11  -1.661 -12.374   5.014
   93   1HG   LYS  11          1HG       LYS  11   0.583 -14.242   5.789
   94   2HG   LYS  11          2HG       LYS  11  -1.044 -14.857   5.466
   95   1HD   LYS  11          1HD       LYS  11   0.795 -13.368   3.566
   96   2HD   LYS  11          2HD       LYS  11   0.005 -14.950   3.342
   97   1HE   LYS  11          1HE       LYS  11  -2.229 -13.724   3.479
   98   2HE   LYS  11          2HE       LYS  11  -1.300 -12.203   3.515
   99   1HZ   LYS  11          1HZ       LYS  11  -1.270 -14.136   1.303
  100   2HZ   LYS  11          2HZ       LYS  11  -2.129 -12.741   1.350
  101   3HZ   LYS  11          3HZ       LYS  11  -0.482 -12.686   1.356
  102    H    THR  12           H        THR  12   0.192 -10.000   4.048
  103    HA   THR  12           HA       THR  12   2.567 -11.239   2.879
  104    HB   THR  12           HB       THR  12   2.497  -9.234   1.343
  105    HG1  THR  12           HG1      THR  12   0.711  -7.907   1.454
  106   1HG2  THR  12          1HG2      THR  12   0.442  -9.918   0.160
  107   2HG2  THR  12          2HG2      THR  12   1.408 -11.303   0.709
  108   3HG2  THR  12          3HG2      THR  12  -0.061 -10.838   1.606
  109    H    GLY  13           H        GLY  13   1.632  -8.109   4.182
  110   1HA   GLY  13          1HA       GLY  13   2.862  -6.436   5.315
  111   2HA   GLY  13          2HA       GLY  13   4.305  -7.499   5.327
  112    H    LEU  14           H        LEU  14   2.233  -7.021   2.597
  113    HA   LEU  14           HA       LEU  14   2.681  -6.450   0.414
  114   1HB   LEU  14          1HB       LEU  14   2.962  -4.020   2.137
  115   2HB   LEU  14          2HB       LEU  14   3.090  -3.887   0.395
  116    HG   LEU  14           HG       LEU  14   0.786  -3.462   1.174
  117   1HD1  LEU  14          1HD2      LEU  14   1.011  -4.470  -1.064
  118   2HD1  LEU  14          2HD2      LEU  14   0.915  -6.089  -0.334
  119   3HD1  LEU  14          3HD2      LEU  14  -0.478  -4.986  -0.248
  120   1HD2  LEU  14          1HD1      LEU  14   0.786  -4.938   3.157
  121   2HD2  LEU  14          2HD1      LEU  14  -0.618  -5.236   2.102
  122   3HD2  LEU  14          3HD1      LEU  14   0.764  -6.359   2.092
  123    H    GLN  15           H        GLN  15   4.664  -7.932   0.431
  124    HA   GLN  15           HA       GLN  15   7.096  -6.226   0.443
  125   1HB   GLN  15          1HB       GLN  15   6.862  -9.240   0.580
  126   2HB   GLN  15          2HB       GLN  15   8.370  -8.305   0.690
  127   1HG   GLN  15          1HG       GLN  15   7.447  -7.100   2.669
  128   2HG   GLN  15          2HG       GLN  15   6.003  -8.127   2.604
  129   1HE2  GLN  15          2HE2      GLN  15   6.068 -10.077   3.730
  130   2HE2  GLN  15          1HE2      GLN  15   7.550 -10.809   4.299
  131    H    ALA  16           H        ALA  16   6.228  -9.146  -1.594
  132    HA   ALA  16           HA       ALA  16   7.285  -7.511  -3.836
  133   1HB   ALA  16          1HB       ALA  16   9.240  -8.566  -2.823
  134   2HB   ALA  16          2HB       ALA  16   8.484 -10.169  -3.001
  135   3HB   ALA  16          3HB       ALA  16   8.927  -9.228  -4.447
  136    H    ARG  17           H        ARG  17   5.133 -10.090  -2.811
  137    HA   ARG  17           HA       ARG  17   4.598 -10.410  -5.727
  138   1HB   ARG  17          1HB       ARG  17   5.969 -12.279  -4.773
  139   2HB   ARG  17          2HB       ARG  17   4.554 -12.752  -3.810
  140   1HG   ARG  17          1HG       ARG  17   4.824 -13.978  -5.995
  141   2HG   ARG  17          2HG       ARG  17   3.260 -13.144  -5.856
  142   1HD   ARG  17          1HD       ARG  17   5.552 -11.625  -7.081
  143   2HD   ARG  17          2HD       ARG  17   4.820 -12.928  -8.030
  144    HE   ARG  17           HE       ARG  17   2.631 -11.832  -7.726
  145   1HH1  ARG  17          1HH2      ARG  17   5.484  -9.747  -7.152
  146   2HH1  ARG  17          2HH2      ARG  17   4.806  -8.421  -8.031
  147   1HH2  ARG  17          2HH1      ARG  17   1.688  -9.980  -8.611
  148   2HH2  ARG  17          1HH1      ARG  17   2.583  -8.491  -8.741
  149    HA   PRO  18           HA       PRO  18   0.407 -11.577  -3.652
  150   1HB   PRO  18          1HB       PRO  18   0.259 -11.308  -0.914
  151   2HB   PRO  18          2HB       PRO  18   0.683 -12.847  -1.738
  152   1HG   PRO  18          1HG       PRO  18   2.614 -10.729  -0.697
  153   2HG   PRO  18          2HG       PRO  18   2.631 -12.459  -0.300
  154   1HD   PRO  18          1HD       PRO  18   4.206 -11.532  -2.240
  155   2HD   PRO  18          2HD       PRO  18   3.245 -13.009  -2.597
  156    H    ALA  19           H        ALA  19   2.268  -9.287  -1.593
  157    HA   ALA  19           HA       ALA  19   0.409  -7.225  -1.347
  158   1HB   ALA  19          1HB       ALA  19   2.739  -7.426  -0.376
  159   2HB   ALA  19          2HB       ALA  19   3.367  -7.084  -2.016
  160   3HB   ALA  19          3HB       ALA  19   2.417  -5.840  -1.162
  161    H    ALA  20           H        ALA  20   2.636  -7.893  -4.032
  162    HA   ALA  20           HA       ALA  20   2.236  -5.388  -5.434
  163   1HB   ALA  20          1HB       ALA  20   3.115  -8.134  -6.429
  164   2HB   ALA  20          2HB       ALA  20   3.262  -6.602  -7.327
  165   3HB   ALA  20          3HB       ALA  20   4.198  -6.851  -5.833
  166    H    LEU  21           H        LEU  21   0.865  -8.649  -5.507
  167    HA   LEU  21           HA       LEU  21  -1.072  -8.298  -7.558
  168   1HB   LEU  21          1HB       LEU  21  -0.174 -10.330  -6.174
  169   2HB   LEU  21          2HB       LEU  21  -1.536  -9.990  -5.100
  170    HG   LEU  21           HG       LEU  21  -1.894 -10.192  -8.115
  171   1HD1  LEU  21          1HD1      LEU  21  -0.887 -12.313  -7.349
  172   2HD1  LEU  21          2HD1      LEU  21  -2.144 -12.460  -6.096
  173   3HD1  LEU  21          3HD1      LEU  21  -2.590 -12.531  -7.814
  174   1HD2  LEU  21          1HD2      LEU  21  -3.652  -9.115  -6.746
  175   2HD2  LEU  21          2HD2      LEU  21  -4.240 -10.665  -7.402
  176   3HD2  LEU  21          3HD2      LEU  21  -3.727 -10.546  -5.700
  177    H    PHE  22           H        PHE  22  -1.189  -7.797  -4.044
  178    HA   PHE  22           HA       PHE  22  -3.866  -6.916  -3.573
  179   1HB   PHE  22          1HB       PHE  22  -1.203  -6.000  -2.452
  180   2HB   PHE  22          2HB       PHE  22  -2.769  -5.580  -1.753
  181    HD1  PHE  22           HD1      PHE  22  -1.107  -6.677   0.070
  182    HD2  PHE  22           HD2      PHE  22  -3.294  -8.758  -2.974
  183    HE1  PHE  22           HE1      PHE  22  -0.820  -8.836   1.337
  184    HE2  PHE  22           HE2      PHE  22  -2.866 -10.918  -1.817
  185    HZ   PHE  22           HZ       PHE  22  -1.599 -10.960   0.308
  186    H    VAL  23           H        VAL  23  -0.991  -4.782  -3.986
  187    HA   VAL  23           HA       VAL  23  -2.517  -2.407  -4.265
  188    HB   VAL  23           HB       VAL  23   0.252  -3.194  -5.239
  189   1HG1  VAL  23          1HG2      VAL  23  -1.055  -0.448  -5.062
  190   2HG1  VAL  23          2HG2      VAL  23   0.660  -0.755  -5.423
  191   3HG1  VAL  23          3HG2      VAL  23  -0.598  -1.292  -6.559
  192   1HG2  VAL  23          1HG1      VAL  23  -0.138  -3.227  -2.769
  193   2HG2  VAL  23          2HG1      VAL  23   0.947  -1.903  -3.233
  194   3HG2  VAL  23          3HG1      VAL  23  -0.749  -1.561  -2.848
  195    H    GLN  24           H        GLN  24  -1.292  -4.721  -6.710
  196    HA   GLN  24           HA       GLN  24  -2.094  -3.526  -9.065
  197   1HB   GLN  24          1HB       GLN  24  -0.773  -5.568  -8.932
  198   2HB   GLN  24          2HB       GLN  24  -2.104  -6.384  -8.090
  199   1HG   GLN  24          1HG       GLN  24  -3.461  -5.721 -10.269
  200   2HG   GLN  24          2HG       GLN  24  -1.848  -5.781 -11.012
  201   1HE2  GLN  24          2HE2      GLN  24  -3.301  -7.697  -8.279
  202   2HE2  GLN  24          1HE2      GLN  24  -3.178  -9.233  -9.123
  203    H    GLU  25           H        GLU  25  -4.126  -5.904  -7.196
  204    HA   GLU  25           HA       GLU  25  -6.368  -5.301  -9.003
  205   1HB   GLU  25          1HB       GLU  25  -7.579  -6.985  -7.565
  206   2HB   GLU  25          2HB       GLU  25  -6.109  -7.623  -8.335
  207   1HG   GLU  25          1HG       GLU  25  -4.850  -7.369  -6.267
  208   2HG   GLU  25          2HG       GLU  25  -6.220  -6.532  -5.510
  209    H    ALA  26           H        ALA  26  -5.423  -4.385  -5.726
  210    HA   ALA  26           HA       ALA  26  -7.848  -3.123  -4.936
  211   1HB   ALA  26          1HB       ALA  26  -4.950  -2.277  -4.539
  212   2HB   ALA  26          2HB       ALA  26  -6.336  -1.684  -3.590
  213   3HB   ALA  26          3HB       ALA  26  -5.844  -3.397  -3.481
  214    H    ASN  27           H        ASN  27  -5.122  -2.145  -6.982
  215    HA   ASN  27           HA       ASN  27  -5.982   0.517  -7.677
  216   1HB   ASN  27          1HB       ASN  27  -3.956  -1.521  -8.435
  217   2HB   ASN  27          2HB       ASN  27  -4.489  -0.492  -9.770
  218   1HD2  ASN  27          2HD2      ASN  27  -2.369  -0.749  -7.237
  219   2HD2  ASN  27          1HD2      ASN  27  -1.835   0.924  -7.058
  220    H    ARG  28           H        ARG  28  -6.241  -2.734  -9.012
  221    HA   ARG  28           HA       ARG  28  -7.393  -2.314 -11.547
  222   1HB   ARG  28          1HB       ARG  28  -7.739  -4.358  -9.332
  223   2HB   ARG  28          2HB       ARG  28  -8.578  -4.530 -10.845
  224   1HG   ARG  28          1HG       ARG  28  -6.343  -4.419 -12.051
  225   2HG   ARG  28          2HG       ARG  28  -5.567  -4.456 -10.452
  226   1HD   ARG  28          1HD       ARG  28  -6.771  -6.595  -9.954
  227   2HD   ARG  28          2HD       ARG  28  -7.503  -6.554 -11.563
  228    HE   ARG  28           HE       ARG  28  -4.885  -7.489 -10.884
  229   1HH1  ARG  28          1HH2      ARG  28  -6.759  -5.898 -13.394
  230   2HH1  ARG  28          2HH2      ARG  28  -5.750  -6.431 -14.714
  231   1HH2  ARG  28          2HH1      ARG  28  -3.450  -8.111 -12.582
  232   2HH2  ARG  28          1HH1      ARG  28  -3.845  -7.737 -14.237
  233    H    PHE  29           H        PHE  29  -8.866  -2.623  -8.336
  234    HA   PHE  29           HA       PHE  29 -11.544  -1.906  -9.088
  235   1HB   PHE  29          1HB       PHE  29  -9.965  -1.747  -6.511
  236   2HB   PHE  29          2HB       PHE  29 -11.712  -1.464  -6.626
  237    HD1  PHE  29           HD1      PHE  29 -12.846  -3.395  -8.276
  238    HD2  PHE  29           HD2      PHE  29  -9.437  -3.933  -5.712
  239    HE1  PHE  29           HE1      PHE  29 -13.446  -5.794  -7.980
  240    HE2  PHE  29           HE2      PHE  29 -10.090  -6.304  -5.334
  241    HZ   PHE  29           HZ       PHE  29 -12.132  -7.216  -6.438
  242    H    THR  30           H        THR  30 -12.218  -0.040  -9.676
  243    HA   THR  30           HA       THR  30 -10.469   2.328  -9.477
  244    HB   THR  30           HB       THR  30 -11.516   1.786 -11.538
  245    HG1  THR  30           HG1      THR  30 -12.763   4.164 -10.665
  246   1HG2  THR  30          1HG2      THR  30 -13.942   2.075 -11.918
  247   2HG2  THR  30          2HG2      THR  30 -13.614   0.778 -10.742
  248   3HG2  THR  30          3HG2      THR  30 -14.154   2.381 -10.177
  249    H    SER  31           H        SER  31 -10.712   1.837  -7.153
  250    HA   SER  31           HA       SER  31 -12.686   3.550  -5.783
  251   1HB   SER  31          1HB       SER  31 -11.389   0.926  -4.911
  252   2HB   SER  31          2HB       SER  31 -12.692   1.793  -4.067
  253    HG   SER  31           HG       SER  31 -13.324  -0.078  -5.398
  254    H    ASP  32           H        ASP  32 -11.860   4.752  -4.101
  255    HA   ASP  32           HA       ASP  32  -8.980   5.183  -4.008
  256   1HB   ASP  32          1HB       ASP  32 -11.289   6.079  -2.276
  257   2HB   ASP  32          2HB       ASP  32  -9.612   6.635  -2.045
  258    H    VAL  33           H        VAL  33  -8.310   3.053  -3.663
  259    HA   VAL  33           HA       VAL  33  -9.155   1.484  -1.426
  260    HB   VAL  33           HB       VAL  33  -6.903   1.280  -3.448
  261   1HG1  VAL  33          1HG1      VAL  33  -7.948  -0.788  -1.468
  262   2HG1  VAL  33          2HG1      VAL  33  -6.753  -1.088  -2.764
  263   3HG1  VAL  33          3HG1      VAL  33  -6.356   0.014  -1.425
  264   1HG2  VAL  33          1HG2      VAL  33  -9.246   1.325  -4.249
  265   2HG2  VAL  33          2HG2      VAL  33  -8.525  -0.285  -4.495
  266   3HG2  VAL  33          3HG2      VAL  33  -9.657   0.003  -3.138
  267    H    PHE  34           H        PHE  34  -8.114   0.912   0.424
  268    HA   PHE  34           HA       PHE  34  -5.698   2.435   1.143
  269   1HB   PHE  34          1HB       PHE  34  -8.283   2.608   2.732
  270   2HB   PHE  34          2HB       PHE  34  -6.705   3.227   3.236
  271    HD1  PHE  34           HD1      PHE  34  -9.762   4.164   1.739
  272    HD2  PHE  34           HD2      PHE  34  -5.522   4.772   1.413
  273    HE1  PHE  34           HE1      PHE  34 -10.162   6.295   0.515
  274    HE2  PHE  34           HE2      PHE  34  -5.920   6.920   0.198
  275    HZ   PHE  34           HZ       PHE  34  -8.246   7.678  -0.237
  276    H    LEU  35           H        LEU  35  -4.798   1.769   3.221
  277    HA   LEU  35           HA       LEU  35  -5.843  -0.815   4.210
  278   1HB   LEU  35          1HB       LEU  35  -3.930  -1.328   2.650
  279   2HB   LEU  35          2HB       LEU  35  -2.875  -0.348   3.705
  280    HG   LEU  35           HG       LEU  35  -3.508  -1.838   5.616
  281   1HD1  LEU  35          1HD2      LEU  35  -4.924  -3.409   3.418
  282   2HD1  LEU  35          2HD2      LEU  35  -4.716  -3.944   5.102
  283   3HD1  LEU  35          3HD2      LEU  35  -5.725  -2.523   4.736
  284   1HD2  LEU  35          1HD1      LEU  35  -1.481  -2.309   4.277
  285   2HD2  LEU  35          2HD1      LEU  35  -2.240  -3.816   4.844
  286   3HD2  LEU  35          3HD1      LEU  35  -2.450  -3.293   3.156
  287    H    GLU  36           H        GLU  36  -6.272  -0.468   6.265
  288    HA   GLU  36           HA       GLU  36  -4.811   1.699   7.699
  289   1HB   GLU  36          1HB       GLU  36  -7.359   0.318   8.564
  290   2HB   GLU  36          2HB       GLU  36  -6.784   1.939   9.016
  291   1HG   GLU  36          1HG       GLU  36  -7.224   2.763   6.768
  292   2HG   GLU  36          2HG       GLU  36  -7.551   1.130   6.180
  293    H    LYS  37           H        LYS  37  -3.027   0.698   8.722
  294    HA   LYS  37           HA       LYS  37  -2.994  -1.972   9.767
  295   1HB   LYS  37          1HB       LYS  37  -1.383   0.587   9.979
  296   2HB   LYS  37          2HB       LYS  37  -0.986  -0.833  10.936
  297   1HG   LYS  37          1HG       LYS  37  -0.724  -2.103   8.845
  298   2HG   LYS  37          2HG       LYS  37  -1.035  -0.628   7.893
  299   1HD   LYS  37          1HD       LYS  37   1.457  -1.062   8.304
  300   2HD   LYS  37          2HD       LYS  37   0.868   0.487   8.962
  301   1HE   LYS  37          1HE       LYS  37   0.461  -0.663  11.167
  302   2HE   LYS  37          2HE       LYS  37   1.266  -2.107  10.529
  303   1HZ   LYS  37          1HZ       LYS  37   2.465   0.577  10.780
  304   2HZ   LYS  37          2HZ       LYS  37   2.746  -0.703  11.785
  305   3HZ   LYS  37          3HZ       LYS  37   3.227  -0.771  10.210
  306    H    ASP  38           H        ASP  38  -4.974  -1.996  11.122
  307    HA   ASP  38           HA       ASP  38  -6.207  -1.636  13.014
  308   1HB   ASP  38          1HB       ASP  38  -3.443  -1.083  14.124
  309   2HB   ASP  38          2HB       ASP  38  -4.897  -1.324  15.115
  310    H    GLY  39           H        GLY  39  -5.755   0.635  11.176
  311   1HA   GLY  39          1HA       GLY  39  -6.965   2.803  11.796
  312   2HA   GLY  39          2HA       GLY  39  -5.818   2.844  13.159
  313    H    LYS  40           H        LYS  40  -3.537   1.793  11.488
  314    HA   LYS  40           HA       LYS  40  -2.638   4.377  10.532
  315   1HB   LYS  40          1HB       LYS  40  -1.287   1.692  10.154
  316   2HB   LYS  40          2HB       LYS  40  -0.535   3.299  10.251
  317   1HG   LYS  40          1HG       LYS  40  -1.453   3.413  12.655
  318   2HG   LYS  40          2HG       LYS  40  -1.854   1.685  12.475
  319   1HD   LYS  40          1HD       LYS  40   0.345   1.954  13.552
  320   2HD   LYS  40          2HD       LYS  40   0.525   1.196  11.954
  321   1HE   LYS  40          1HE       LYS  40   1.116   3.387  10.971
  322   2HE   LYS  40          2HE       LYS  40   0.872   4.172  12.544
  323   1HZ   LYS  40          1HZ       LYS  40   2.653   2.843  13.418
  324   2HZ   LYS  40          2HZ       LYS  40   2.895   2.125  11.954
  325   3HZ   LYS  40          3HZ       LYS  40   3.170   3.739  12.136
  326    H    LYS  41           H        LYS  41  -4.426   4.555   8.964
  327    HA   LYS  41           HA       LYS  41  -4.346   2.788   6.633
  328   1HB   LYS  41          1HB       LYS  41  -6.448   3.286   7.478
  329   2HB   LYS  41          2HB       LYS  41  -6.076   5.001   7.659
  330   1HG   LYS  41          1HG       LYS  41  -6.107   3.838   4.886
  331   2HG   LYS  41          2HG       LYS  41  -7.645   4.220   5.707
  332   1HD   LYS  41          1HD       LYS  41  -6.938   6.501   6.151
  333   2HD   LYS  41          2HD       LYS  41  -5.312   6.185   5.518
  334   1HE   LYS  41          1HE       LYS  41  -6.243   5.777   3.271
  335   2HE   LYS  41          2HE       LYS  41  -7.884   6.003   3.885
  336   1HZ   LYS  41          1HZ       LYS  41  -5.768   8.039   3.890
  337   2HZ   LYS  41          2HZ       LYS  41  -7.037   7.963   2.840
  338   3HZ   LYS  41          3HZ       LYS  41  -7.307   8.250   4.441
  339    H    VAL  42           H        VAL  42  -3.738   3.132   4.720
  340    HA   VAL  42           HA       VAL  42  -3.032   5.824   3.674
  341    HB   VAL  42           HB       VAL  42  -1.043   4.606   2.519
  342   1HG1  VAL  42          1HG1      VAL  42  -0.969   5.211   5.493
  343   2HG1  VAL  42          2HG1      VAL  42   0.453   5.099   4.428
  344   3HG1  VAL  42          3HG1      VAL  42  -0.755   6.381   4.172
  345   1HG2  VAL  42          1HG2      VAL  42  -1.705   2.327   3.174
  346   2HG2  VAL  42          2HG2      VAL  42  -0.091   2.723   3.823
  347   3HG2  VAL  42          3HG2      VAL  42  -1.517   2.759   4.890
  348    H    ASN  43           H        ASN  43  -2.507   5.662   1.253
  349    HA   ASN  43           HA       ASN  43  -4.815   4.411  -0.012
  350   1HB   ASN  43          1HB       ASN  43  -3.973   6.614  -0.761
  351   2HB   ASN  43          2HB       ASN  43  -2.406   5.879  -1.155
  352   1HD2  ASN  43          2HD2      ASN  43  -5.808   4.654  -1.822
  353   2HD2  ASN  43          1HD2      ASN  43  -5.593   4.793  -3.558
  354    H    ALA  44           H        ALA  44  -4.811   2.433   0.014
  355    HA   ALA  44           HA       ALA  44  -2.800   0.547   0.242
  356   1HB   ALA  44          1HB       ALA  44  -5.473   0.361  -1.189
  357   2HB   ALA  44          2HB       ALA  44  -4.546  -1.044  -0.624
  358   3HB   ALA  44          3HB       ALA  44  -5.228   0.118   0.550
  359    H    LYS  45           H        LYS  45  -4.204   1.923  -2.700
  360    HA   LYS  45           HA       LYS  45  -2.814   0.072  -4.466
  361   1HB   LYS  45          1HB       LYS  45  -3.706   1.513  -6.251
  362   2HB   LYS  45          2HB       LYS  45  -4.970   0.949  -5.135
  363   1HG   LYS  45          1HG       LYS  45  -5.076   3.108  -4.048
  364   2HG   LYS  45          2HG       LYS  45  -3.551   3.608  -4.796
  365   1HD   LYS  45          1HD       LYS  45  -5.074   4.725  -6.125
  366   2HD   LYS  45          2HD       LYS  45  -4.746   3.269  -7.079
  367   1HE   LYS  45          1HE       LYS  45  -7.136   3.616  -5.193
  368   2HE   LYS  45          2HE       LYS  45  -7.182   3.944  -6.929
  369   1HZ   LYS  45          1HZ       LYS  45  -6.537   1.330  -5.768
  370   2HZ   LYS  45          2HZ       LYS  45  -7.998   1.781  -6.381
  371   3HZ   LYS  45          3HZ       LYS  45  -6.686   1.704  -7.370
  372    H    SER  46           H        SER  46  -1.765   2.845  -2.753
  373    HA   SER  46           HA       SER  46   0.284   3.361  -4.858
  374   1HB   SER  46          1HB       SER  46  -0.726   5.073  -2.569
  375   2HB   SER  46          2HB       SER  46   0.827   5.377  -3.379
  376    HG   SER  46           HG       SER  46  -1.762   5.478  -4.474
  377    H    ILE  47           H        ILE  47   2.438   3.719  -4.176
  378    HA   ILE  47           HA       ILE  47   3.701   1.750  -2.757
  379    HB   ILE  47           HB       ILE  47   4.909   3.213  -4.150
  380   1HG1  ILE  47          1HG1      ILE  47   5.868   2.309  -1.836
  381   2HG1  ILE  47          2HG1      ILE  47   6.871   3.328  -2.867
  382   1HG2  ILE  47          1HG2      ILE  47   3.615   5.271  -3.884
  383   2HG2  ILE  47          2HG2      ILE  47   4.306   5.496  -2.258
  384   3HG2  ILE  47          3HG2      ILE  47   5.357   5.573  -3.690
  385   1HD1  ILE  47          1HD1      ILE  47   6.121   5.344  -1.553
  386   2HD1  ILE  47          2HD1      ILE  47   5.173   4.274  -0.503
  387   3HD1  ILE  47          3HD1      ILE  47   6.942   4.147  -0.523
  388    H    MET  48           H        MET  48   2.749   4.932  -1.382
  389    HA   MET  48           HA       MET  48   3.925   4.188   1.096
  390   1HB   MET  48          1HB       MET  48   3.143   6.162   1.974
  391   2HB   MET  48          2HB       MET  48   3.048   6.561   0.246
  392   1HG   MET  48          1HG       MET  48   0.810   5.288   1.818
  393   2HG   MET  48          2HG       MET  48   0.963   7.060   1.691
  394   1HE   MET  48          1HE       MET  48   2.231   6.871  -1.314
  395   2HE   MET  48          2HE       MET  48   0.818   7.333  -2.304
  396   3HE   MET  48          3HE       MET  48   1.184   8.216  -0.800
  397    H    GLY  49           H        GLY  49   0.848   3.250  -0.277
  398   1HA   GLY  49          1HA       GLY  49  -0.159   2.290   2.305
  399   2HA   GLY  49          2HA       GLY  49  -0.897   1.995   0.697
  400    H    LEU  50           H        LEU  50   0.703   0.695  -0.820
  401    HA   LEU  50           HA       LEU  50   1.125  -1.887   0.039
  402   1HB   LEU  50          1HB       LEU  50   1.135  -1.194  -2.275
  403   2HB   LEU  50          2HB       LEU  50   2.509  -0.112  -1.994
  404    HG   LEU  50           HG       LEU  50   4.025  -1.957  -1.672
  405   1HD1  LEU  50          1HD2      LEU  50   1.613  -3.754  -2.150
  406   2HD1  LEU  50          2HD2      LEU  50   3.301  -4.296  -1.989
  407   3HD1  LEU  50          3HD2      LEU  50   2.470  -3.546  -0.605
  408   1HD2  LEU  50          1HD1      LEU  50   3.545  -1.165  -3.967
  409   2HD2  LEU  50          2HD1      LEU  50   3.898  -2.913  -3.956
  410   3HD2  LEU  50          3HD1      LEU  50   2.217  -2.344  -4.094
  411    H    MET  51           H        MET  51   3.787   0.440  -0.467
  412    HA   MET  51           HA       MET  51   5.642  -1.396   0.722
  413   1HB   MET  51          1HB       MET  51   6.032   0.117  -1.351
  414   2HB   MET  51          2HB       MET  51   6.034   1.491  -0.248
  415   1HG   MET  51          1HG       MET  51   7.919  -0.846   0.151
  416   2HG   MET  51          2HG       MET  51   8.279   0.455  -0.989
  417   1HE   MET  51          1HE       MET  51   8.258   3.023  -0.303
  418   2HE   MET  51          2HE       MET  51   6.823   2.874   0.745
  419   3HE   MET  51          3HE       MET  51   8.326   3.592   1.382
  420    H    SER  52           H        SER  52   4.256   1.922   1.557
  421    HA   SER  52           HA       SER  52   6.085   2.005   3.778
  422   1HB   SER  52          1HB       SER  52   3.595   3.677   3.349
  423   2HB   SER  52          2HB       SER  52   4.983   4.067   4.392
  424    HG   SER  52           HG       SER  52   6.284   3.990   2.454
  425    H    LEU  53           H        LEU  53   2.463   1.974   4.016
  426    HA   LEU  53           HA       LEU  53   2.778   1.098   6.779
  427   1HB   LEU  53          1HB       LEU  53   0.459   1.738   4.946
  428   2HB   LEU  53          2HB       LEU  53   0.226   1.011   6.546
  429    HG   LEU  53           HG       LEU  53   1.540   2.886   7.570
  430   1HD1  LEU  53          1HD2      LEU  53   1.464   4.025   4.737
  431   2HD1  LEU  53          2HD2      LEU  53   1.985   4.912   6.194
  432   3HD1  LEU  53          3HD2      LEU  53   2.923   3.513   5.617
  433   1HD2  LEU  53          1HD1      LEU  53  -0.913   2.972   7.352
  434   2HD2  LEU  53          2HD1      LEU  53  -0.195   4.605   7.191
  435   3HD2  LEU  53          3HD1      LEU  53  -0.734   3.713   5.743
  436    H    ALA  54           H        ALA  54   1.245  -0.283   3.922
  437    HA   ALA  54           HA       ALA  54   0.358  -2.740   4.926
  438   1HB   ALA  54          1HB       ALA  54  -0.352  -1.683   2.785
  439   2HB   ALA  54          2HB       ALA  54   1.261  -1.995   2.118
  440   3HB   ALA  54          3HB       ALA  54   0.204  -3.354   2.544
  441    H    VAL  55           H        VAL  55   3.637  -1.737   4.349
  442    HA   VAL  55           HA       VAL  55   4.673  -4.358   3.802
  443    HB   VAL  55           HB       VAL  55   5.794  -2.138   3.347
  444   1HG1  VAL  55          1HG1      VAL  55   6.494  -2.411   6.308
  445   2HG1  VAL  55          2HG1      VAL  55   7.212  -1.246   5.168
  446   3HG1  VAL  55          3HG1      VAL  55   5.490  -1.126   5.588
  447   1HG2  VAL  55          1HG2      VAL  55   6.905  -4.332   3.142
  448   2HG2  VAL  55          2HG2      VAL  55   8.037  -3.095   3.743
  449   3HG2  VAL  55          3HG2      VAL  55   7.331  -4.284   4.868
  450    H    SER  56           H        SER  56   3.350  -2.954   6.662
  451    HA   SER  56           HA       SER  56   5.038  -4.363   8.515
  452   1HB   SER  56          1HB       SER  56   2.306  -3.160   9.036
  453   2HB   SER  56          2HB       SER  56   3.612  -3.447  10.198
  454    HG   SER  56           HG       SER  56   3.584  -1.599   8.021
  455    H    THR  57           H        THR  57   4.667  -6.516   7.229
  456    HA   THR  57           HA       THR  57   2.518  -8.142   7.346
  457    HB   THR  57           HB       THR  57   5.169  -9.083   8.447
  458    HG1  THR  57           HG1      THR  57   4.873  -9.072   5.693
  459   1HG2  THR  57          1HG2      THR  57   4.592 -11.071   7.034
  460   2HG2  THR  57          2HG2      THR  57   3.350 -10.718   8.262
  461   3HG2  THR  57          3HG2      THR  57   3.073 -10.259   6.570
  462    H    GLY  58           H        GLY  58   1.095  -8.745   8.822
  463   1HA   GLY  58          1HA       GLY  58   0.515  -9.819  10.879
  464   2HA   GLY  58          2HA       GLY  58   1.933  -9.092  11.645
  465    H    THR  59           H        THR  59   0.443  -6.572   9.866
  466    HA   THR  59           HA       THR  59  -0.680  -5.573  12.386
  467    HB   THR  59           HB       THR  59  -0.822  -4.345   9.600
  468    HG1  THR  59           HG1      THR  59   1.354  -4.733  10.326
  469   1HG2  THR  59          1HG2      THR  59  -1.049  -2.244  10.889
  470   2HG2  THR  59          2HG2      THR  59  -2.346  -3.389  11.320
  471   3HG2  THR  59          3HG2      THR  59  -0.960  -3.162  12.408
  472    H    GLU  60           H        GLU  60  -3.038  -5.123  12.680
  473    HA   GLU  60           HA       GLU  60  -4.582  -6.947  10.928
  474   1HB   GLU  60          1HB       GLU  60  -5.875  -5.477  13.188
  475   2HB   GLU  60          2HB       GLU  60  -6.219  -7.089  12.446
  476   1HG   GLU  60          1HG       GLU  60  -3.679  -6.526  14.025
  477   2HG   GLU  60          2HG       GLU  60  -5.170  -7.061  14.818
  478    H    VAL  61           H        VAL  61  -4.714  -5.952   9.109
  479    HA   VAL  61           HA       VAL  61  -5.091  -3.036   9.001
  480    HB   VAL  61           HB       VAL  61  -4.620  -3.981   6.416
  481   1HG1  VAL  61          1HG2      VAL  61  -4.010  -2.031   7.654
  482   2HG1  VAL  61          2HG2      VAL  61  -2.938  -3.019   8.696
  483   3HG1  VAL  61          3HG2      VAL  61  -2.552  -2.825   6.939
  484   1HG2  VAL  61          1HG1      VAL  61  -2.835  -5.345   8.524
  485   2HG2  VAL  61          2HG1      VAL  61  -3.857  -6.227   7.380
  486   3HG2  VAL  61          3HG1      VAL  61  -2.457  -5.282   6.788
  487    H    THR  62           H        THR  62  -6.674  -1.981   8.074
  488    HA   THR  62           HA       THR  62  -8.705  -3.786   7.040
  489    HB   THR  62           HB       THR  62  -9.180  -0.851   7.773
  490    HG1  THR  62           HG1      THR  62  -8.505  -2.197   9.550
  491   1HG2  THR  62          1HG2      THR  62 -11.552  -1.571   7.923
  492   2HG2  THR  62          2HG2      THR  62 -10.922  -1.839   6.290
  493   3HG2  THR  62          3HG2      THR  62 -11.089  -3.206   7.415
  494    H    LEU  63           H        LEU  63  -8.825  -4.079   4.969
  495    HA   LEU  63           HA       LEU  63  -7.519  -2.221   3.123
  496   1HB   LEU  63          1HB       LEU  63  -7.341  -4.773   3.137
  497   2HB   LEU  63          2HB       LEU  63  -9.023  -4.814   2.568
  498    HG   LEU  63           HG       LEU  63  -7.323  -5.035   0.789
  499   1HD1  LEU  63          1HD1      LEU  63  -9.551  -4.124   0.266
  500   2HD1  LEU  63          2HD1      LEU  63  -8.954  -2.473   0.576
  501   3HD1  LEU  63          3HD1      LEU  63  -8.299  -3.416  -0.783
  502   1HD2  LEU  63          1HD2      LEU  63  -5.594  -3.570   1.770
  503   2HD2  LEU  63          2HD2      LEU  63  -5.993  -3.063   0.111
  504   3HD2  LEU  63          3HD2      LEU  63  -6.635  -2.151   1.498
  505    H    ILE  64           H        ILE  64  -8.586  -0.547   2.585
  506    HA   ILE  64           HA       ILE  64 -11.536  -0.448   2.382
  507    HB   ILE  64           HB       ILE  64  -9.392   1.687   1.985
  508   1HG1  ILE  64          1HG1      ILE  64 -11.039   1.108   4.469
  509   2HG1  ILE  64          2HG1      ILE  64  -9.265   0.960   4.305
  510   1HG2  ILE  64          1HG2      ILE  64 -12.392   1.880   2.435
  511   2HG2  ILE  64          2HG2      ILE  64 -11.275   3.263   2.318
  512   3HG2  ILE  64          3HG2      ILE  64 -11.532   2.201   0.909
  513   1HD1  ILE  64          1HD1      ILE  64  -9.173   3.384   3.688
  514   2HD1  ILE  64          2HD1      ILE  64 -10.937   3.475   3.907
  515   3HD1  ILE  64          3HD1      ILE  64  -9.891   3.147   5.311
  516    H    ALA  65           H        ALA  65 -12.525   0.171   0.488
  517    HA   ALA  65           HA       ALA  65 -10.854   0.975  -1.776
  518   1HB   ALA  65          1HB       ALA  65 -11.103  -1.498  -2.191
  519   2HB   ALA  65          2HB       ALA  65 -12.875  -1.295  -2.100
  520   3HB   ALA  65          3HB       ALA  65 -11.961  -0.519  -3.406
  521    H    GLN  66           H        GLN  66 -11.744   3.004  -1.300
  522    HA   GLN  66           HA       GLN  66 -14.707   3.011  -1.326
  523   1HB   GLN  66          1HB       GLN  66 -14.557   5.261  -0.482
  524   2HB   GLN  66          2HB       GLN  66 -13.409   4.242   0.427
  525   1HG   GLN  66          1HG       GLN  66 -11.542   5.265  -0.509
  526   2HG   GLN  66          2HG       GLN  66 -12.432   5.673  -1.989
  527   1HE2  GLN  66          2HE2      GLN  66 -12.026   6.669   1.441
  528   2HE2  GLN  66          1HE2      GLN  66 -12.603   8.298   1.144
  529    H    GLY  67           H        GLY  67 -14.664   2.180  -3.452
  530   1HA   GLY  67          1HA       GLY  67 -14.501   4.413  -5.451
  531   2HA   GLY  67          2HA       GLY  67 -13.682   2.890  -5.728
  532    H    GLU  68           H        GLU  68 -14.849   3.055  -7.639
  533    HA   GLU  68           HA       GLU  68 -17.630   2.569  -7.900
  534   1HB   GLU  68          1HB       GLU  68 -15.216   1.978  -9.632
  535   2HB   GLU  68          2HB       GLU  68 -16.898   1.892 -10.217
  536   1HG   GLU  68          1HG       GLU  68 -17.267   4.230  -9.770
  537   2HG   GLU  68          2HG       GLU  68 -15.800   4.328  -8.773
  538    H    ASP  69           H        ASP  69 -14.905   0.287  -7.098
  539    HA   ASP  69           HA       ASP  69 -17.023  -1.836  -7.310
  540   1HB   ASP  69          1HB       ASP  69 -14.164  -2.555  -7.067
  541   2HB   ASP  69          2HB       ASP  69 -15.496  -3.430  -7.800
  542    H    GLU  70           H        GLU  70 -16.477   0.289  -5.175
  543    HA   GLU  70           HA       GLU  70 -14.763  -0.088  -3.337
  544   1HB   GLU  70          1HB       GLU  70 -16.384   0.716  -1.688
  545   2HB   GLU  70          2HB       GLU  70 -16.391   1.595  -3.230
  546   1HG   GLU  70          1HG       GLU  70 -18.528   1.195  -3.625
  547   2HG   GLU  70          2HG       GLU  70 -18.402  -0.520  -3.216
  548    H    GLN  71           H        GLN  71 -17.796  -1.619  -2.356
  549    HA   GLN  71           HA       GLN  71 -17.044  -3.181  -0.321
  550   1HB   GLN  71          1HB       GLN  71 -19.267  -2.829  -1.715
  551   2HB   GLN  71          2HB       GLN  71 -18.741  -4.267  -2.602
  552   1HG   GLN  71          1HG       GLN  71 -19.545  -4.033   0.308
  553   2HG   GLN  71          2HG       GLN  71 -20.323  -4.998  -0.971
  554   1HE2  GLN  71          2HE2      GLN  71 -17.600  -4.627   1.192
  555   2HE2  GLN  71          1HE2      GLN  71 -16.876  -6.221   0.905
  556    H    GLU  72           H        GLU  72 -17.026  -4.170  -3.717
  557    HA   GLU  72           HA       GLU  72 -16.029  -6.777  -3.446
  558   1HB   GLU  72          1HB       GLU  72 -17.194  -5.990  -5.494
  559   2HB   GLU  72          2HB       GLU  72 -16.188  -4.523  -5.505
  560   1HG   GLU  72          1HG       GLU  72 -15.611  -5.759  -7.377
  561   2HG   GLU  72          2HG       GLU  72 -14.255  -5.777  -6.241
  562    H    ALA  73           H        ALA  73 -14.470  -3.643  -4.056
  563    HA   ALA  73           HA       ALA  73 -11.911  -4.569  -4.854
  564   1HB   ALA  73          1HB       ALA  73 -13.015  -1.967  -3.734
  565   2HB   ALA  73          2HB       ALA  73 -11.417  -2.144  -4.520
  566   3HB   ALA  73          3HB       ALA  73 -12.913  -2.430  -5.444
  567    H    LEU  74           H        LEU  74 -13.157  -3.141  -1.828
  568    HA   LEU  74           HA       LEU  74 -10.767  -3.548  -0.314
  569   1HB   LEU  74          1HB       LEU  74 -12.356  -3.280   1.658
  570   2HB   LEU  74          2HB       LEU  74 -12.333  -1.993   0.429
  571    HG   LEU  74           HG       LEU  74 -14.285  -3.712  -0.513
  572   1HD1  LEU  74          1HD2      LEU  74 -14.646  -3.163   2.458
  573   2HD1  LEU  74          2HD2      LEU  74 -15.883  -3.801   1.341
  574   3HD1  LEU  74          3HD2      LEU  74 -14.433  -4.769   1.703
  575   1HD2  LEU  74          1HD1      LEU  74 -14.387  -1.070   1.000
  576   2HD2  LEU  74          2HD1      LEU  74 -14.123  -1.297  -0.744
  577   3HD2  LEU  74          3HD1      LEU  74 -15.684  -1.728  -0.033
  578    H    GLU  75           H        GLU  75 -13.654  -5.621  -0.782
  579    HA   GLU  75           HA       GLU  75 -13.003  -7.734   0.900
  580   1HB   GLU  75          1HB       GLU  75 -14.221  -7.730  -1.906
  581   2HB   GLU  75          2HB       GLU  75 -14.144  -9.169  -0.862
  582   1HG   GLU  75          1HG       GLU  75 -15.552  -6.581  -0.185
  583   2HG   GLU  75          2HG       GLU  75 -16.340  -8.104  -0.649
  584    H    LYS  76           H        LYS  76 -12.118  -7.638  -2.610
  585    HA   LYS  76           HA       LYS  76 -10.822 -10.142  -2.527
  586   1HB   LYS  76          1HB       LYS  76  -9.905  -7.847  -4.287
  587   2HB   LYS  76          2HB       LYS  76  -9.795  -9.592  -4.590
  588   1HG   LYS  76          1HG       LYS  76 -12.458  -9.410  -4.255
  589   2HG   LYS  76          2HG       LYS  76 -12.132  -7.743  -4.764
  590   1HD   LYS  76          1HD       LYS  76 -11.533 -10.389  -6.191
  591   2HD   LYS  76          2HD       LYS  76 -12.572  -9.078  -6.784
  592   1HE   LYS  76          1HE       LYS  76 -10.526  -7.643  -7.050
  593   2HE   LYS  76          2HE       LYS  76  -9.524  -8.967  -6.432
  594   1HZ   LYS  76          1HZ       LYS  76 -11.175  -9.048  -8.861
  595   2HZ   LYS  76          2HZ       LYS  76  -9.535  -8.886  -8.805
  596   3HZ   LYS  76          3HZ       LYS  76 -10.241 -10.284  -8.293
  597    H    LEU  77           H        LEU  77  -9.471  -6.895  -2.041
  598    HA   LEU  77           HA       LEU  77  -6.797  -7.906  -1.780
  599   1HB   LEU  77          1HB       LEU  77  -7.934  -5.247  -0.906
  600   2HB   LEU  77          2HB       LEU  77  -6.254  -5.758  -0.805
  601    HG   LEU  77           HG       LEU  77  -6.617  -4.439  -2.893
  602   1HD1  LEU  77          1HD2      LEU  77  -5.153  -6.502  -3.032
  603   2HD1  LEU  77          2HD2      LEU  77  -6.618  -7.397  -3.562
  604   3HD1  LEU  77          3HD2      LEU  77  -5.986  -6.067  -4.558
  605   1HD2  LEU  77          1HD1      LEU  77  -8.613  -6.637  -3.531
  606   2HD2  LEU  77          2HD1      LEU  77  -9.060  -4.960  -3.147
  607   3HD2  LEU  77          3HD1      LEU  77  -8.134  -5.332  -4.641
  608    H    ALA  78           H        ALA  78  -9.101  -6.798   0.864
  609    HA   ALA  78           HA       ALA  78  -7.192  -7.601   2.873
  610   1HB   ALA  78          1HB       ALA  78  -9.036  -6.067   3.411
  611   2HB   ALA  78          2HB       ALA  78 -10.214  -7.366   3.093
  612   3HB   ALA  78          3HB       ALA  78  -9.069  -7.503   4.445
  613    H    ALA  79           H        ALA  79  -9.415  -9.354   0.848
  614    HA   ALA  79           HA       ALA  79  -9.608 -11.775   2.404
  615   1HB   ALA  79          1HB       ALA  79 -11.035 -11.206   0.413
  616   2HB   ALA  79          2HB       ALA  79  -9.585 -11.363  -0.615
  617   3HB   ALA  79          3HB       ALA  79 -10.222 -12.786   0.245
  618    H    TYR  80           H        TYR  80  -7.481 -10.689  -0.306
  619    HA   TYR  80           HA       TYR  80  -5.926 -13.095  -0.184
  620   1HB   TYR  80          1HB       TYR  80  -6.451 -11.652  -2.124
  621   2HB   TYR  80          2HB       TYR  80  -5.366 -10.423  -1.476
  622    HD1  TYR  80           HD1      TYR  80  -3.816 -13.460  -0.665
  623    HD2  TYR  80           HD2      TYR  80  -4.692 -10.930  -4.038
  624    HE1  TYR  80           HE1      TYR  80  -1.693 -14.162  -1.737
  625    HE2  TYR  80           HE2      TYR  80  -2.548 -11.589  -5.086
  626    HH   TYR  80           HH       TYR  80  -0.658 -12.882  -4.913
  627    H    VAL  81           H        VAL  81  -5.227  -9.751   0.883
  628    HA   VAL  81           HA       VAL  81  -2.603  -9.882   1.591
  629    HB   VAL  81           HB       VAL  81  -3.102  -8.115   3.254
  630   1HG1  VAL  81          1HG2      VAL  81  -4.873  -7.933   0.797
  631   2HG1  VAL  81          2HG2      VAL  81  -4.343  -6.560   1.802
  632   3HG1  VAL  81          3HG2      VAL  81  -3.149  -7.508   0.872
  633   1HG2  VAL  81          1HG1      VAL  81  -5.056  -9.213   4.281
  634   2HG2  VAL  81          2HG1      VAL  81  -5.463  -7.557   3.777
  635   3HG2  VAL  81          3HG1      VAL  81  -5.996  -8.951   2.800
  636    H    GLN  82           H        GLN  82  -5.170 -11.315   3.466
  637    HA   GLN  82           HA       GLN  82  -3.379 -11.667   5.782
  638   1HB   GLN  82          1HB       GLN  82  -5.594 -12.054   6.901
  639   2HB   GLN  82          2HB       GLN  82  -5.748 -10.661   5.798
  640   1HG   GLN  82          1HG       GLN  82  -6.667 -12.163   4.074
  641   2HG   GLN  82          2HG       GLN  82  -6.206 -13.541   5.075
  642   1HE2  GLN  82          2HE2      GLN  82  -8.642 -11.576   4.171
  643   2HE2  GLN  82          1HE2      GLN  82  -9.898 -12.158   5.283
  644    H    GLU  83           H        GLU  83  -4.311 -13.506   3.011
  645    HA   GLU  83           HA       GLU  83  -5.466 -15.689   4.411
  646   1HB   GLU  83          1HB       GLU  83  -5.747 -16.716   2.244
  647   2HB   GLU  83          2HB       GLU  83  -6.188 -14.990   2.231
  648   1HG   GLU  83          1HG       GLU  83  -4.056 -14.425   1.155
  649   2HG   GLU  83          2HG       GLU  83  -3.555 -16.132   1.210
  650    H    GLU  84           H        GLU  84  -2.272 -15.772   2.672
  651    HA   GLU  84           HA       GLU  84  -1.951 -18.359   4.114
  652   1HB   GLU  84          1HB       GLU  84   0.015 -18.684   2.579
  653   2HB   GLU  84          2HB       GLU  84  -1.565 -18.641   1.779
  654   1HG   GLU  84          1HG       GLU  84  -0.246 -15.993   1.971
  655   2HG   GLU  84          2HG       GLU  84   0.589 -17.192   0.948
  656    H    VAL  85           H        VAL  85   1.000 -17.137   3.240
  657    HA   VAL  85           HA       VAL  85   1.702 -15.240   5.344
  658    HB   VAL  85           HB       VAL  85   1.894 -17.205   6.803
  659   1HG1  VAL  85          1HG1      VAL  85   3.402 -18.759   4.584
  660   2HG1  VAL  85          2HG1      VAL  85   3.201 -19.290   6.273
  661   3HG1  VAL  85          3HG1      VAL  85   1.793 -19.155   5.234
  662   1HG2  VAL  85          1HG2      VAL  85   3.940 -15.709   6.833
  663   2HG2  VAL  85          2HG2      VAL  85   4.333 -17.381   7.245
  664   3HG2  VAL  85          3HG2      VAL  85   4.725 -16.752   5.624
  Start of MODEL    5
    1   1H    VAL   2          1H        VAL   2 -17.819   6.424  -0.461
    2   2H    VAL   2          2H        VAL   2 -17.117   6.697  -1.965
    3   3H    VAL   2          3H        VAL   2 -18.786   6.805  -1.784
    4    HA   VAL   2           HA       VAL   2 -18.970   4.511  -1.321
    5    HB   VAL   2           HB       VAL   2 -19.058   5.343  -3.639
    6   1HG1  VAL   2          1HG1      VAL   2 -16.671   6.087  -3.811
    7   2HG1  VAL   2          2HG1      VAL   2 -16.187   4.377  -3.844
    8   3HG1  VAL   2          3HG1      VAL   2 -17.187   5.042  -5.161
    9   1HG2  VAL   2          1HG2      VAL   2 -17.819   2.603  -3.234
   10   2HG2  VAL   2          2HG2      VAL   2 -19.554   3.001  -3.168
   11   3HG2  VAL   2          3HG2      VAL   2 -18.667   3.124  -4.710
   12    H    GLN   3           H        GLN   3 -17.301   4.859   0.645
   13    HA   GLN   3           HA       GLN   3 -14.897   3.206   0.057
   14   1HB   GLN   3          1HB       GLN   3 -14.568   5.642   0.810
   15   2HB   GLN   3          2HB       GLN   3 -15.341   5.154   2.341
   16   1HG   GLN   3          1HG       GLN   3 -13.571   3.289   2.468
   17   2HG   GLN   3          2HG       GLN   3 -12.734   4.124   1.153
   18   1HE2  GLN   3          2HE2      GLN   3 -13.206   6.833   1.915
   19   2HE2  GLN   3          1HE2      GLN   3 -12.400   7.103   3.461
   20    H    GLN   4           H        GLN   4 -14.814   1.276   1.017
   21    HA   GLN   4           HA       GLN   4 -16.007   1.041   3.694
   22   1HB   GLN   4          1HB       GLN   4 -17.333  -0.088   1.504
   23   2HB   GLN   4          2HB       GLN   4 -16.352  -1.432   2.128
   24   1HG   GLN   4          1HG       GLN   4 -18.257   0.302   3.750
   25   2HG   GLN   4          2HG       GLN   4 -18.528  -1.392   3.256
   26   1HE2  GLN   4          2HE2      GLN   4 -17.116  -3.044   4.126
   27   2HE2  GLN   4          1HE2      GLN   4 -16.101  -2.734   5.558
   28    H    LYS   5           H        LYS   5 -14.793  -0.713   4.966
   29    HA   LYS   5           HA       LYS   5 -12.521  -1.890   3.557
   30   1HB   LYS   5          1HB       LYS   5 -11.059  -1.132   5.450
   31   2HB   LYS   5          2HB       LYS   5 -11.531   0.143   4.317
   32   1HG   LYS   5          1HG       LYS   5 -13.128  -0.300   6.833
   33   2HG   LYS   5          2HG       LYS   5 -11.618   0.651   6.873
   34   1HD   LYS   5          1HD       LYS   5 -12.450   2.226   5.245
   35   2HD   LYS   5          2HD       LYS   5 -13.875   1.214   4.921
   36   1HE   LYS   5          1HE       LYS   5 -13.243   2.572   7.573
   37   2HE   LYS   5          2HE       LYS   5 -14.439   3.119   6.381
   38   1HZ   LYS   5          1HZ       LYS   5 -15.589   1.023   6.680
   39   2HZ   LYS   5          2HZ       LYS   5 -14.501   0.562   7.828
   40   3HZ   LYS   5          3HZ       LYS   5 -15.477   1.860   8.098
   41    H    VAL   6           H        VAL   6 -11.645  -3.625   4.743
   42    HA   VAL   6           HA       VAL   6 -13.157  -4.473   7.149
   43    HB   VAL   6           HB       VAL   6 -13.132  -6.821   6.237
   44   1HG1  VAL   6          1HG2      VAL   6 -15.133  -5.364   6.262
   45   2HG1  VAL   6          2HG2      VAL   6 -14.680  -4.715   4.672
   46   3HG1  VAL   6          3HG2      VAL   6 -15.129  -6.430   4.835
   47   1HG2  VAL   6          1HG1      VAL   6 -12.510  -5.378   3.624
   48   2HG2  VAL   6          2HG1      VAL   6 -11.427  -6.509   4.468
   49   3HG2  VAL   6          3HG1      VAL   6 -12.967  -7.093   3.784
   50    H    GLU   7           H        GLU   7 -11.669  -4.773   8.774
   51    HA   GLU   7           HA       GLU   7  -8.874  -4.795   7.902
   52   1HB   GLU   7          1HB       GLU   7  -8.316  -4.654  10.292
   53   2HB   GLU   7          2HB       GLU   7  -9.428  -3.355   9.820
   54   1HG   GLU   7          1HG       GLU   7 -11.294  -4.517  10.868
   55   2HG   GLU   7          2HG       GLU   7 -10.311  -5.983  11.095
   56    H    VAL   8           H        VAL   8  -7.338  -6.252   8.363
   57    HA   VAL   8           HA       VAL   8  -8.137  -8.992   9.152
   58    HB   VAL   8           HB       VAL   8  -6.963  -9.748   7.016
   59   1HG1  VAL   8          1HG2      VAL   8  -9.423  -8.009   6.531
   60   2HG1  VAL   8          2HG2      VAL   8  -8.802  -9.298   5.466
   61   3HG1  VAL   8          3HG2      VAL   8  -9.441  -9.713   7.072
   62   1HG2  VAL   8          1HG1      VAL   8  -5.806  -7.586   6.630
   63   2HG2  VAL   8          2HG1      VAL   8  -6.741  -8.127   5.209
   64   3HG2  VAL   8          3HG1      VAL   8  -7.384  -6.829   6.257
   65    H    ARG   9           H        ARG   9  -6.009 -10.350   9.256
   66    HA   ARG   9           HA       ARG   9  -3.904  -8.640  10.416
   67   1HB   ARG   9          1HB       ARG   9  -4.095 -10.900  11.298
   68   2HB   ARG   9          2HB       ARG   9  -3.867 -11.571   9.648
   69   1HG   ARG   9          1HG       ARG   9  -1.556 -10.484   9.646
   70   2HG   ARG   9          2HG       ARG   9  -1.845 -10.106  11.360
   71   1HD   ARG   9          1HD       ARG   9  -0.587 -12.266  10.950
   72   2HD   ARG   9          2HD       ARG   9  -2.091 -12.481  11.873
   73    HE   ARG   9           HE       ARG   9  -2.971 -12.916   9.359
   74   1HH1  ARG   9          2HH1      ARG   9  -0.156 -14.208  11.059
   75   2HH1  ARG   9          1HH1      ARG   9  -0.161 -15.717  10.184
   76   1HH2  ARG   9          1HH2      ARG   9  -3.000 -14.869   8.235
   77   2HH2  ARG   9          2HH2      ARG   9  -1.780 -16.063   8.442
   78    H    LEU  10           H        LEU  10  -2.420  -7.599   9.240
   79    HA   LEU  10           HA       LEU  10  -2.247  -8.060   6.382
   80   1HB   LEU  10          1HB       LEU  10  -2.102  -5.811   7.319
   81   2HB   LEU  10          2HB       LEU  10  -0.883  -6.323   8.490
   82    HG   LEU  10           HG       LEU  10   0.770  -6.620   6.729
   83   1HD1  LEU  10          1HD1      LEU  10  -1.463  -5.651   4.889
   84   2HD1  LEU  10          2HD1      LEU  10   0.254  -5.853   4.437
   85   3HD1  LEU  10          3HD1      LEU  10  -0.713  -7.273   4.908
   86   1HD2  LEU  10          1HD2      LEU  10   0.459  -4.549   7.967
   87   2HD2  LEU  10          2HD2      LEU  10   0.985  -4.199   6.304
   88   3HD2  LEU  10          3HD2      LEU  10  -0.726  -3.968   6.765
   89    H    LYS  11           H        LYS  11  -1.795 -10.391   6.946
   90    HA   LYS  11           HA       LYS  11   0.646 -11.286   8.200
   91   1HB   LYS  11          1HB       LYS  11  -1.171 -12.774   8.251
   92   2HB   LYS  11          2HB       LYS  11  -1.654 -12.357   6.592
   93   1HG   LYS  11          1HG       LYS  11   0.806 -13.423   6.088
   94   2HG   LYS  11          2HG       LYS  11   0.227 -14.425   7.483
   95   1HD   LYS  11          1HD       LYS  11  -0.825 -15.370   5.500
   96   2HD   LYS  11          2HD       LYS  11  -2.057 -14.350   6.302
   97   1HE   LYS  11          1HE       LYS  11  -1.539 -12.500   4.854
   98   2HE   LYS  11          2HE       LYS  11  -0.267 -13.465   4.017
   99   1HZ   LYS  11          1HZ       LYS  11  -3.105 -14.144   4.016
  100   2HZ   LYS  11          2HZ       LYS  11  -2.307 -13.410   2.789
  101   3HZ   LYS  11          3HZ       LYS  11  -1.899 -14.942   3.234
  102    H    THR  12           H        THR  12  -0.424 -10.611   4.918
  103    HA   THR  12           HA       THR  12   1.791 -11.672   3.527
  104    HB   THR  12           HB       THR  12   1.160  -9.925   1.782
  105    HG1  THR  12           HG1      THR  12  -0.622  -8.586   2.333
  106   1HG2  THR  12          1HG2      THR  12  -1.183 -10.724   1.495
  107   2HG2  THR  12          2HG2      THR  12  -0.075 -12.043   1.907
  108   3HG2  THR  12          3HG2      THR  12  -1.149 -11.366   3.157
  109    H    GLY  13           H        GLY  13   1.180  -8.302   4.526
  110   1HA   GLY  13          1HA       GLY  13   2.567  -6.715   5.503
  111   2HA   GLY  13          2HA       GLY  13   3.835  -7.940   5.705
  112    H    LEU  14           H        LEU  14   2.266  -7.243   2.720
  113    HA   LEU  14           HA       LEU  14   3.067  -6.571   0.619
  114   1HB   LEU  14          1HB       LEU  14   3.430  -4.354   2.617
  115   2HB   LEU  14          2HB       LEU  14   3.687  -4.078   0.892
  116    HG   LEU  14           HG       LEU  14   1.393  -3.514   1.850
  117   1HD1  LEU  14          1HD1      LEU  14   1.490  -5.413  -0.506
  118   2HD1  LEU  14          2HD1      LEU  14   0.152  -4.315  -0.100
  119   3HD1  LEU  14          3HD1      LEU  14   1.741  -3.653  -0.539
  120   1HD2  LEU  14          1HD2      LEU  14   0.996  -5.548   3.190
  121   2HD2  LEU  14          2HD2      LEU  14  -0.278  -5.319   1.963
  122   3HD2  LEU  14          3HD2      LEU  14   1.002  -6.526   1.702
  123    H    GLN  15           H        GLN  15   4.825  -8.237   0.922
  124    HA   GLN  15           HA       GLN  15   7.555  -7.141   1.286
  125   1HB   GLN  15          1HB       GLN  15   6.542  -9.964   0.790
  126   2HB   GLN  15          2HB       GLN  15   8.239  -9.514   1.090
  127   1HG   GLN  15          1HG       GLN  15   7.605  -8.548   3.273
  128   2HG   GLN  15          2HG       GLN  15   5.912  -8.994   2.983
  129   1HE2  GLN  15          2HE2      GLN  15   5.291 -10.894   3.938
  130   2HE2  GLN  15          1HE2      GLN  15   6.335 -12.266   4.207
  131    H    ALA  16           H        ALA  16   6.674  -5.809  -0.630
  132    HA   ALA  16           HA       ALA  16   7.025  -5.154  -2.809
  133   1HB   ALA  16          1HB       ALA  16   9.350  -5.845  -2.424
  134   2HB   ALA  16          2HB       ALA  16   8.937  -7.514  -2.889
  135   3HB   ALA  16          3HB       ALA  16   8.850  -6.202  -4.093
  136    H    ARG  17           H        ARG  17   7.707  -7.657  -4.700
  137    HA   ARG  17           HA       ARG  17   5.708  -7.810  -6.336
  138   1HB   ARG  17          1HB       ARG  17   7.796  -9.153  -6.318
  139   2HB   ARG  17          2HB       ARG  17   6.963 -10.357  -5.314
  140   1HG   ARG  17          1HG       ARG  17   6.944 -10.934  -7.721
  141   2HG   ARG  17          2HG       ARG  17   5.294 -10.697  -7.113
  142   1HD   ARG  17          1HD       ARG  17   6.871  -8.487  -8.483
  143   2HD   ARG  17          2HD       ARG  17   5.863  -9.642  -9.380
  144    HE   ARG  17           HE       ARG  17   4.104  -8.773  -7.524
  145   1HH1  ARG  17          2HH1      ARG  17   6.289  -6.976  -9.639
  146   2HH1  ARG  17          1HH1      ARG  17   5.292  -5.548  -9.677
  147   1HH2  ARG  17          1HH2      ARG  17   2.787  -6.986  -7.599
  148   2HH2  ARG  17          2HH2      ARG  17   3.217  -5.561  -8.512
  149    HA   PRO  18           HA       PRO  18   2.920 -11.157  -4.223
  150   1HB   PRO  18          1HB       PRO  18   3.032 -11.223  -1.441
  151   2HB   PRO  18          2HB       PRO  18   3.935 -12.321  -2.538
  152   1HG   PRO  18          1HG       PRO  18   4.919  -9.745  -1.245
  153   2HG   PRO  18          2HG       PRO  18   5.753 -11.330  -1.301
  154   1HD   PRO  18          1HD       PRO  18   6.376  -9.386  -3.052
  155   2HD   PRO  18          2HD       PRO  18   6.214 -11.074  -3.634
  156    H    ALA  19           H        ALA  19   3.095  -8.976  -1.315
  157    HA   ALA  19           HA       ALA  19   0.409  -8.259  -1.828
  158   1HB   ALA  19          1HB       ALA  19   1.397  -8.291   0.394
  159   2HB   ALA  19          2HB       ALA  19   2.413  -6.892  -0.044
  160   3HB   ALA  19          3HB       ALA  19   0.638  -6.714   0.007
  161    H    ALA  20           H        ALA  20   3.244  -7.059  -3.376
  162    HA   ALA  20           HA       ALA  20   2.207  -4.487  -4.153
  163   1HB   ALA  20          1HB       ALA  20   4.569  -5.206  -4.527
  164   2HB   ALA  20          2HB       ALA  20   3.994  -6.438  -5.675
  165   3HB   ALA  20          3HB       ALA  20   3.777  -4.712  -6.045
  166    H    LEU  21           H        LEU  21   1.898  -7.853  -5.346
  167    HA   LEU  21           HA       LEU  21   0.145  -7.390  -7.545
  168   1HB   LEU  21          1HB       LEU  21   1.446  -9.497  -6.659
  169   2HB   LEU  21          2HB       LEU  21   0.003  -9.769  -5.680
  170    HG   LEU  21           HG       LEU  21   0.008  -9.432  -8.717
  171   1HD1  LEU  21          1HD1      LEU  21   1.132 -11.514  -7.969
  172   2HD1  LEU  21          2HD1      LEU  21  -0.298 -11.925  -6.991
  173   3HD1  LEU  21          3HD1      LEU  21  -0.422 -11.861  -8.765
  174   1HD2  LEU  21          1HD2      LEU  21  -2.100  -8.755  -7.590
  175   2HD2  LEU  21          2HD2      LEU  21  -2.329 -10.239  -8.543
  176   3HD2  LEU  21          3HD2      LEU  21  -2.166 -10.332  -6.774
  177    H    PHE  22           H        PHE  22  -0.321  -8.078  -4.096
  178    HA   PHE  22           HA       PHE  22  -3.137  -7.934  -3.778
  179   1HB   PHE  22          1HB       PHE  22  -1.871  -8.450  -1.860
  180   2HB   PHE  22          2HB       PHE  22  -0.756  -7.103  -2.163
  181    HD1  PHE  22           HD1      PHE  22  -0.823  -5.143  -1.135
  182    HD2  PHE  22           HD2      PHE  22  -4.298  -7.681  -1.032
  183    HE1  PHE  22           HE1      PHE  22  -1.917  -3.570   0.458
  184    HE2  PHE  22           HE2      PHE  22  -5.362  -6.155   0.607
  185    HZ   PHE  22           HZ       PHE  22  -4.187  -4.090   1.343
  186    H    VAL  23           H        VAL  23  -0.829  -5.236  -3.639
  187    HA   VAL  23           HA       VAL  23  -2.518  -3.019  -3.527
  188    HB   VAL  23           HB       VAL  23   0.210  -3.640  -4.667
  189   1HG1  VAL  23          1HG2      VAL  23  -1.075  -0.889  -4.690
  190   2HG1  VAL  23          2HG2      VAL  23   0.630  -1.258  -5.038
  191   3HG1  VAL  23          3HG2      VAL  23  -0.649  -1.862  -6.117
  192   1HG2  VAL  23          1HG1      VAL  23  -0.067  -3.484  -2.222
  193   2HG2  VAL  23          2HG1      VAL  23   0.934  -2.145  -2.837
  194   3HG2  VAL  23          3HG1      VAL  23  -0.764  -1.850  -2.401
  195    H    GLN  24           H        GLN  24  -1.192  -4.734  -6.368
  196    HA   GLN  24           HA       GLN  24  -2.431  -3.248  -8.399
  197   1HB   GLN  24          1HB       GLN  24  -0.520  -4.844  -8.507
  198   2HB   GLN  24          2HB       GLN  24  -1.654  -6.196  -8.351
  199   1HG   GLN  24          1HG       GLN  24  -2.186  -4.183 -10.506
  200   2HG   GLN  24          2HG       GLN  24  -0.767  -5.228 -10.703
  201   1HE2  GLN  24          2HE2      GLN  24  -4.327  -5.336 -10.215
  202   2HE2  GLN  24          1HE2      GLN  24  -4.496  -6.932 -10.917
  203    H    GLU  25           H        GLU  25  -3.643  -6.032  -6.524
  204    HA   GLU  25           HA       GLU  25  -6.022  -6.437  -8.096
  205   1HB   GLU  25          1HB       GLU  25  -5.412  -7.044  -5.153
  206   2HB   GLU  25          2HB       GLU  25  -6.684  -7.845  -6.106
  207   1HG   GLU  25          1HG       GLU  25  -3.774  -7.995  -6.933
  208   2HG   GLU  25          2HG       GLU  25  -4.433  -9.071  -5.682
  209    H    ALA  26           H        ALA  26  -5.377  -4.807  -4.980
  210    HA   ALA  26           HA       ALA  26  -7.949  -3.700  -4.514
  211   1HB   ALA  26          1HB       ALA  26  -5.200  -2.419  -4.185
  212   2HB   ALA  26          2HB       ALA  26  -6.685  -1.888  -3.365
  213   3HB   ALA  26          3HB       ALA  26  -5.979  -3.481  -2.984
  214    H    ASN  27           H        ASN  27  -5.199  -2.457  -6.277
  215    HA   ASN  27           HA       ASN  27  -6.033  -0.152  -7.552
  216   1HB   ASN  27          1HB       ASN  27  -4.082  -2.312  -7.861
  217   2HB   ASN  27          2HB       ASN  27  -4.541  -1.617  -9.416
  218   1HD2  ASN  27          2HD2      ASN  27  -2.498  -1.332  -6.833
  219   2HD2  ASN  27          1HD2      ASN  27  -1.968   0.339  -6.951
  220    H    ARG  28           H        ARG  28  -6.524  -3.548  -8.568
  221    HA   ARG  28           HA       ARG  28  -7.633  -3.167 -11.145
  222   1HB   ARG  28          1HB       ARG  28  -8.464  -5.032  -8.881
  223   2HB   ARG  28          2HB       ARG  28  -9.073  -5.143 -10.549
  224   1HG   ARG  28          1HG       ARG  28  -6.646  -5.475 -11.278
  225   2HG   ARG  28          2HG       ARG  28  -6.217  -5.529  -9.551
  226   1HD   ARG  28          1HD       ARG  28  -7.918  -7.342  -9.232
  227   2HD   ARG  28          2HD       ARG  28  -8.260  -7.325 -10.966
  228    HE   ARG  28           HE       ARG  28  -5.909  -8.435  -9.610
  229   1HH1  ARG  28          2HH1      ARG  28  -7.313  -7.467 -12.704
  230   2HH1  ARG  28          1HH1      ARG  28  -6.276  -8.505 -13.646
  231   1HH2  ARG  28          1HH2      ARG  28  -4.560  -9.715 -10.761
  232   2HH2  ARG  28          2HH2      ARG  28  -4.606  -9.794 -12.508
  233    H    PHE  29           H        PHE  29  -9.087  -2.766  -7.941
  234    HA   PHE  29           HA       PHE  29 -11.739  -2.296  -9.034
  235   1HB   PHE  29          1HB       PHE  29 -10.485  -2.061  -6.291
  236   2HB   PHE  29          2HB       PHE  29 -12.223  -1.849  -6.604
  237    HD1  PHE  29           HD1      PHE  29  -9.854  -4.156  -5.522
  238    HD2  PHE  29           HD2      PHE  29 -12.978  -3.856  -8.451
  239    HE1  PHE  29           HE1      PHE  29  -9.830  -6.614  -5.812
  240    HE2  PHE  29           HE2      PHE  29 -12.931  -6.307  -8.781
  241    HZ   PHE  29           HZ       PHE  29 -11.333  -7.694  -7.485
  242    H    THR  30           H        THR  30 -12.603  -0.505  -9.485
  243    HA   THR  30           HA       THR  30 -11.071   1.899  -9.858
  244    HB   THR  30           HB       THR  30 -14.078   1.462 -10.000
  245    HG1  THR  30           HG1      THR  30 -13.631   0.873 -12.172
  246   1HG2  THR  30          1HG2      THR  30 -12.252   3.382 -11.476
  247   2HG2  THR  30          2HG2      THR  30 -14.026   3.247 -11.663
  248   3HG2  THR  30          3HG2      THR  30 -13.331   3.780 -10.111
  249    H    SER  31           H        SER  31 -10.715   1.614  -7.281
  250    HA   SER  31           HA       SER  31 -12.480   3.475  -5.812
  251   1HB   SER  31          1HB       SER  31 -11.142   0.965  -4.750
  252   2HB   SER  31          2HB       SER  31 -12.459   1.887  -3.990
  253    HG   SER  31           HG       SER  31 -13.006  -0.183  -5.078
  254    H    ASP  32           H        ASP  32 -11.452   4.772  -4.334
  255    HA   ASP  32           HA       ASP  32  -8.538   4.983  -4.352
  256   1HB   ASP  32          1HB       ASP  32 -10.163   6.877  -4.208
  257   2HB   ASP  32          2HB       ASP  32 -10.735   6.200  -2.667
  258    H    VAL  33           H        VAL  33  -7.957   2.963  -3.709
  259    HA   VAL  33           HA       VAL  33  -9.230   1.578  -1.505
  260    HB   VAL  33           HB       VAL  33  -6.909   0.901  -3.331
  261   1HG1  VAL  33          1HG1      VAL  33  -6.813  -0.186  -1.074
  262   2HG1  VAL  33          2HG1      VAL  33  -8.427  -0.868  -1.370
  263   3HG1  VAL  33          3HG1      VAL  33  -7.056  -1.358  -2.402
  264   1HG2  VAL  33          1HG2      VAL  33  -9.869   0.155  -3.133
  265   2HG2  VAL  33          2HG2      VAL  33  -9.135   1.201  -4.357
  266   3HG2  VAL  33          3HG2      VAL  33  -8.747  -0.538  -4.336
  267    H    PHE  34           H        PHE  34  -8.330   0.884   0.426
  268    HA   PHE  34           HA       PHE  34  -6.013   2.486   1.319
  269   1HB   PHE  34          1HB       PHE  34  -8.645   2.261   2.826
  270   2HB   PHE  34          2HB       PHE  34  -7.228   3.146   3.345
  271    HD1  PHE  34           HD1      PHE  34  -6.817   4.230   0.310
  272    HD2  PHE  34           HD2      PHE  34 -10.043   4.277   3.172
  273    HE1  PHE  34           HE1      PHE  34  -7.750   6.269  -0.750
  274    HE2  PHE  34           HE2      PHE  34 -10.879   6.381   2.189
  275    HZ   PHE  34           HZ       PHE  34  -9.697   7.422   0.266
  276    H    LEU  35           H        LEU  35  -5.284   1.867   3.499
  277    HA   LEU  35           HA       LEU  35  -6.048  -0.810   4.477
  278   1HB   LEU  35          1HB       LEU  35  -4.262  -1.146   2.772
  279   2HB   LEU  35          2HB       LEU  35  -3.185  -0.079   3.700
  280    HG   LEU  35           HG       LEU  35  -4.480  -2.408   5.106
  281   1HD1  LEU  35          1HD2      LEU  35  -3.657  -3.338   2.969
  282   2HD1  LEU  35          2HD2      LEU  35  -2.060  -2.612   3.266
  283   3HD1  LEU  35          3HD2      LEU  35  -2.673  -3.894   4.342
  284   1HD2  LEU  35          1HD1      LEU  35  -3.044  -0.730   6.291
  285   2HD2  LEU  35          2HD1      LEU  35  -2.336  -2.364   6.324
  286   3HD2  LEU  35          3HD1      LEU  35  -1.701  -1.140   5.195
  287    H    GLU  36           H        GLU  36  -6.297  -0.547   6.632
  288    HA   GLU  36           HA       GLU  36  -5.014   1.860   7.882
  289   1HB   GLU  36          1HB       GLU  36  -7.525   0.469   8.801
  290   2HB   GLU  36          2HB       GLU  36  -6.990   2.137   9.124
  291   1HG   GLU  36          1HG       GLU  36  -7.367   2.752   6.808
  292   2HG   GLU  36          2HG       GLU  36  -7.771   1.107   6.362
  293    H    LYS  37           H        LYS  37  -3.208   0.898   8.970
  294    HA   LYS  37           HA       LYS  37  -3.119  -1.651  10.276
  295   1HB   LYS  37          1HB       LYS  37  -1.539   0.922  10.618
  296   2HB   LYS  37          2HB       LYS  37  -1.065  -0.646  11.296
  297   1HG   LYS  37          1HG       LYS  37  -1.601  -0.781   8.428
  298   2HG   LYS  37          2HG       LYS  37  -0.269   0.332   8.837
  299   1HD   LYS  37          1HD       LYS  37  -0.525  -2.604   9.582
  300   2HD   LYS  37          2HD       LYS  37   0.745  -1.852   8.586
  301   1HE   LYS  37          1HE       LYS  37   0.213  -1.219  11.534
  302   2HE   LYS  37          2HE       LYS  37   1.454  -2.351  10.967
  303   1HZ   LYS  37          1HZ       LYS  37   1.341   0.497  10.256
  304   2HZ   LYS  37          2HZ       LYS  37   2.326  -0.169  11.405
  305   3HZ   LYS  37          3HZ       LYS  37   2.510  -0.598   9.830
  306    H    ASP  38           H        ASP  38  -4.975  -1.799  11.646
  307    HA   ASP  38           HA       ASP  38  -6.332  -1.384  13.439
  308   1HB   ASP  38          1HB       ASP  38  -3.745  -0.351  14.620
  309   2HB   ASP  38          2HB       ASP  38  -5.191  -0.808  15.540
  310    H    GLY  39           H        GLY  39  -6.096   0.696  11.374
  311   1HA   GLY  39          1HA       GLY  39  -7.513   2.780  11.649
  312   2HA   GLY  39          2HA       GLY  39  -6.522   3.091  13.093
  313    H    LYS  40           H        LYS  40  -4.023   2.099  11.623
  314    HA   LYS  40           HA       LYS  40  -3.187   4.674  10.613
  315   1HB   LYS  40          1HB       LYS  40  -1.854   1.942  10.493
  316   2HB   LYS  40          2HB       LYS  40  -1.048   3.521  10.326
  317   1HG   LYS  40          1HG       LYS  40  -1.768   4.063  12.679
  318   2HG   LYS  40          2HG       LYS  40  -2.471   2.425  12.797
  319   1HD   LYS  40          1HD       LYS  40  -0.158   2.586  13.775
  320   2HD   LYS  40          2HD       LYS  40  -0.319   1.389  12.466
  321   1HE   LYS  40          1HE       LYS  40   0.583   2.995  10.842
  322   2HE   LYS  40          2HE       LYS  40   0.679   4.245  12.094
  323   1HZ   LYS  40          1HZ       LYS  40   2.155   1.701  12.131
  324   2HZ   LYS  40          2HZ       LYS  40   2.795   3.171  11.741
  325   3HZ   LYS  40          3HZ       LYS  40   2.249   2.886  13.270
  326    H    LYS  41           H        LYS  41  -4.897   4.785   8.958
  327    HA   LYS  41           HA       LYS  41  -4.636   2.924   6.731
  328   1HB   LYS  41          1HB       LYS  41  -6.781   3.398   7.460
  329   2HB   LYS  41          2HB       LYS  41  -6.516   5.129   7.485
  330   1HG   LYS  41          1HG       LYS  41  -6.318   3.544   4.921
  331   2HG   LYS  41          2HG       LYS  41  -7.902   4.098   5.468
  332   1HD   LYS  41          1HD       LYS  41  -7.380   6.388   5.359
  333   2HD   LYS  41          2HD       LYS  41  -5.628   6.084   5.350
  334   1HE   LYS  41          1HE       LYS  41  -5.873   4.929   3.161
  335   2HE   LYS  41          2HE       LYS  41  -7.570   5.426   3.102
  336   1HZ   LYS  41          1HZ       LYS  41  -5.290   7.273   3.248
  337   2HZ   LYS  41          2HZ       LYS  41  -6.190   6.940   1.904
  338   3HZ   LYS  41          3HZ       LYS  41  -6.886   7.690   3.191
  339    H    VAL  42           H        VAL  42  -4.065   3.206   4.759
  340    HA   VAL  42           HA       VAL  42  -3.271   5.819   3.596
  341    HB   VAL  42           HB       VAL  42  -1.284   4.548   2.571
  342   1HG1  VAL  42          1HG1      VAL  42  -0.969   6.263   4.302
  343   2HG1  VAL  42          2HG1      VAL  42  -1.219   5.027   5.564
  344   3HG1  VAL  42          3HG1      VAL  42   0.191   4.924   4.478
  345   1HG2  VAL  42          1HG2      VAL  42  -2.110   2.299   3.186
  346   2HG2  VAL  42          2HG2      VAL  42  -0.470   2.586   3.835
  347   3HG2  VAL  42          3HG2      VAL  42  -1.893   2.694   4.906
  348    H    ASN  43           H        ASN  43  -2.700   5.436   1.172
  349    HA   ASN  43           HA       ASN  43  -4.961   4.050  -0.006
  350   1HB   ASN  43          1HB       ASN  43  -3.967   6.172  -0.956
  351   2HB   ASN  43          2HB       ASN  43  -2.494   5.236  -1.324
  352   1HD2  ASN  43          2HD2      ASN  43  -5.726   6.036  -2.390
  353   2HD2  ASN  43          1HD2      ASN  43  -5.720   4.969  -3.771
  354    H    ALA  44           H        ALA  44  -4.972   2.098   0.202
  355    HA   ALA  44           HA       ALA  44  -3.071   0.163   0.639
  356   1HB   ALA  44          1HB       ALA  44  -5.563  -0.150   0.726
  357   2HB   ALA  44          2HB       ALA  44  -5.600  -0.051  -1.046
  358   3HB   ALA  44          3HB       ALA  44  -4.790  -1.420  -0.262
  359    H    LYS  45           H        LYS  45  -4.203   1.383  -2.509
  360    HA   LYS  45           HA       LYS  45  -2.651  -0.665  -3.948
  361   1HB   LYS  45          1HB       LYS  45  -3.668   0.430  -5.952
  362   2HB   LYS  45          2HB       LYS  45  -4.851  -0.242  -4.806
  363   1HG   LYS  45          1HG       LYS  45  -5.401   1.945  -3.968
  364   2HG   LYS  45          2HG       LYS  45  -3.946   2.650  -4.671
  365   1HD   LYS  45          1HD       LYS  45  -5.788   3.285  -6.076
  366   2HD   LYS  45          2HD       LYS  45  -4.833   2.078  -6.971
  367   1HE   LYS  45          1HE       LYS  45  -6.416   0.296  -6.202
  368   2HE   LYS  45          2HE       LYS  45  -7.414   1.541  -5.421
  369   1HZ   LYS  45          1HZ       LYS  45  -6.819   1.412  -8.294
  370   2HZ   LYS  45          2HZ       LYS  45  -8.235   0.980  -7.577
  371   3HZ   LYS  45          3HZ       LYS  45  -7.747   2.548  -7.531
  372    H    SER  46           H        SER  46  -1.976   2.371  -2.626
  373    HA   SER  46           HA       SER  46   0.073   2.908  -4.705
  374   1HB   SER  46          1HB       SER  46  -0.934   4.584  -2.371
  375   2HB   SER  46          2HB       SER  46   0.307   5.102  -3.539
  376    HG   SER  46           HG       SER  46  -2.352   4.330  -4.179
  377    H    ILE  47           H        ILE  47   2.195   3.524  -3.967
  378    HA   ILE  47           HA       ILE  47   3.734   1.841  -2.573
  379    HB   ILE  47           HB       ILE  47   4.764   3.601  -3.702
  380   1HG1  ILE  47          1HG1      ILE  47   5.641   2.876  -1.294
  381   2HG1  ILE  47          2HG1      ILE  47   6.477   4.106  -2.235
  382   1HG2  ILE  47          1HG2      ILE  47   2.986   5.290  -3.563
  383   2HG2  ILE  47          2HG2      ILE  47   3.408   5.593  -1.860
  384   3HG2  ILE  47          3HG2      ILE  47   4.571   5.981  -3.144
  385   1HD1  ILE  47          1HD1      ILE  47   5.163   5.884  -1.015
  386   2HD1  ILE  47          2HD1      ILE  47   4.402   4.620  -0.042
  387   3HD1  ILE  47          3HD1      ILE  47   6.147   4.898   0.098
  388    H    MET  48           H        MET  48   2.342   4.732  -0.930
  389    HA   MET  48           HA       MET  48   3.422   3.842   1.537
  390   1HB   MET  48          1HB       MET  48   2.845   6.200   1.027
  391   2HB   MET  48          2HB       MET  48   1.122   5.780   1.070
  392   1HG   MET  48          1HG       MET  48   1.417   4.994   3.426
  393   2HG   MET  48          2HG       MET  48   3.125   5.453   3.341
  394   1HE   MET  48          1HE       MET  48   3.974   7.881   3.028
  395   2HE   MET  48          2HE       MET  48   2.869   8.190   1.665
  396   3HE   MET  48          3HE       MET  48   2.938   9.331   3.034
  397    H    GLY  49           H        GLY  49   0.556   2.781  -0.095
  398   1HA   GLY  49          1HA       GLY  49  -0.701   1.795   2.357
  399   2HA   GLY  49          2HA       GLY  49  -1.212   1.471   0.665
  400    H    LEU  50           H        LEU  50   1.105   0.566  -0.514
  401    HA   LEU  50           HA       LEU  50   1.351  -2.117   0.346
  402   1HB   LEU  50          1HB       LEU  50   1.660  -0.730  -1.907
  403   2HB   LEU  50          2HB       LEU  50   3.334  -0.650  -1.381
  404    HG   LEU  50           HG       LEU  50   1.787  -3.214  -1.902
  405   1HD1  LEU  50          1HD1      LEU  50   2.624  -1.976  -3.912
  406   2HD1  LEU  50          2HD1      LEU  50   4.262  -2.011  -3.212
  407   3HD1  LEU  50          3HD1      LEU  50   3.458  -3.532  -3.670
  408   1HD2  LEU  50          1HD2      LEU  50   3.293  -3.398   0.040
  409   2HD2  LEU  50          2HD2      LEU  50   3.898  -4.352  -1.332
  410   3HD2  LEU  50          3HD2      LEU  50   4.642  -2.774  -0.932
  411    H    MET  51           H        MET  51   3.934   0.205  -0.161
  412    HA   MET  51           HA       MET  51   6.015  -1.353   1.076
  413   1HB   MET  51          1HB       MET  51   6.258   0.275  -0.909
  414   2HB   MET  51          2HB       MET  51   5.872   1.571   0.227
  415   1HG   MET  51          1HG       MET  51   7.829   0.622   1.654
  416   2HG   MET  51          2HG       MET  51   8.336  -0.162   0.148
  417   1HE   MET  51          1HE       MET  51   6.478   3.172   0.769
  418   2HE   MET  51          2HE       MET  51   7.692   3.169   2.073
  419   3HE   MET  51          3HE       MET  51   7.787   4.379   0.768
  420    H    SER  52           H        SER  52   3.977   1.447   1.917
  421    HA   SER  52           HA       SER  52   5.671   1.893   4.273
  422   1HB   SER  52          1HB       SER  52   3.048   3.255   3.613
  423   2HB   SER  52          2HB       SER  52   4.262   3.781   4.801
  424    HG   SER  52           HG       SER  52   5.754   3.925   3.006
  425    H    LEU  53           H        LEU  53   2.083   1.607   4.282
  426    HA   LEU  53           HA       LEU  53   2.333   0.702   7.032
  427   1HB   LEU  53          1HB       LEU  53  -0.022   1.255   5.221
  428   2HB   LEU  53          2HB       LEU  53  -0.180   0.755   6.920
  429    HG   LEU  53           HG       LEU  53   1.167   2.704   7.647
  430   1HD1  LEU  53          1HD2      LEU  53   0.984   3.521   4.718
  431   2HD1  LEU  53          2HD2      LEU  53   1.492   4.594   6.050
  432   3HD1  LEU  53          3HD2      LEU  53   2.478   3.176   5.626
  433   1HD2  LEU  53          1HD1      LEU  53  -1.190   3.356   5.845
  434   2HD2  LEU  53          2HD1      LEU  53  -1.291   2.833   7.543
  435   3HD2  LEU  53          3HD1      LEU  53  -0.564   4.409   7.137
  436    H    ALA  54           H        ALA  54   0.919  -0.770   4.080
  437    HA   ALA  54           HA       ALA  54   0.161  -3.185   5.325
  438   1HB   ALA  54          1HB       ALA  54  -0.776  -2.313   3.223
  439   2HB   ALA  54          2HB       ALA  54   0.764  -2.644   2.412
  440   3HB   ALA  54          3HB       ALA  54  -0.200  -3.992   3.062
  441    H    VAL  55           H        VAL  55   3.359  -2.133   4.395
  442    HA   VAL  55           HA       VAL  55   4.480  -4.731   4.118
  443    HB   VAL  55           HB       VAL  55   5.545  -2.515   3.530
  444   1HG1  VAL  55          1HG2      VAL  55   5.163  -1.368   5.701
  445   2HG1  VAL  55          2HG2      VAL  55   6.221  -2.555   6.505
  446   3HG1  VAL  55          3HG2      VAL  55   6.889  -1.435   5.292
  447   1HG2  VAL  55          1HG1      VAL  55   7.090  -4.530   5.200
  448   2HG2  VAL  55          2HG1      VAL  55   6.725  -4.661   3.465
  449   3HG2  VAL  55          3HG1      VAL  55   7.816  -3.379   4.049
  450    H    SER  56           H        SER  56   3.004  -3.332   6.898
  451    HA   SER  56           HA       SER  56   4.721  -4.593   8.831
  452   1HB   SER  56          1HB       SER  56   1.892  -3.589   9.198
  453   2HB   SER  56          2HB       SER  56   3.130  -3.802  10.445
  454    HG   SER  56           HG       SER  56   3.114  -1.940   8.279
  455    H    THR  57           H        THR  57   4.493  -6.775   7.486
  456    HA   THR  57           HA       THR  57   2.501  -8.568   7.592
  457    HB   THR  57           HB       THR  57   5.301  -9.087   8.625
  458    HG1  THR  57           HG1      THR  57   4.453  -9.527   5.959
  459   1HG2  THR  57          1HG2      THR  57   4.926 -11.381   7.821
  460   2HG2  THR  57          2HG2      THR  57   3.712 -10.925   9.039
  461   3HG2  THR  57          3HG2      THR  57   3.275 -10.943   7.314
  462    H    GLY  58           H        GLY  58   1.016  -8.920   9.011
  463   1HA   GLY  58          1HA       GLY  58   0.144 -10.164  10.807
  464   2HA   GLY  58          2HA       GLY  58   1.621  -9.916  11.726
  465    H    THR  59           H        THR  59   0.309  -7.053  10.166
  466    HA   THR  59           HA       THR  59  -0.669  -6.250  12.862
  467    HB   THR  59           HB       THR  59  -0.301  -4.387  10.493
  468    HG1  THR  59           HG1      THR  59   1.672  -5.486  10.971
  469   1HG2  THR  59          1HG2      THR  59  -0.027  -2.713  12.310
  470   2HG2  THR  59          2HG2      THR  59  -1.576  -3.572  12.477
  471   3HG2  THR  59          3HG2      THR  59  -0.198  -4.007  13.516
  472    H    GLU  60           H        GLU  60  -2.900  -5.972  13.173
  473    HA   GLU  60           HA       GLU  60  -4.630  -6.800  11.016
  474   1HB   GLU  60          1HB       GLU  60  -5.534  -5.452  13.575
  475   2HB   GLU  60          2HB       GLU  60  -6.413  -6.604  12.536
  476   1HG   GLU  60          1HG       GLU  60  -3.971  -7.242  14.249
  477   2HG   GLU  60          2HG       GLU  60  -5.645  -7.744  14.563
  478    H    VAL  61           H        VAL  61  -4.834  -5.551   9.306
  479    HA   VAL  61           HA       VAL  61  -5.282  -2.635   9.746
  480    HB   VAL  61           HB       VAL  61  -4.056  -2.262   7.616
  481   1HG1  VAL  61          1HG1      VAL  61  -2.741  -2.371   9.774
  482   2HG1  VAL  61          2HG1      VAL  61  -2.507  -4.110   9.490
  483   3HG1  VAL  61          3HG1      VAL  61  -1.804  -2.919   8.367
  484   1HG2  VAL  61          1HG2      VAL  61  -3.634  -5.262   7.827
  485   2HG2  VAL  61          2HG2      VAL  61  -4.613  -4.431   6.586
  486   3HG2  VAL  61          3HG2      VAL  61  -2.834  -4.197   6.637
  487    H    THR  62           H        THR  62  -7.032  -1.757   8.778
  488    HA   THR  62           HA       THR  62  -8.948  -3.549   7.556
  489    HB   THR  62           HB       THR  62  -9.126  -0.536   7.651
  490    HG1  THR  62           HG1      THR  62  -9.653  -0.668   9.768
  491   1HG2  THR  62          1HG2      THR  62 -11.526  -1.058   8.102
  492   2HG2  THR  62          2HG2      THR  62 -10.994  -1.785   6.580
  493   3HG2  THR  62          3HG2      THR  62 -11.150  -2.794   8.035
  494    H    LEU  63           H        LEU  63  -8.869  -4.153   5.422
  495    HA   LEU  63           HA       LEU  63  -7.520  -2.383   3.515
  496   1HB   LEU  63          1HB       LEU  63  -7.387  -4.936   3.621
  497   2HB   LEU  63          2HB       LEU  63  -9.039  -4.960   2.968
  498    HG   LEU  63           HG       LEU  63  -7.217  -5.229   1.311
  499   1HD1  LEU  63          1HD1      LEU  63  -9.447  -4.300   0.663
  500   2HD1  LEU  63          2HD1      LEU  63  -8.782  -2.656   0.866
  501   3HD1  LEU  63          3HD1      LEU  63  -8.123  -3.737  -0.382
  502   1HD2  LEU  63          1HD2      LEU  63  -5.596  -3.660   2.390
  503   2HD2  LEU  63          2HD2      LEU  63  -5.835  -3.312   0.661
  504   3HD2  LEU  63          3HD2      LEU  63  -6.626  -2.295   1.886
  505    H    ILE  64           H        ILE  64  -8.546  -0.768   2.763
  506    HA   ILE  64           HA       ILE  64 -11.520  -0.649   2.658
  507    HB   ILE  64           HB       ILE  64  -9.519   1.588   2.208
  508   1HG1  ILE  64          1HG1      ILE  64 -10.641   0.769   4.894
  509   2HG1  ILE  64          2HG1      ILE  64  -8.931   0.913   4.437
  510   1HG2  ILE  64          1HG2      ILE  64 -12.431   1.567   3.049
  511   2HG2  ILE  64          2HG2      ILE  64 -11.404   3.022   2.918
  512   3HG2  ILE  64          3HG2      ILE  64 -11.769   2.055   1.473
  513   1HD1  ILE  64          1HD1      ILE  64 -11.002   3.158   4.402
  514   2HD1  ILE  64          2HD1      ILE  64  -9.808   2.920   5.696
  515   3HD1  ILE  64          3HD1      ILE  64  -9.271   3.340   4.046
  516    H    ALA  65           H        ALA  65 -12.424   0.414   0.805
  517    HA   ALA  65           HA       ALA  65 -10.901   1.400  -1.375
  518   1HB   ALA  65          1HB       ALA  65 -12.685  -1.076  -1.838
  519   2HB   ALA  65          2HB       ALA  65 -11.907  -0.121  -3.121
  520   3HB   ALA  65          3HB       ALA  65 -10.913  -1.097  -2.014
  521    H    GLN  66           H        GLN  66 -11.588   2.982  -1.991
  522    HA   GLN  66           HA       GLN  66 -14.468   3.397  -1.560
  523   1HB   GLN  66          1HB       GLN  66 -13.960   5.175  -0.394
  524   2HB   GLN  66          2HB       GLN  66 -12.490   4.325  -0.078
  525   1HG   GLN  66          1HG       GLN  66 -11.172   5.729  -1.286
  526   2HG   GLN  66          2HG       GLN  66 -12.485   6.184  -2.408
  527   1HE2  GLN  66          2HE2      GLN  66 -10.841   8.208  -1.286
  528   2HE2  GLN  66          1HE2      GLN  66 -11.800   9.125  -0.146
  529    H    GLY  67           H        GLY  67 -14.653   2.481  -3.617
  530   1HA   GLY  67          1HA       GLY  67 -14.564   4.391  -5.857
  531   2HA   GLY  67          2HA       GLY  67 -13.571   2.961  -5.991
  532    H    GLU  68           H        GLU  68 -15.068   2.806  -7.825
  533    HA   GLU  68           HA       GLU  68 -17.693   1.889  -7.838
  534   1HB   GLU  68          1HB       GLU  68 -15.325   0.800  -9.421
  535   2HB   GLU  68          2HB       GLU  68 -17.033   0.683  -9.875
  536   1HG   GLU  68          1HG       GLU  68 -15.471   3.288  -9.583
  537   2HG   GLU  68          2HG       GLU  68 -15.948   2.519 -11.113
  538    H    ASP  69           H        ASP  69 -14.683   0.087  -6.975
  539    HA   ASP  69           HA       ASP  69 -16.383  -2.268  -6.251
  540   1HB   ASP  69          1HB       ASP  69 -13.480  -2.405  -6.879
  541   2HB   ASP  69          2HB       ASP  69 -14.657  -3.707  -6.820
  542    H    GLU  70           H        GLU  70 -16.388  -0.174  -4.490
  543    HA   GLU  70           HA       GLU  70 -14.154  -0.090  -2.797
  544   1HB   GLU  70          1HB       GLU  70 -15.882   0.615  -1.084
  545   2HB   GLU  70          2HB       GLU  70 -15.790   1.580  -2.561
  546   1HG   GLU  70          1HG       GLU  70 -17.885   1.218  -3.135
  547   2HG   GLU  70          2HG       GLU  70 -17.770  -0.529  -2.862
  548    H    GLN  71           H        GLN  71 -17.208  -1.699  -1.900
  549    HA   GLN  71           HA       GLN  71 -16.262  -3.438   0.002
  550   1HB   GLN  71          1HB       GLN  71 -18.580  -3.415  -1.891
  551   2HB   GLN  71          2HB       GLN  71 -18.218  -4.933  -1.042
  552   1HG   GLN  71          1HG       GLN  71 -18.546  -2.245   0.339
  553   2HG   GLN  71          2HG       GLN  71 -19.770  -3.530   0.284
  554   1HE2  GLN  71          2HE2      GLN  71 -17.394  -5.587   0.405
  555   2HE2  GLN  71          1HE2      GLN  71 -17.090  -5.635   2.134
  556    H    GLU  72           H        GLU  72 -16.332  -4.025  -3.530
  557    HA   GLU  72           HA       GLU  72 -15.606  -6.758  -3.396
  558   1HB   GLU  72          1HB       GLU  72 -16.523  -5.869  -5.446
  559   2HB   GLU  72          2HB       GLU  72 -15.393  -4.494  -5.436
  560   1HG   GLU  72          1HG       GLU  72 -14.749  -5.996  -7.159
  561   2HG   GLU  72          2HG       GLU  72 -13.515  -6.032  -5.891
  562    H    ALA  73           H        ALA  73 -13.676  -3.732  -3.879
  563    HA   ALA  73           HA       ALA  73 -11.166  -4.993  -4.118
  564   1HB   ALA  73          1HB       ALA  73 -11.883  -2.743  -4.795
  565   2HB   ALA  73          2HB       ALA  73 -12.139  -2.296  -3.116
  566   3HB   ALA  73          3HB       ALA  73 -10.466  -2.611  -3.699
  567    H    LEU  74           H        LEU  74 -12.635  -3.266  -1.366
  568    HA   LEU  74           HA       LEU  74 -10.631  -3.663   0.518
  569   1HB   LEU  74          1HB       LEU  74 -12.328  -2.977   2.115
  570   2HB   LEU  74          2HB       LEU  74 -12.479  -2.098   0.571
  571    HG   LEU  74           HG       LEU  74 -14.202  -3.974  -0.043
  572   1HD1  LEU  74          1HD2      LEU  74 -14.361  -3.824   2.993
  573   2HD1  LEU  74          2HD2      LEU  74 -15.541  -4.624   1.918
  574   3HD1  LEU  74          3HD2      LEU  74 -13.882  -5.265   2.047
  575   1HD2  LEU  74          1HD1      LEU  74 -14.804  -1.697   1.873
  576   2HD2  LEU  74          2HD1      LEU  74 -14.655  -1.570   0.109
  577   3HD2  LEU  74          3HD1      LEU  74 -15.984  -2.507   0.817
  578    H    GLU  75           H        GLU  75 -13.495  -5.798  -0.091
  579    HA   GLU  75           HA       GLU  75 -12.862  -7.623   1.981
  580   1HB   GLU  75          1HB       GLU  75 -14.318  -8.099  -0.644
  581   2HB   GLU  75          2HB       GLU  75 -14.300  -9.200   0.757
  582   1HG   GLU  75          1HG       GLU  75 -15.352  -6.353   0.786
  583   2HG   GLU  75          2HG       GLU  75 -16.344  -7.823   0.705
  584    H    LYS  76           H        LYS  76 -12.072  -7.909  -1.592
  585    HA   LYS  76           HA       LYS  76 -10.848 -10.473  -1.020
  586   1HB   LYS  76          1HB       LYS  76  -9.865 -10.234  -3.309
  587   2HB   LYS  76          2HB       LYS  76 -11.641 -10.245  -3.214
  588   1HG   LYS  76          1HG       LYS  76 -11.719  -7.835  -3.499
  589   2HG   LYS  76          2HG       LYS  76  -9.941  -7.718  -3.477
  590   1HD   LYS  76          1HD       LYS  76 -11.325  -9.609  -5.407
  591   2HD   LYS  76          2HD       LYS  76 -11.310  -7.879  -5.737
  592   1HE   LYS  76          1HE       LYS  76  -9.444  -8.881  -6.900
  593   2HE   LYS  76          2HE       LYS  76  -8.819  -7.847  -5.610
  594   1HZ   LYS  76          1HZ       LYS  76  -9.134 -10.765  -5.434
  595   2HZ   LYS  76          2HZ       LYS  76  -7.717  -9.985  -5.756
  596   3HZ   LYS  76          3HZ       LYS  76  -8.457  -9.788  -4.289
  597    H    LEU  77           H        LEU  77  -9.580  -7.157  -1.285
  598    HA   LEU  77           HA       LEU  77  -6.852  -8.067  -1.245
  599   1HB   LEU  77          1HB       LEU  77  -8.117  -5.391  -0.662
  600   2HB   LEU  77          2HB       LEU  77  -6.353  -5.708  -0.604
  601    HG   LEU  77           HG       LEU  77  -6.813  -4.863  -2.816
  602   1HD1  LEU  77          1HD2      LEU  77  -5.211  -6.750  -2.546
  603   2HD1  LEU  77          2HD2      LEU  77  -6.569  -7.888  -2.821
  604   3HD1  LEU  77          3HD2      LEU  77  -6.057  -6.782  -4.124
  605   1HD2  LEU  77          1HD1      LEU  77  -8.703  -7.226  -3.086
  606   2HD2  LEU  77          2HD1      LEU  77  -9.216  -5.522  -3.027
  607   3HD2  LEU  77          3HD1      LEU  77  -8.232  -6.116  -4.400
  608    H    ALA  78           H        ALA  78  -9.041  -6.896   1.429
  609    HA   ALA  78           HA       ALA  78  -7.043  -7.325   3.443
  610   1HB   ALA  78          1HB       ALA  78 -10.072  -7.505   3.697
  611   2HB   ALA  78          2HB       ALA  78  -8.912  -7.399   5.038
  612   3HB   ALA  78          3HB       ALA  78  -9.086  -6.036   3.922
  613    H    ALA  79           H        ALA  79  -9.368  -9.498   1.855
  614    HA   ALA  79           HA       ALA  79  -9.089 -11.823   3.432
  615   1HB   ALA  79          1HB       ALA  79 -10.589 -11.452   1.404
  616   2HB   ALA  79          2HB       ALA  79  -9.114 -11.580   0.396
  617   3HB   ALA  79          3HB       ALA  79  -9.669 -12.984   1.344
  618    H    TYR  80           H        TYR  80  -7.343 -10.761   0.550
  619    HA   TYR  80           HA       TYR  80  -5.385 -12.715   0.282
  620   1HB   TYR  80          1HB       TYR  80  -5.952 -10.983  -1.338
  621   2HB   TYR  80          2HB       TYR  80  -5.423  -9.728  -0.228
  622    HD1  TYR  80           HD1      TYR  80  -3.187  -9.057   0.068
  623    HD2  TYR  80           HD2      TYR  80  -4.049 -12.628  -2.173
  624    HE1  TYR  80           HE1      TYR  80  -0.757  -9.539  -0.103
  625    HE2  TYR  80           HE2      TYR  80  -1.618 -13.070  -2.390
  626    HH   TYR  80           HH       TYR  80   0.863 -11.109  -0.753
  627    H    VAL  81           H        VAL  81  -5.227  -9.673   2.218
  628    HA   VAL  81           HA       VAL  81  -2.411  -9.931   2.669
  629    HB   VAL  81           HB       VAL  81  -2.611  -8.101   4.145
  630   1HG1  VAL  81          1HG1      VAL  81  -3.322  -7.587   1.804
  631   2HG1  VAL  81          2HG1      VAL  81  -4.993  -7.959   2.269
  632   3HG1  VAL  81          3HG1      VAL  81  -4.170  -6.561   3.002
  633   1HG2  VAL  81          1HG2      VAL  81  -5.521  -8.934   4.462
  634   2HG2  VAL  81          2HG2      VAL  81  -4.247  -9.109   5.679
  635   3HG2  VAL  81          3HG2      VAL  81  -4.799  -7.485   5.201
  636    H    GLN  82           H        GLN  82  -5.247 -11.295   4.344
  637    HA   GLN  82           HA       GLN  82  -3.362 -11.926   6.507
  638   1HB   GLN  82          1HB       GLN  82  -5.283 -11.859   7.852
  639   2HB   GLN  82          2HB       GLN  82  -5.442 -10.541   6.696
  640   1HG   GLN  82          1HG       GLN  82  -7.066 -11.906   5.406
  641   2HG   GLN  82          2HG       GLN  82  -6.699 -13.278   6.435
  642   1HE2  GLN  82          2HE2      GLN  82  -9.233 -11.917   6.090
  643   2HE2  GLN  82          1HE2      GLN  82  -9.775 -11.408   7.691
  644    H    GLU  83           H        GLU  83  -5.578 -13.435   4.297
  645    HA   GLU  83           HA       GLU  83  -6.675 -15.575   5.368
  646   1HB   GLU  83          1HB       GLU  83  -6.653 -14.518   3.110
  647   2HB   GLU  83          2HB       GLU  83  -5.369 -15.675   2.639
  648   1HG   GLU  83          1HG       GLU  83  -8.104 -16.468   3.742
  649   2HG   GLU  83          2HG       GLU  83  -7.704 -16.400   2.016
  650    H    GLU  84           H        GLU  84  -3.584 -16.171   3.647
  651    HA   GLU  84           HA       GLU  84  -3.315 -18.644   5.257
  652   1HB   GLU  84          1HB       GLU  84  -1.547 -19.149   3.546
  653   2HB   GLU  84          2HB       GLU  84  -3.177 -18.953   2.886
  654   1HG   GLU  84          1HG       GLU  84  -1.390 -16.516   2.897
  655   2HG   GLU  84          2HG       GLU  84  -1.067 -17.819   1.736
  656    H    VAL  85           H        VAL  85  -0.440 -17.536   4.017
  657    HA   VAL  85           HA       VAL  85   0.632 -15.791   6.141
  658    HB   VAL  85           HB       VAL  85   2.619 -17.101   6.478
  659   1HG1  VAL  85          1HG1      VAL  85   0.361 -19.172   6.950
  660   2HG1  VAL  85          2HG1      VAL  85   2.005 -19.251   7.632
  661   3HG1  VAL  85          3HG1      VAL  85   0.928 -17.954   8.117
  662   1HG2  VAL  85          1HG2      VAL  85   2.816 -18.170   4.188
  663   2HG2  VAL  85          2HG2      VAL  85   3.135 -19.321   5.490
  664   3HG2  VAL  85          3HG2      VAL  85   1.571 -19.361   4.635
  Start of MODEL    6
    1   1H    VAL   2          1H        VAL   2 -16.405   6.376  -2.128
    2   2H    VAL   2          2H        VAL   2 -16.882   5.170  -3.199
    3   3H    VAL   2          3H        VAL   2 -17.901   6.472  -2.890
    4    HA   VAL   2           HA       VAL   2 -18.172   5.807  -0.634
    5    HB   VAL   2           HB       VAL   2 -19.400   3.682  -1.052
    6   1HG1  VAL   2          1HG1      VAL   2 -20.406   5.882  -1.564
    7   2HG1  VAL   2          2HG1      VAL   2 -19.718   5.816  -3.204
    8   3HG1  VAL   2          3HG1      VAL   2 -20.959   4.640  -2.710
    9   1HG2  VAL   2          1HG2      VAL   2 -17.809   2.676  -2.666
   10   2HG2  VAL   2          2HG2      VAL   2 -19.461   2.749  -3.329
   11   3HG2  VAL   2          3HG2      VAL   2 -18.233   3.925  -3.857
   12    H    GLN   3           H        GLN   3 -17.099   5.030   1.128
   13    HA   GLN   3           HA       GLN   3 -14.847   3.236   0.462
   14   1HB   GLN   3          1HB       GLN   3 -14.338   5.475   1.447
   15   2HB   GLN   3          2HB       GLN   3 -15.206   4.981   2.928
   16   1HG   GLN   3          1HG       GLN   3 -13.685   3.026   3.148
   17   2HG   GLN   3          2HG       GLN   3 -12.859   3.522   1.652
   18   1HE2  GLN   3          2HE2      GLN   3 -13.775   4.906   4.872
   19   2HE2  GLN   3          1HE2      GLN   3 -12.260   5.762   5.073
   20    H    GLN   4           H        GLN   4 -14.733   1.227   1.129
   21    HA   GLN   4           HA       GLN   4 -16.001   0.527   3.687
   22   1HB   GLN   4          1HB       GLN   4 -17.037  -0.402   1.225
   23   2HB   GLN   4          2HB       GLN   4 -16.016  -1.725   1.820
   24   1HG   GLN   4          1HG       GLN   4 -18.230  -0.332   3.380
   25   2HG   GLN   4          2HG       GLN   4 -18.315  -1.967   2.675
   26   1HE2  GLN   4          2HE2      GLN   4 -17.143  -3.700   3.689
   27   2HE2  GLN   4          1HE2      GLN   4 -16.163  -3.430   5.150
   28    H    LYS   5           H        LYS   5 -14.794  -1.189   4.766
   29    HA   LYS   5           HA       LYS   5 -12.353  -2.192   3.517
   30   1HB   LYS   5          1HB       LYS   5 -11.082  -1.623   5.570
   31   2HB   LYS   5          2HB       LYS   5 -11.547  -0.207   4.614
   32   1HG   LYS   5          1HG       LYS   5 -13.192  -1.145   6.978
   33   2HG   LYS   5          2HG       LYS   5 -11.801  -0.041   7.166
   34   1HD   LYS   5          1HD       LYS   5 -12.791   1.649   5.831
   35   2HD   LYS   5          2HD       LYS   5 -14.056   0.554   5.234
   36   1HE   LYS   5          1HE       LYS   5 -13.735   1.441   8.132
   37   2HE   LYS   5          2HE       LYS   5 -14.920   2.090   6.979
   38   1HZ   LYS   5          1HZ       LYS   5 -15.840  -0.116   6.778
   39   2HZ   LYS   5          2HZ       LYS   5 -14.774  -0.701   7.887
   40   3HZ   LYS   5          3HZ       LYS   5 -15.897   0.416   8.338
   41    H    VAL   6           H        VAL   6 -11.519  -3.974   4.643
   42    HA   VAL   6           HA       VAL   6 -13.200  -5.191   6.756
   43    HB   VAL   6           HB       VAL   6 -12.689  -7.428   5.473
   44   1HG1  VAL   6          1HG2      VAL   6 -14.772  -5.398   4.564
   45   2HG1  VAL   6          2HG2      VAL   6 -14.872  -7.160   4.317
   46   3HG1  VAL   6          3HG2      VAL   6 -14.914  -6.486   5.964
   47   1HG2  VAL   6          1HG1      VAL   6 -11.336  -6.351   3.646
   48   2HG2  VAL   6          2HG1      VAL   6 -12.791  -7.160   3.015
   49   3HG2  VAL   6          3HG1      VAL   6 -12.757  -5.390   3.195
   50    H    GLU   7           H        GLU   7 -11.916  -6.379   8.288
   51    HA   GLU   7           HA       GLU   7  -9.160  -5.415   8.097
   52   1HB   GLU   7          1HB       GLU   7 -11.016  -6.380  10.287
   53   2HB   GLU   7          2HB       GLU   7  -9.277  -6.643  10.544
   54   1HG   GLU   7          1HG       GLU   7 -10.358  -3.921   9.787
   55   2HG   GLU   7          2HG       GLU   7 -10.183  -4.465  11.468
   56    H    VAL   8           H        VAL   8  -7.316  -6.549   8.801
   57    HA   VAL   8           HA       VAL   8  -7.288  -9.454   8.585
   58    HB   VAL   8           HB       VAL   8  -6.654  -9.670   6.433
   59   1HG1  VAL   8          1HG2      VAL   8  -7.199  -6.695   6.184
   60   2HG1  VAL   8          2HG2      VAL   8  -7.031  -7.852   4.834
   61   3HG1  VAL   8          3HG2      VAL   8  -8.379  -8.017   5.981
   62   1HG2  VAL   8          1HG1      VAL   8  -4.794  -7.301   6.813
   63   2HG2  VAL   8          2HG1      VAL   8  -4.373  -9.026   6.956
   64   3HG2  VAL   8          3HG1      VAL   8  -4.830  -8.354   5.378
   65    H    ARG   9           H        ARG   9  -5.177 -10.314   9.140
   66    HA   ARG   9           HA       ARG   9  -3.267  -8.214  10.108
   67   1HB   ARG   9          1HB       ARG   9  -3.210  -9.929  11.699
   68   2HB   ARG   9          2HB       ARG   9  -3.344 -11.232  10.474
   69   1HG   ARG   9          1HG       ARG   9  -0.955  -9.413  10.578
   70   2HG   ARG   9          2HG       ARG   9  -1.065 -10.826  11.638
   71   1HD   ARG   9          1HD       ARG   9  -1.426 -11.069   8.624
   72   2HD   ARG   9          2HD       ARG   9   0.149 -11.190   9.422
   73    HE   ARG   9           HE       ARG   9  -0.571 -13.147  10.578
   74   1HH1  ARG   9          2HH1      ARG   9  -2.901 -12.046   8.132
   75   2HH1  ARG   9          1HH1      ARG   9  -3.415 -13.676   7.734
   76   1HH2  ARG   9          1HH2      ARG   9  -1.289 -15.254  10.047
   77   2HH2  ARG   9          2HH2      ARG   9  -2.513 -15.484   8.825
   78    H    LEU  10           H        LEU  10  -1.827  -7.507   8.642
   79    HA   LEU  10           HA       LEU  10  -1.910  -8.462   5.969
   80   1HB   LEU  10          1HB       LEU  10  -1.184  -6.142   7.086
   81   2HB   LEU  10          2HB       LEU  10   0.424  -6.898   7.048
   82    HG   LEU  10           HG       LEU  10   0.528  -6.027   4.963
   83   1HD1  LEU  10          1HD1      LEU  10   0.283  -8.435   4.589
   84   2HD1  LEU  10          2HD1      LEU  10  -1.474  -8.238   4.349
   85   3HD1  LEU  10          3HD1      LEU  10  -0.324  -7.491   3.202
   86   1HD2  LEU  10          1HD2      LEU  10  -1.526  -4.678   5.315
   87   2HD2  LEU  10          2HD2      LEU  10  -1.444  -5.309   3.653
   88   3HD2  LEU  10          3HD2      LEU  10  -2.525  -6.076   4.844
   89    H    LYS  11           H        LYS  11  -1.536 -10.654   6.051
   90    HA   LYS  11           HA       LYS  11   0.807 -11.862   7.205
   91   1HB   LYS  11          1HB       LYS  11  -1.164 -13.081   7.235
   92   2HB   LYS  11          2HB       LYS  11  -1.571 -12.678   5.558
   93   1HG   LYS  11          1HG       LYS  11   0.751 -14.463   6.232
   94   2HG   LYS  11          2HG       LYS  11  -0.905 -15.044   5.953
   95   1HD   LYS  11          1HD       LYS  11   0.951 -13.624   4.046
   96   2HD   LYS  11          2HD       LYS  11   0.044 -15.118   3.768
   97   1HE   LYS  11          1HE       LYS  11  -1.333 -12.410   4.164
   98   2HE   LYS  11          2HE       LYS  11  -0.773 -12.997   2.570
   99   1HZ   LYS  11          1HZ       LYS  11  -2.606 -14.406   4.284
  100   2HZ   LYS  11          2HZ       LYS  11  -3.033 -13.515   2.950
  101   3HZ   LYS  11          3HZ       LYS  11  -2.129 -14.880   2.787
  102    H    THR  12           H        THR  12   0.070 -10.578   3.944
  103    HA   THR  12           HA       THR  12   2.490 -11.771   2.747
  104    HB   THR  12           HB       THR  12   2.218  -9.901   1.109
  105    HG1  THR  12           HG1      THR  12   0.245  -8.727   1.239
  106   1HG2  THR  12          1HG2      THR  12   0.091 -10.701   0.110
  107   2HG2  THR  12          2HG2      THR  12   1.062 -12.065   0.712
  108   3HG2  THR  12          3HG2      THR  12  -0.336 -11.486   1.651
  109    H    GLY  13           H        GLY  13   1.426  -8.638   3.761
  110   1HA   GLY  13          1HA       GLY  13   2.301  -6.879   5.019
  111   2HA   GLY  13          2HA       GLY  13   3.702  -7.870   5.479
  112    H    LEU  14           H        LEU  14   2.318  -7.424   2.330
  113    HA   LEU  14           HA       LEU  14   3.176  -6.721   0.329
  114   1HB   LEU  14          1HB       LEU  14   2.845  -4.447   2.189
  115   2HB   LEU  14          2HB       LEU  14   3.452  -4.139   0.542
  116    HG   LEU  14           HG       LEU  14   1.598  -5.656  -0.333
  117   1HD1  LEU  14          1HD2      LEU  14   0.504  -5.271   2.477
  118   2HD1  LEU  14          2HD2      LEU  14  -0.417  -5.912   1.096
  119   3HD1  LEU  14          3HD2      LEU  14   0.984  -6.809   1.725
  120   1HD2  LEU  14          1HD1      LEU  14   0.731  -3.106   1.055
  121   2HD2  LEU  14          2HD1      LEU  14   1.410  -3.254  -0.582
  122   3HD2  LEU  14          3HD1      LEU  14  -0.179  -3.962  -0.210
  123    H    GLN  15           H        GLN  15   4.958  -8.145   1.013
  124    HA   GLN  15           HA       GLN  15   7.563  -6.789   1.353
  125   1HB   GLN  15          1HB       GLN  15   6.731  -9.705   1.417
  126   2HB   GLN  15          2HB       GLN  15   8.385  -9.127   1.736
  127   1HG   GLN  15          1HG       GLN  15   5.974  -8.097   3.273
  128   2HG   GLN  15          2HG       GLN  15   6.908  -9.519   3.794
  129   1HE2  GLN  15          2HE2      GLN  15   6.557  -6.395   4.581
  130   2HE2  GLN  15          1HE2      GLN  15   8.217  -5.999   4.992
  131    H    ALA  16           H        ALA  16   6.412  -9.482  -0.879
  132    HA   ALA  16           HA       ALA  16   8.471  -8.364  -2.722
  133   1HB   ALA  16          1HB       ALA  16   9.388 -10.284  -1.502
  134   2HB   ALA  16          2HB       ALA  16   8.024 -11.291  -2.049
  135   3HB   ALA  16          3HB       ALA  16   9.191 -10.654  -3.233
  136    H    ARG  17           H        ARG  17   5.410 -10.272  -2.471
  137    HA   ARG  17           HA       ARG  17   5.027  -9.447  -5.272
  138   1HB   ARG  17          1HB       ARG  17   6.317 -11.498  -5.529
  139   2HB   ARG  17          2HB       ARG  17   5.040 -12.419  -4.693
  140   1HG   ARG  17          1HG       ARG  17   4.839 -12.472  -7.219
  141   2HG   ARG  17          2HG       ARG  17   3.413 -11.778  -6.415
  142   1HD   ARG  17          1HD       ARG  17   4.365  -9.483  -6.786
  143   2HD   ARG  17          2HD       ARG  17   5.698 -10.217  -7.688
  144    HE   ARG  17           HE       ARG  17   4.216 -10.715  -9.453
  145   1HH1  ARG  17          1HH2      ARG  17   2.451  -9.302  -6.678
  146   2HH1  ARG  17          2HH2      ARG  17   1.113  -8.793  -7.692
  147   1HH2  ARG  17          2HH1      ARG  17   2.355 -10.040 -10.691
  148   2HH2  ARG  17          1HH1      ARG  17   1.041  -9.223  -9.855
  149    HA   PRO  18           HA       PRO  18   0.775 -11.466  -3.748
  150   1HB   PRO  18          1HB       PRO  18   0.710 -11.914  -1.044
  151   2HB   PRO  18          2HB       PRO  18   1.338 -13.176  -2.157
  152   1HG   PRO  18          1HG       PRO  18   2.979 -10.951  -0.857
  153   2HG   PRO  18          2HG       PRO  18   3.307 -12.642  -0.555
  154   1HD   PRO  18          1HD       PRO  18   4.656 -11.572  -2.443
  155   2HD   PRO  18          2HD       PRO  18   3.706 -13.001  -2.980
  156    H    ALA  19           H        ALA  19   2.941  -9.570  -1.781
  157    HA   ALA  19           HA       ALA  19   1.487  -7.602  -0.569
  158   1HB   ALA  19          1HB       ALA  19   4.051  -7.783  -2.198
  159   2HB   ALA  19          2HB       ALA  19   3.754  -6.517  -0.955
  160   3HB   ALA  19          3HB       ALA  19   3.847  -8.249  -0.505
  161    H    ALA  20           H        ALA  20   2.791  -7.654  -3.913
  162    HA   ALA  20           HA       ALA  20   1.468  -5.088  -4.704
  163   1HB   ALA  20          1HB       ALA  20   3.027  -7.223  -6.258
  164   2HB   ALA  20          2HB       ALA  20   2.494  -5.651  -6.899
  165   3HB   ALA  20          3HB       ALA  20   3.731  -5.715  -5.617
  166    H    LEU  21           H        LEU  21   0.983  -8.605  -4.817
  167    HA   LEU  21           HA       LEU  21  -1.130  -8.719  -6.697
  168   1HB   LEU  21          1HB       LEU  21   0.029 -10.569  -5.291
  169   2HB   LEU  21          2HB       LEU  21  -1.165 -10.184  -4.041
  170    HG   LEU  21           HG       LEU  21  -1.780 -11.035  -6.910
  171   1HD1  LEU  21          1HD1      LEU  21  -0.827 -12.834  -5.505
  172   2HD1  LEU  21          2HD1      LEU  21  -2.039 -12.496  -4.247
  173   3HD1  LEU  21          3HD1      LEU  21  -2.553 -13.127  -5.831
  174   1HD2  LEU  21          1HD2      LEU  21  -3.626 -10.605  -4.519
  175   2HD2  LEU  21          2HD2      LEU  21  -3.524  -9.554  -5.953
  176   3HD2  LEU  21          3HD2      LEU  21  -4.110 -11.225  -6.118
  177    H    PHE  22           H        PHE  22  -1.168  -8.169  -3.205
  178    HA   PHE  22           HA       PHE  22  -3.747  -7.345  -2.620
  179   1HB   PHE  22          1HB       PHE  22  -2.012  -7.589  -0.957
  180   2HB   PHE  22          2HB       PHE  22  -0.992  -6.404  -1.768
  181    HD1  PHE  22           HD1      PHE  22  -3.189  -6.909   0.935
  182    HD2  PHE  22           HD2      PHE  22  -1.773  -3.937  -1.830
  183    HE1  PHE  22           HE1      PHE  22  -3.652  -5.133   2.604
  184    HE2  PHE  22           HE2      PHE  22  -2.257  -2.162  -0.210
  185    HZ   PHE  22           HZ       PHE  22  -3.209  -2.745   2.041
  186    H    VAL  23           H        VAL  23  -1.048  -5.046  -3.419
  187    HA   VAL  23           HA       VAL  23  -2.738  -2.840  -3.658
  188    HB   VAL  23           HB       VAL  23  -0.902  -1.741  -4.718
  189   1HG1  VAL  23          1HG1      VAL  23  -0.562  -2.098  -2.369
  190   2HG1  VAL  23          2HG1      VAL  23   0.277  -3.637  -2.709
  191   3HG1  VAL  23          3HG1      VAL  23   0.954  -2.089  -3.272
  192   1HG2  VAL  23          1HG2      VAL  23  -0.685  -3.217  -6.452
  193   2HG2  VAL  23          2HG2      VAL  23   0.913  -2.820  -5.776
  194   3HG2  VAL  23          3HG2      VAL  23   0.119  -4.415  -5.429
  195    H    GLN  24           H        GLN  24  -1.933  -5.255  -6.133
  196    HA   GLN  24           HA       GLN  24  -2.846  -3.637  -8.353
  197   1HB   GLN  24          1HB       GLN  24  -2.457  -5.612  -9.713
  198   2HB   GLN  24          2HB       GLN  24  -1.047  -5.257  -8.687
  199   1HG   GLN  24          1HG       GLN  24  -1.647  -6.992  -7.139
  200   2HG   GLN  24          2HG       GLN  24  -3.207  -7.261  -7.932
  201   1HE2  GLN  24          2HE2      GLN  24  -3.251  -8.234 -10.056
  202   2HE2  GLN  24          1HE2      GLN  24  -1.919  -9.258 -10.558
  203    H    GLU  25           H        GLU  25  -4.248  -6.254  -6.390
  204    HA   GLU  25           HA       GLU  25  -6.628  -6.422  -8.066
  205   1HB   GLU  25          1HB       GLU  25  -7.540  -7.730  -6.096
  206   2HB   GLU  25          2HB       GLU  25  -6.050  -8.394  -6.792
  207   1HG   GLU  25          1HG       GLU  25  -4.708  -7.391  -5.027
  208   2HG   GLU  25          2HG       GLU  25  -6.130  -6.590  -4.345
  209    H    ALA  26           H        ALA  26  -5.646  -4.793  -5.053
  210    HA   ALA  26           HA       ALA  26  -8.025  -3.331  -4.537
  211   1HB   ALA  26          1HB       ALA  26  -5.084  -2.562  -4.368
  212   2HB   ALA  26          2HB       ALA  26  -6.406  -1.705  -3.543
  213   3HB   ALA  26          3HB       ALA  26  -6.004  -3.383  -3.078
  214    H    ASN  27           H        ASN  27  -5.088  -2.551  -6.368
  215    HA   ASN  27           HA       ASN  27  -5.537  -0.167  -7.545
  216   1HB   ASN  27          1HB       ASN  27  -3.876  -2.483  -7.837
  217   2HB   ASN  27          2HB       ASN  27  -4.502  -2.164  -9.448
  218   1HD2  ASN  27          2HD2      ASN  27  -2.513  -0.998  -6.822
  219   2HD2  ASN  27          1HD2      ASN  27  -1.699   0.307  -7.673
  220    H    ARG  28           H        ARG  28  -6.555  -3.368  -8.757
  221    HA   ARG  28           HA       ARG  28  -7.437  -2.314 -11.302
  222   1HB   ARG  28          1HB       ARG  28  -8.025  -4.940  -9.982
  223   2HB   ARG  28          2HB       ARG  28  -8.515  -4.468 -11.637
  224   1HG   ARG  28          1HG       ARG  28  -5.687  -4.374 -10.503
  225   2HG   ARG  28          2HG       ARG  28  -6.261  -5.549 -11.699
  226   1HD   ARG  28          1HD       ARG  28  -6.285  -3.989 -13.429
  227   2HD   ARG  28          2HD       ARG  28  -6.538  -2.630 -12.327
  228    HE   ARG  28           HE       ARG  28  -3.945  -4.012 -12.762
  229   1HH1  ARG  28          2HH1      ARG  28  -5.832  -1.205 -11.576
  230   2HH1  ARG  28          1HH1      ARG  28  -4.403  -0.337 -11.095
  231   1HH2  ARG  28          1HH2      ARG  28  -2.100  -2.768 -12.098
  232   2HH2  ARG  28          2HH2      ARG  28  -2.342  -1.199 -11.359
  233    H    PHE  29           H        PHE  29  -8.908  -2.200  -8.173
  234    HA   PHE  29           HA       PHE  29 -11.445  -1.719  -9.596
  235   1HB   PHE  29          1HB       PHE  29 -10.775  -2.002  -6.671
  236   2HB   PHE  29          2HB       PHE  29 -12.370  -1.486  -7.268
  237    HD1  PHE  29           HD1      PHE  29 -10.933  -4.244  -5.979
  238    HD2  PHE  29           HD2      PHE  29 -12.621  -3.096  -9.757
  239    HE1  PHE  29           HE1      PHE  29 -11.487  -6.620  -6.459
  240    HE2  PHE  29           HE2      PHE  29 -13.144  -5.462 -10.257
  241    HZ   PHE  29           HZ       PHE  29 -12.596  -7.233  -8.594
  242    H    THR  30           H        THR  30 -12.534   0.133  -9.187
  243    HA   THR  30           HA       THR  30 -10.914   2.453  -9.874
  244    HB   THR  30           HB       THR  30 -13.143   3.608  -9.972
  245    HG1  THR  30           HG1      THR  30 -14.228   1.057  -9.332
  246   1HG2  THR  30          1HG2      THR  30 -14.067   2.188 -11.792
  247   2HG2  THR  30          2HG2      THR  30 -12.298   2.338 -11.916
  248   3HG2  THR  30          3HG2      THR  30 -13.019   0.848 -11.270
  249    H    SER  31           H        SER  31 -12.389   1.240  -6.977
  250    HA   SER  31           HA       SER  31 -12.747   3.294  -5.289
  251   1HB   SER  31          1HB       SER  31 -11.336   0.689  -4.656
  252   2HB   SER  31          2HB       SER  31 -12.567   1.547  -3.691
  253    HG   SER  31           HG       SER  31 -13.565  -0.161  -4.735
  254    H    ASP  32           H        ASP  32 -11.649   4.611  -4.019
  255    HA   ASP  32           HA       ASP  32  -8.758   4.909  -4.281
  256   1HB   ASP  32          1HB       ASP  32 -10.766   6.018  -2.281
  257   2HB   ASP  32          2HB       ASP  32  -9.079   6.543  -2.428
  258    H    VAL  33           H        VAL  33  -8.170   2.756  -3.858
  259    HA   VAL  33           HA       VAL  33  -9.053   1.346  -1.553
  260    HB   VAL  33           HB       VAL  33  -6.725   0.857  -3.448
  261   1HG1  VAL  33          1HG1      VAL  33  -8.173  -0.954  -1.459
  262   2HG1  VAL  33          2HG1      VAL  33  -6.925  -1.483  -2.615
  263   3HG1  VAL  33          3HG1      VAL  33  -6.508  -0.357  -1.303
  264   1HG2  VAL  33          1HG2      VAL  33  -8.999   1.102  -4.419
  265   2HG2  VAL  33          2HG2      VAL  33  -8.449  -0.590  -4.533
  266   3HG2  VAL  33          3HG2      VAL  33  -9.622  -0.099  -3.273
  267    H    PHE  34           H        PHE  34  -8.204   0.980   0.356
  268    HA   PHE  34           HA       PHE  34  -5.785   2.513   1.079
  269   1HB   PHE  34          1HB       PHE  34  -8.480   2.794   2.448
  270   2HB   PHE  34          2HB       PHE  34  -6.944   3.381   3.104
  271    HD1  PHE  34           HD1      PHE  34  -9.727   4.790   1.981
  272    HD2  PHE  34           HD2      PHE  34  -5.626   4.453   0.718
  273    HE1  PHE  34           HE1      PHE  34 -10.009   6.777   0.528
  274    HE2  PHE  34           HE2      PHE  34  -5.912   6.463  -0.746
  275    HZ   PHE  34           HZ       PHE  34  -8.102   7.635  -0.811
  276    H    LEU  35           H        LEU  35  -4.803   1.876   3.037
  277    HA   LEU  35           HA       LEU  35  -5.853  -0.671   4.171
  278   1HB   LEU  35          1HB       LEU  35  -3.913  -1.207   2.683
  279   2HB   LEU  35          2HB       LEU  35  -2.905  -0.076   3.631
  280    HG   LEU  35           HG       LEU  35  -3.448  -1.361   5.697
  281   1HD1  LEU  35          1HD1      LEU  35  -5.662  -2.179   4.927
  282   2HD1  LEU  35          2HD1      LEU  35  -4.855  -3.233   3.742
  283   3HD1  LEU  35          3HD1      LEU  35  -4.636  -3.522   5.486
  284   1HD2  LEU  35          1HD2      LEU  35  -1.431  -1.956   4.389
  285   2HD2  LEU  35          2HD2      LEU  35  -2.143  -3.381   5.180
  286   3HD2  LEU  35          3HD2      LEU  35  -2.393  -3.113   3.439
  287    H    GLU  36           H        GLU  36  -6.024  -0.478   6.348
  288    HA   GLU  36           HA       GLU  36  -4.880   2.009   7.559
  289   1HB   GLU  36          1HB       GLU  36  -7.260   0.455   8.586
  290   2HB   GLU  36          2HB       GLU  36  -6.855   2.168   8.837
  291   1HG   GLU  36          1HG       GLU  36  -7.269   2.586   6.419
  292   2HG   GLU  36          2HG       GLU  36  -7.676   0.887   6.202
  293    H    LYS  37           H        LYS  37  -2.945   1.173   8.582
  294    HA   LYS  37           HA       LYS  37  -2.854  -1.441   9.878
  295   1HB   LYS  37          1HB       LYS  37  -1.071   1.008   9.835
  296   2HB   LYS  37          2HB       LYS  37  -0.805  -0.307  10.993
  297   1HG   LYS  37          1HG       LYS  37  -0.650  -1.963   9.212
  298   2HG   LYS  37          2HG       LYS  37  -0.824  -0.655   8.028
  299   1HD   LYS  37          1HD       LYS  37   1.592  -1.223   8.419
  300   2HD   LYS  37          2HD       LYS  37   1.224   0.425   8.983
  301   1HE   LYS  37          1HE       LYS  37   0.798  -0.565  11.288
  302   2HE   LYS  37          2HE       LYS  37   1.471  -2.096  10.685
  303   1HZ   LYS  37          1HZ       LYS  37   2.869   0.494  10.742
  304   2HZ   LYS  37          2HZ       LYS  37   3.124  -0.770  11.771
  305   3HZ   LYS  37          3HZ       LYS  37   3.484  -0.923  10.167
  306    H    ASP  38           H        ASP  38  -4.390  -1.741  11.438
  307    HA   ASP  38           HA       ASP  38  -5.644  -1.379  13.301
  308   1HB   ASP  38          1HB       ASP  38  -3.173   0.189  14.114
  309   2HB   ASP  38          2HB       ASP  38  -4.529  -0.201  15.192
  310    H    GLY  39           H        GLY  39  -5.843   0.496  10.962
  311   1HA   GLY  39          1HA       GLY  39  -7.618   2.233  10.981
  312   2HA   GLY  39          2HA       GLY  39  -6.902   2.807  12.508
  313    H    LYS  40           H        LYS  40  -4.081   2.295  11.152
  314    HA   LYS  40           HA       LYS  40  -3.827   5.036  10.212
  315   1HB   LYS  40          1HB       LYS  40  -1.907   2.702  10.392
  316   2HB   LYS  40          2HB       LYS  40  -1.430   4.386  10.032
  317   1HG   LYS  40          1HG       LYS  40  -2.357   5.092  12.244
  318   2HG   LYS  40          2HG       LYS  40  -2.868   3.410  12.537
  319   1HD   LYS  40          1HD       LYS  40   0.000   4.404  12.237
  320   2HD   LYS  40          2HD       LYS  40  -0.771   3.716  13.694
  321   1HE   LYS  40          1HE       LYS  40  -1.282   1.647  12.325
  322   2HE   LYS  40          2HE       LYS  40  -0.307   2.334  11.019
  323   1HZ   LYS  40          1HZ       LYS  40   0.669   1.717  13.734
  324   2HZ   LYS  40          2HZ       LYS  40   0.979   0.830  12.382
  325   3HZ   LYS  40          3HZ       LYS  40   1.579   2.360  12.518
  326    H    LYS  41           H        LYS  41  -5.293   4.853   8.523
  327    HA   LYS  41           HA       LYS  41  -4.803   3.110   6.291
  328   1HB   LYS  41          1HB       LYS  41  -6.989   3.435   6.444
  329   2HB   LYS  41          2HB       LYS  41  -6.814   5.005   7.210
  330   1HG   LYS  41          1HG       LYS  41  -6.277   4.649   4.259
  331   2HG   LYS  41          2HG       LYS  41  -7.935   4.868   4.853
  332   1HD   LYS  41          1HD       LYS  41  -7.386   6.970   5.917
  333   2HD   LYS  41          2HD       LYS  41  -5.654   6.765   5.571
  334   1HE   LYS  41          1HE       LYS  41  -7.775   6.927   3.390
  335   2HE   LYS  41          2HE       LYS  41  -6.883   8.336   4.002
  336   1HZ   LYS  41          1HZ       LYS  41  -5.673   5.949   2.814
  337   2HZ   LYS  41          2HZ       LYS  41  -5.854   7.407   2.071
  338   3HZ   LYS  41          3HZ       LYS  41  -4.854   7.268   3.380
  339    H    VAL  42           H        VAL  42  -4.240   3.399   4.361
  340    HA   VAL  42           HA       VAL  42  -3.157   5.946   3.260
  341    HB   VAL  42           HB       VAL  42  -1.125   4.624   2.508
  342   1HG1  VAL  42          1HG1      VAL  42  -1.038   6.214   4.375
  343   2HG1  VAL  42          2HG1      VAL  42  -1.532   4.918   5.503
  344   3HG1  VAL  42          3HG1      VAL  42   0.036   4.821   4.651
  345   1HG2  VAL  42          1HG2      VAL  42  -2.151   2.389   2.847
  346   2HG2  VAL  42          2HG2      VAL  42  -0.611   2.544   3.733
  347   3HG2  VAL  42          3HG2      VAL  42  -2.164   2.665   4.604
  348    H    ASN  43           H        ASN  43  -2.385   5.436   0.862
  349    HA   ASN  43           HA       ASN  43  -4.635   4.149  -0.463
  350   1HB   ASN  43          1HB       ASN  43  -3.571   6.189  -1.388
  351   2HB   ASN  43          2HB       ASN  43  -2.042   5.300  -1.550
  352   1HD2  ASN  43          2HD2      ASN  43  -5.386   4.028  -2.292
  353   2HD2  ASN  43          1HD2      ASN  43  -5.070   3.959  -4.015
  354    H    ALA  44           H        ALA  44  -4.749   2.211  -0.058
  355    HA   ALA  44           HA       ALA  44  -2.962   0.244   0.564
  356   1HB   ALA  44          1HB       ALA  44  -5.513   0.082  -1.091
  357   2HB   ALA  44          2HB       ALA  44  -4.798  -1.300  -0.235
  358   3HB   ALA  44          3HB       ALA  44  -5.452   0.089   0.677
  359    H    LYS  45           H        LYS  45  -4.060   1.217  -2.637
  360    HA   LYS  45           HA       LYS  45  -2.741  -1.017  -3.998
  361   1HB   LYS  45          1HB       LYS  45  -3.515   0.169  -6.050
  362   2HB   LYS  45          2HB       LYS  45  -4.820  -0.194  -4.902
  363   1HG   LYS  45          1HG       LYS  45  -4.826   2.099  -4.093
  364   2HG   LYS  45          2HG       LYS  45  -3.381   2.486  -5.053
  365   1HD   LYS  45          1HD       LYS  45  -5.406   3.284  -6.235
  366   2HD   LYS  45          2HD       LYS  45  -4.614   1.979  -7.139
  367   1HE   LYS  45          1HE       LYS  45  -6.221   0.341  -6.144
  368   2HE   LYS  45          2HE       LYS  45  -7.039   1.674  -5.306
  369   1HZ   LYS  45          1HZ       LYS  45  -7.510   2.644  -7.434
  370   2HZ   LYS  45          2HZ       LYS  45  -6.775   1.385  -8.220
  371   3HZ   LYS  45          3HZ       LYS  45  -8.128   1.128  -7.341
  372    H    SER  46           H        SER  46  -1.751   2.142  -2.925
  373    HA   SER  46           HA       SER  46   0.443   2.082  -4.923
  374   1HB   SER  46          1HB       SER  46  -1.098   4.108  -4.854
  375   2HB   SER  46          2HB       SER  46  -0.433   4.448  -3.252
  376    HG   SER  46           HG       SER  46   0.649   5.493  -5.112
  377    H    ILE  47           H        ILE  47   2.192   3.571  -3.859
  378    HA   ILE  47           HA       ILE  47   3.917   2.141  -2.227
  379    HB   ILE  47           HB       ILE  47   4.762   3.974  -3.373
  380   1HG1  ILE  47          1HG1      ILE  47   5.482   3.706  -0.847
  381   2HG1  ILE  47          2HG1      ILE  47   6.058   5.089  -1.783
  382   1HG2  ILE  47          1HG2      ILE  47   2.686   5.253  -3.667
  383   2HG2  ILE  47          2HG2      ILE  47   2.811   5.826  -1.984
  384   3HG2  ILE  47          3HG2      ILE  47   4.045   6.294  -3.176
  385   1HD1  ILE  47          1HD1      ILE  47   4.165   6.473  -0.879
  386   2HD1  ILE  47          2HD1      ILE  47   3.659   5.096   0.107
  387   3HD1  ILE  47          3HD1      ILE  47   5.222   5.867   0.422
  388    H    MET  48           H        MET  48   1.721   4.741  -1.091
  389    HA   MET  48           HA       MET  48   2.723   4.362   1.530
  390   1HB   MET  48          1HB       MET  48   1.612   6.434   0.625
  391   2HB   MET  48          2HB       MET  48   0.047   5.619   0.777
  392   1HG   MET  48          1HG       MET  48   0.495   5.342   3.218
  393   2HG   MET  48          2HG       MET  48   2.041   6.179   3.016
  394   1HE   MET  48          1HE       MET  48   1.186   8.371   0.864
  395   2HE   MET  48          2HE       MET  48   0.840   9.762   1.922
  396   3HE   MET  48          3HE       MET  48   2.246   8.719   2.256
  397    H    GLY  49           H        GLY  49   0.096   2.689  -0.114
  398   1HA   GLY  49          1HA       GLY  49  -0.775   1.409   2.358
  399   2HA   GLY  49          2HA       GLY  49  -1.241   0.949   0.686
  400    H    LEU  50           H        LEU  50   0.937   0.299  -0.628
  401    HA   LEU  50           HA       LEU  50   1.838  -2.171   0.256
  402   1HB   LEU  50          1HB       LEU  50   2.269  -0.345  -1.909
  403   2HB   LEU  50          2HB       LEU  50   3.862  -0.825  -1.271
  404    HG   LEU  50           HG       LEU  50   1.682  -2.769  -2.129
  405   1HD1  LEU  50          1HD1      LEU  50   2.728  -1.569  -4.035
  406   2HD1  LEU  50          2HD1      LEU  50   4.339  -2.027  -3.428
  407   3HD1  LEU  50          3HD1      LEU  50   3.211  -3.281  -3.999
  408   1HD2  LEU  50          1HD2      LEU  50   3.114  -3.570  -0.301
  409   2HD2  LEU  50          2HD2      LEU  50   3.417  -4.476  -1.796
  410   3HD2  LEU  50          3HD2      LEU  50   4.567  -3.220  -1.260
  411    H    MET  51           H        MET  51   3.837   0.732   0.015
  412    HA   MET  51           HA       MET  51   6.118  -0.546   1.183
  413   1HB   MET  51          1HB       MET  51   6.217   1.200  -0.671
  414   2HB   MET  51          2HB       MET  51   5.550   2.360   0.484
  415   1HG   MET  51          1HG       MET  51   7.541   1.683   2.003
  416   2HG   MET  51          2HG       MET  51   8.262   1.040   0.520
  417   1HE   MET  51          1HE       MET  51   5.906   4.092   1.115
  418   2HE   MET  51          2HE       MET  51   7.013   4.109   2.512
  419   3HE   MET  51          3HE       MET  51   7.072   5.426   1.311
  420    H    SER  52           H        SER  52   3.741   1.979   2.104
  421    HA   SER  52           HA       SER  52   5.167   2.435   4.603
  422   1HB   SER  52          1HB       SER  52   2.409   3.449   3.867
  423   2HB   SER  52          2HB       SER  52   3.529   4.125   5.068
  424    HG   SER  52           HG       SER  52   4.988   4.470   3.249
  425    H    LEU  53           H        LEU  53   1.713   1.508   4.133
  426    HA   LEU  53           HA       LEU  53   1.639   0.645   6.909
  427   1HB   LEU  53          1HB       LEU  53  -0.357   0.877   4.703
  428   2HB   LEU  53          2HB       LEU  53  -0.689  -0.058   6.177
  429    HG   LEU  53           HG       LEU  53  -1.394   2.287   6.503
  430   1HD1  LEU  53          1HD1      LEU  53  -0.387   1.146   8.462
  431   2HD1  LEU  53          2HD1      LEU  53   1.211   1.773   7.979
  432   3HD1  LEU  53          3HD1      LEU  53  -0.075   2.900   8.474
  433   1HD2  LEU  53          1HD2      LEU  53   0.164   3.219   4.791
  434   2HD2  LEU  53          2HD2      LEU  53   0.223   4.129   6.330
  435   3HD2  LEU  53          3HD2      LEU  53   1.515   2.968   5.924
  436    H    ALA  54           H        ALA  54   0.500  -1.029   4.050
  437    HA   ALA  54           HA       ALA  54  -0.037  -3.550   5.043
  438   1HB   ALA  54          1HB       ALA  54  -0.748  -2.653   2.848
  439   2HB   ALA  54          2HB       ALA  54   0.937  -2.705   2.287
  440   3HB   ALA  54          3HB       ALA  54   0.075  -4.216   2.658
  441    H    VAL  55           H        VAL  55   3.053  -2.277   3.855
  442    HA   VAL  55           HA       VAL  55   4.404  -4.725   3.732
  443    HB   VAL  55           HB       VAL  55   5.152  -2.380   2.960
  444   1HG1  VAL  55          1HG1      VAL  55   4.894  -1.293   5.192
  445   2HG1  VAL  55          2HG1      VAL  55   6.211  -2.312   5.823
  446   3HG1  VAL  55          3HG1      VAL  55   6.539  -1.113   4.548
  447   1HG2  VAL  55          1HG2      VAL  55   7.131  -4.174   4.417
  448   2HG2  VAL  55          2HG2      VAL  55   6.557  -4.377   2.744
  449   3HG2  VAL  55          3HG2      VAL  55   7.547  -2.961   3.179
  450    H    SER  56           H        SER  56   3.229  -3.219   6.587
  451    HA   SER  56           HA       SER  56   5.245  -4.447   8.287
  452   1HB   SER  56          1HB       SER  56   2.533  -3.376   9.126
  453   2HB   SER  56          2HB       SER  56   4.013  -3.480  10.090
  454    HG   SER  56           HG       SER  56   3.508  -1.772   7.854
  455    H    THR  57           H        THR  57   4.734  -6.582   6.954
  456    HA   THR  57           HA       THR  57   2.656  -8.242   7.177
  457    HB   THR  57           HB       THR  57   5.403  -9.136   8.076
  458    HG1  THR  57           HG1      THR  57   4.906  -9.240   5.380
  459   1HG2  THR  57          1HG2      THR  57   4.745 -11.167   6.785
  460   2HG2  THR  57          2HG2      THR  57   3.582 -10.796   8.080
  461   3HG2  THR  57          3HG2      THR  57   3.189 -10.394   6.396
  462    H    GLY  58           H        GLY  58   1.256  -8.653   8.732
  463   1HA   GLY  58          1HA       GLY  58   0.850  -9.905  10.819
  464   2HA   GLY  58          2HA       GLY  58   2.280  -9.112  11.504
  465    H    THR  59           H        THR  59   1.002  -6.554   9.927
  466    HA   THR  59           HA       THR  59  -0.238  -5.615  12.413
  467    HB   THR  59           HB       THR  59  -0.161  -4.177   9.733
  468    HG1  THR  59           HG1      THR  59   1.951  -4.822  10.507
  469   1HG2  THR  59          1HG2      THR  59  -0.292  -2.171  11.152
  470   2HG2  THR  59          2HG2      THR  59  -1.667  -3.253  11.470
  471   3HG2  THR  59          3HG2      THR  59  -0.303  -3.188  12.610
  472    H    GLU  60           H        GLU  60  -2.443  -5.584  12.829
  473    HA   GLU  60           HA       GLU  60  -4.178  -6.686  10.734
  474   1HB   GLU  60          1HB       GLU  60  -4.972  -5.554  13.447
  475   2HB   GLU  60          2HB       GLU  60  -5.952  -6.555  12.338
  476   1HG   GLU  60          1HG       GLU  60  -4.251  -8.369  12.500
  477   2HG   GLU  60          2HG       GLU  60  -3.377  -7.418  13.720
  478    H    VAL  61           H        VAL  61  -4.469  -5.442   9.077
  479    HA   VAL  61           HA       VAL  61  -4.927  -2.536   9.521
  480    HB   VAL  61           HB       VAL  61  -3.618  -2.085   7.492
  481   1HG1  VAL  61          1HG1      VAL  61  -2.395  -2.347   9.686
  482   2HG1  VAL  61          2HG1      VAL  61  -2.201  -4.077   9.326
  483   3HG1  VAL  61          3HG1      VAL  61  -1.407  -2.863   8.295
  484   1HG2  VAL  61          1HG2      VAL  61  -4.137  -4.237   6.327
  485   2HG2  VAL  61          2HG2      VAL  61  -2.381  -3.904   6.409
  486   3HG2  VAL  61          3HG2      VAL  61  -3.120  -5.085   7.527
  487    H    THR  62           H        THR  62  -6.649  -1.665   8.599
  488    HA   THR  62           HA       THR  62  -8.597  -3.426   7.517
  489    HB   THR  62           HB       THR  62  -8.982  -0.495   7.218
  490    HG1  THR  62           HG1      THR  62  -8.428  -1.631   9.764
  491   1HG2  THR  62          1HG2      THR  62 -11.030  -1.030   8.529
  492   2HG2  THR  62          2HG2      THR  62 -10.861  -2.083   7.112
  493   3HG2  THR  62          3HG2      THR  62 -10.454  -2.702   8.733
  494    H    LEU  63           H        LEU  63  -8.855  -4.082   5.500
  495    HA   LEU  63           HA       LEU  63  -7.561  -2.649   3.287
  496   1HB   LEU  63          1HB       LEU  63  -8.834  -5.331   3.790
  497   2HB   LEU  63          2HB       LEU  63  -8.932  -4.671   2.154
  498    HG   LEU  63           HG       LEU  63  -6.937  -6.011   2.247
  499   1HD1  LEU  63          1HD2      LEU  63  -6.819  -3.836   1.045
  500   2HD1  LEU  63          2HD2      LEU  63  -6.219  -3.061   2.529
  501   3HD1  LEU  63          3HD2      LEU  63  -5.238  -4.302   1.713
  502   1HD2  LEU  63          1HD1      LEU  63  -6.195  -4.361   4.693
  503   2HD2  LEU  63          2HD1      LEU  63  -6.671  -6.072   4.689
  504   3HD2  LEU  63          3HD1      LEU  63  -5.151  -5.573   3.910
  505    H    ILE  64           H        ILE  64  -8.566  -0.940   2.639
  506    HA   ILE  64           HA       ILE  64 -11.520  -0.763   2.363
  507    HB   ILE  64           HB       ILE  64  -9.244   1.268   2.357
  508   1HG1  ILE  64          1HG1      ILE  64 -11.507   0.914   4.355
  509   2HG1  ILE  64          2HG1      ILE  64  -9.816   0.415   4.612
  510   1HG2  ILE  64          1HG2      ILE  64 -11.044   1.991   0.852
  511   2HG2  ILE  64          2HG2      ILE  64 -12.239   1.737   2.149
  512   3HG2  ILE  64          3HG2      ILE  64 -10.997   3.007   2.313
  513   1HD1  ILE  64          1HD1      ILE  64 -10.721   3.260   3.986
  514   2HD1  ILE  64          2HD1      ILE  64 -10.216   2.658   5.587
  515   3HD1  ILE  64          3HD1      ILE  64  -9.041   2.727   4.252
  516    H    ALA  65           H        ALA  65 -12.380  -0.058   0.426
  517    HA   ALA  65           HA       ALA  65 -10.570   0.788  -1.734
  518   1HB   ALA  65          1HB       ALA  65 -12.647  -1.409  -2.199
  519   2HB   ALA  65          2HB       ALA  65 -11.705  -0.604  -3.470
  520   3HB   ALA  65          3HB       ALA  65 -10.882  -1.638  -2.274
  521    H    GLN  66           H        GLN  66 -11.406   2.882  -1.258
  522    HA   GLN  66           HA       GLN  66 -14.345   2.952  -1.272
  523   1HB   GLN  66          1HB       GLN  66 -14.127   5.203  -0.432
  524   2HB   GLN  66          2HB       GLN  66 -12.984   4.154   0.440
  525   1HG   GLN  66          1HG       GLN  66 -11.107   5.100  -0.602
  526   2HG   GLN  66          2HG       GLN  66 -12.074   5.638  -1.992
  527   1HE2  GLN  66          2HE2      GLN  66 -11.597   6.332   1.534
  528   2HE2  GLN  66          1HE2      GLN  66 -12.062   8.015   1.364
  529    H    GLY  67           H        GLY  67 -14.493   2.185  -3.419
  530   1HA   GLY  67          1HA       GLY  67 -14.865   4.501  -5.217
  531   2HA   GLY  67          2HA       GLY  67 -13.750   3.243  -5.778
  532    H    GLU  68           H        GLU  68 -15.164   2.911  -7.601
  533    HA   GLU  68           HA       GLU  68 -17.933   2.310  -7.166
  534   1HB   GLU  68          1HB       GLU  68 -16.381   1.684  -9.672
  535   2HB   GLU  68          2HB       GLU  68 -18.092   2.129  -9.489
  536   1HG   GLU  68          1HG       GLU  68 -15.638   3.887  -9.123
  537   2HG   GLU  68          2HG       GLU  68 -16.874   4.035 -10.387
  538    H    ASP  69           H        ASP  69 -15.072   0.316  -6.807
  539    HA   ASP  69           HA       ASP  69 -16.784  -2.120  -7.104
  540   1HB   ASP  69          1HB       ASP  69 -13.803  -2.052  -7.114
  541   2HB   ASP  69          2HB       ASP  69 -14.882  -3.356  -7.591
  542    H    GLU  70           H        GLU  70 -16.358   0.097  -4.922
  543    HA   GLU  70           HA       GLU  70 -14.698  -0.112  -3.057
  544   1HB   GLU  70          1HB       GLU  70 -16.804   1.200  -3.113
  545   2HB   GLU  70          2HB       GLU  70 -17.692  -0.273  -2.684
  546   1HG   GLU  70          1HG       GLU  70 -15.988  -0.245  -0.611
  547   2HG   GLU  70          2HG       GLU  70 -16.043   1.503  -0.956
  548    H    GLN  71           H        GLN  71 -17.550  -1.921  -2.003
  549    HA   GLN  71           HA       GLN  71 -16.219  -3.502  -0.214
  550   1HB   GLN  71          1HB       GLN  71 -18.643  -3.202  -0.326
  551   2HB   GLN  71          2HB       GLN  71 -18.719  -4.227  -1.775
  552   1HG   GLN  71          1HG       GLN  71 -19.340  -5.443   0.298
  553   2HG   GLN  71          2HG       GLN  71 -17.924  -6.152  -0.498
  554   1HE2  GLN  71          2HE2      GLN  71 -15.862  -5.979   0.486
  555   2HE2  GLN  71          1HE2      GLN  71 -15.737  -5.630   2.205
  556    H    GLU  72           H        GLU  72 -16.459  -4.141  -3.710
  557    HA   GLU  72           HA       GLU  72 -15.749  -6.940  -3.689
  558   1HB   GLU  72          1HB       GLU  72 -16.758  -5.982  -5.659
  559   2HB   GLU  72          2HB       GLU  72 -15.697  -4.555  -5.558
  560   1HG   GLU  72          1HG       GLU  72 -14.925  -5.746  -7.400
  561   2HG   GLU  72          2HG       GLU  72 -13.739  -6.042  -6.127
  562    H    ALA  73           H        ALA  73 -14.024  -3.879  -4.214
  563    HA   ALA  73           HA       ALA  73 -11.447  -4.941  -4.690
  564   1HB   ALA  73          1HB       ALA  73 -12.628  -2.283  -3.793
  565   2HB   ALA  73          2HB       ALA  73 -10.977  -2.460  -4.473
  566   3HB   ALA  73          3HB       ALA  73 -12.423  -2.826  -5.458
  567    H    LEU  74           H        LEU  74 -12.973  -3.454  -1.817
  568    HA   LEU  74           HA       LEU  74 -10.631  -3.794  -0.207
  569   1HB   LEU  74          1HB       LEU  74 -12.049  -3.030   1.623
  570   2HB   LEU  74          2HB       LEU  74 -12.271  -2.080   0.130
  571    HG   LEU  74           HG       LEU  74 -14.221  -4.073  -0.079
  572   1HD1  LEU  74          1HD1      LEU  74 -14.093  -2.826   2.707
  573   2HD1  LEU  74          2HD1      LEU  74 -15.450  -3.773   2.050
  574   3HD1  LEU  74          3HD1      LEU  74 -13.874  -4.561   2.338
  575   1HD2  LEU  74          1HD2      LEU  74 -14.270  -1.644  -0.722
  576   2HD2  LEU  74          2HD2      LEU  74 -15.694  -2.084   0.235
  577   3HD2  LEU  74          3HD2      LEU  74 -14.351  -1.191   0.989
  578    H    GLU  75           H        GLU  75 -13.566  -5.881  -0.599
  579    HA   GLU  75           HA       GLU  75 -12.715  -7.613   1.522
  580   1HB   GLU  75          1HB       GLU  75 -14.364  -9.224   0.660
  581   2HB   GLU  75          2HB       GLU  75 -15.017  -7.600   0.935
  582   1HG   GLU  75          1HG       GLU  75 -15.985  -8.147  -1.074
  583   2HG   GLU  75          2HG       GLU  75 -14.558  -7.256  -1.616
  584    H    LYS  76           H        LYS  76 -12.163  -7.793  -2.067
  585    HA   LYS  76           HA       LYS  76 -10.843 -10.314  -1.940
  586   1HB   LYS  76          1HB       LYS  76  -9.430  -9.334  -3.881
  587   2HB   LYS  76          2HB       LYS  76 -11.163  -9.615  -4.130
  588   1HG   LYS  76          1HG       LYS  76 -11.695  -7.383  -4.157
  589   2HG   LYS  76          2HG       LYS  76 -10.317  -6.900  -3.164
  590   1HD   LYS  76          1HD       LYS  76 -10.162  -6.200  -5.588
  591   2HD   LYS  76          2HD       LYS  76  -8.772  -7.042  -4.913
  592   1HE   LYS  76          1HE       LYS  76  -9.576  -7.667  -7.298
  593   2HE   LYS  76          2HE       LYS  76  -9.087  -8.947  -6.170
  594   1HZ   LYS  76          1HZ       LYS  76 -11.891  -8.215  -6.692
  595   2HZ   LYS  76          2HZ       LYS  76 -11.088  -9.510  -7.300
  596   3HZ   LYS  76          3HZ       LYS  76 -11.353  -9.387  -5.685
  597    H    LEU  77           H        LEU  77  -9.623  -7.029  -1.383
  598    HA   LEU  77           HA       LEU  77  -6.895  -7.747  -0.929
  599   1HB   LEU  77          1HB       LEU  77  -8.758  -5.471  -0.270
  600   2HB   LEU  77          2HB       LEU  77  -7.129  -5.505   0.457
  601    HG   LEU  77           HG       LEU  77  -7.434  -4.301  -1.885
  602   1HD1  LEU  77          1HD1      LEU  77  -5.332  -4.765  -0.661
  603   2HD1  LEU  77          2HD1      LEU  77  -5.342  -6.428  -1.321
  604   3HD1  LEU  77          3HD1      LEU  77  -5.150  -5.038  -2.421
  605   1HD2  LEU  77          1HD2      LEU  77  -7.068  -7.245  -2.623
  606   2HD2  LEU  77          2HD2      LEU  77  -8.503  -6.290  -3.041
  607   3HD2  LEU  77          3HD2      LEU  77  -6.910  -5.889  -3.754
  608    H    ALA  78           H        ALA  78  -9.433  -6.943   1.573
  609    HA   ALA  78           HA       ALA  78  -7.712  -7.725   3.689
  610   1HB   ALA  78          1HB       ALA  78  -9.674  -6.327   4.087
  611   2HB   ALA  78          2HB       ALA  78 -10.739  -7.708   3.685
  612   3HB   ALA  78          3HB       ALA  78  -9.679  -7.767   5.114
  613    H    ALA  79           H        ALA  79  -9.728  -9.741   1.563
  614    HA   ALA  79           HA       ALA  79  -9.448 -12.073   3.254
  615   1HB   ALA  79          1HB       ALA  79 -11.071 -11.829   1.334
  616   2HB   ALA  79          2HB       ALA  79  -9.657 -11.847   0.229
  617   3HB   ALA  79          3HB       ALA  79 -10.038 -13.284   1.217
  618    H    TYR  80           H        TYR  80  -7.713 -10.808   0.333
  619    HA   TYR  80           HA       TYR  80  -6.009 -13.071   0.146
  620   1HB   TYR  80          1HB       TYR  80  -6.684 -11.513  -1.644
  621   2HB   TYR  80          2HB       TYR  80  -5.607 -10.283  -0.955
  622    HD1  TYR  80           HD1      TYR  80  -5.470 -13.940  -1.757
  623    HD2  TYR  80           HD2      TYR  80  -3.445 -10.160  -1.721
  624    HE1  TYR  80           HE1      TYR  80  -3.304 -15.131  -1.823
  625    HE2  TYR  80           HE2      TYR  80  -1.236 -11.352  -1.856
  626    HH   TYR  80           HH       TYR  80  -1.087 -14.906  -1.496
  627    H    VAL  81           H        VAL  81  -5.443  -9.846   1.436
  628    HA   VAL  81           HA       VAL  81  -2.824  -9.670   2.150
  629    HB   VAL  81           HB       VAL  81  -3.711  -8.467   4.205
  630   1HG1  VAL  81          1HG1      VAL  81  -5.182  -7.955   1.608
  631   2HG1  VAL  81          2HG1      VAL  81  -5.123  -6.835   2.996
  632   3HG1  VAL  81          3HG1      VAL  81  -3.621  -7.243   2.118
  633   1HG2  VAL  81          1HG2      VAL  81  -6.342  -9.586   3.120
  634   2HG2  VAL  81          2HG2      VAL  81  -5.563 -10.037   4.646
  635   3HG2  VAL  81          3HG2      VAL  81  -6.198  -8.398   4.439
  636    H    GLN  82           H        GLN  82  -5.280 -11.620   3.882
  637    HA   GLN  82           HA       GLN  82  -3.156 -12.260   5.855
  638   1HB   GLN  82          1HB       GLN  82  -4.977 -12.127   7.514
  639   2HB   GLN  82          2HB       GLN  82  -4.932 -10.683   6.498
  640   1HG   GLN  82          1HG       GLN  82  -6.853 -11.621   5.216
  641   2HG   GLN  82          2HG       GLN  82  -6.722 -13.113   6.126
  642   1HE2  GLN  82          2HE2      GLN  82  -8.622 -10.802   5.915
  643   2HE2  GLN  82          1HE2      GLN  82  -9.081 -10.281   7.528
  644    H    GLU  83           H        GLU  83  -5.462 -13.666   3.643
  645    HA   GLU  83           HA       GLU  83  -6.087 -16.007   5.078
  646   1HB   GLU  83          1HB       GLU  83  -7.249 -16.577   3.035
  647   2HB   GLU  83          2HB       GLU  83  -7.377 -14.814   3.350
  648   1HG   GLU  83          1HG       GLU  83  -5.481 -14.433   1.775
  649   2HG   GLU  83          2HG       GLU  83  -5.481 -16.169   1.392
  650    H    GLU  84           H        GLU  84  -3.072 -15.903   4.895
  651    HA   GLU  84           HA       GLU  84  -2.649 -18.613   4.687
  652   1HB   GLU  84          1HB       GLU  84  -1.336 -18.881   2.650
  653   2HB   GLU  84          2HB       GLU  84  -2.995 -18.386   2.302
  654   1HG   GLU  84          1HG       GLU  84  -2.186 -16.031   1.935
  655   2HG   GLU  84          2HG       GLU  84  -0.531 -16.614   2.172
  656    H    VAL  85           H        VAL  85   0.144 -17.565   3.418
  657    HA   VAL  85           HA       VAL  85   1.195 -15.816   5.559
  658    HB   VAL  85           HB       VAL  85   2.680 -18.424   4.883
  659   1HG1  VAL  85          1HG1      VAL  85   3.087 -16.516   7.293
  660   2HG1  VAL  85          2HG1      VAL  85   3.996 -18.018   6.990
  661   3HG1  VAL  85          3HG1      VAL  85   4.161 -16.668   5.882
  662   1HG2  VAL  85          1HG2      VAL  85   0.590 -19.166   6.110
  663   2HG2  VAL  85          2HG2      VAL  85   2.056 -19.469   7.049
  664   3HG2  VAL  85          3HG2      VAL  85   1.004 -18.093   7.469
  Start of MODEL    7
    1   1H    VAL   2          1H        VAL   2 -19.016   3.243   0.291
    2   2H    VAL   2          2H        VAL   2 -18.494   4.840   0.369
    3   3H    VAL   2          3H        VAL   2 -19.956   4.469  -0.374
    4    HA   VAL   2           HA       VAL   2 -18.830   3.238  -2.079
    5    HB   VAL   2           HB       VAL   2 -17.735   6.051  -1.696
    6   1HG1  VAL   2          1HG2      VAL   2 -16.419   4.699  -3.333
    7   2HG1  VAL   2          2HG2      VAL   2 -17.917   4.293  -4.196
    8   3HG1  VAL   2          3HG2      VAL   2 -17.352   5.980  -4.140
    9   1HG2  VAL   2          1HG1      VAL   2 -20.108   4.962  -3.270
   10   2HG2  VAL   2          2HG1      VAL   2 -20.207   5.928  -1.778
   11   3HG2  VAL   2          3HG1      VAL   2 -19.559   6.653  -3.267
   12    H    GLN   3           H        GLN   3 -16.478   5.098  -0.087
   13    HA   GLN   3           HA       GLN   3 -14.347   3.157  -0.429
   14   1HB   GLN   3          1HB       GLN   3 -14.241   5.648   0.450
   15   2HB   GLN   3          2HB       GLN   3 -14.739   4.907   1.997
   16   1HG   GLN   3          1HG       GLN   3 -12.778   3.466   1.970
   17   2HG   GLN   3          2HG       GLN   3 -12.241   4.152   0.434
   18   1HE2  GLN   3          2HE2      GLN   3 -12.681   6.941   0.808
   19   2HE2  GLN   3          1HE2      GLN   3 -11.722   7.456   2.176
   20    H    GLN   4           H        GLN   4 -14.615   1.151   0.261
   21    HA   GLN   4           HA       GLN   4 -15.913   0.650   2.900
   22   1HB   GLN   4          1HB       GLN   4 -15.905  -1.365   0.664
   23   2HB   GLN   4          2HB       GLN   4 -16.990  -1.312   2.052
   24   1HG   GLN   4          1HG       GLN   4 -17.012   0.860  -0.080
   25   2HG   GLN   4          2HG       GLN   4 -17.881  -0.664  -0.316
   26   1HE2  GLN   4          2HE2      GLN   4 -19.020  -1.329   1.966
   27   2HE2  GLN   4          1HE2      GLN   4 -20.102  -0.075   2.552
   28    H    LYS   5           H        LYS   5 -14.784  -1.199   4.089
   29    HA   LYS   5           HA       LYS   5 -12.402  -2.243   2.749
   30   1HB   LYS   5          1HB       LYS   5 -11.072  -1.630   4.845
   31   2HB   LYS   5          2HB       LYS   5 -11.406  -0.377   3.636
   32   1HG   LYS   5          1HG       LYS   5 -11.694   0.528   5.876
   33   2HG   LYS   5          2HG       LYS   5 -13.241   0.510   5.010
   34   1HD   LYS   5          1HD       LYS   5 -13.930  -1.528   6.209
   35   2HD   LYS   5          2HD       LYS   5 -12.352  -1.637   7.005
   36   1HE   LYS   5          1HE       LYS   5 -14.221   0.755   7.285
   37   2HE   LYS   5          2HE       LYS   5 -14.121  -0.592   8.445
   38   1HZ   LYS   5          1HZ       LYS   5 -11.849   1.117   7.704
   39   2HZ   LYS   5          2HZ       LYS   5 -12.751   1.281   9.076
   40   3HZ   LYS   5          3HZ       LYS   5 -11.863  -0.084   8.829
   41    H    VAL   6           H        VAL   6 -11.382  -3.884   3.840
   42    HA   VAL   6           HA       VAL   6 -12.994  -5.285   5.918
   43    HB   VAL   6           HB       VAL   6 -11.494  -6.386   3.506
   44   1HG1  VAL   6          1HG1      VAL   6 -11.119  -7.792   5.495
   45   2HG1  VAL   6          2HG1      VAL   6 -12.879  -7.895   5.763
   46   3HG1  VAL   6          3HG1      VAL   6 -12.153  -8.619   4.307
   47   1HG2  VAL   6          1HG2      VAL   6 -13.749  -5.489   3.043
   48   2HG2  VAL   6          2HG2      VAL   6 -13.719  -7.260   2.858
   49   3HG2  VAL   6          3HG2      VAL   6 -14.426  -6.528   4.315
   50    H    GLU   7           H        GLU   7 -11.706  -5.549   7.791
   51    HA   GLU   7           HA       GLU   7  -8.941  -4.752   7.408
   52   1HB   GLU   7          1HB       GLU   7 -10.357  -5.853   9.906
   53   2HB   GLU   7          2HB       GLU   7  -8.720  -5.184   9.876
   54   1HG   GLU   7          1HG       GLU   7 -10.115  -3.466  10.725
   55   2HG   GLU   7          2HG       GLU   7  -9.723  -2.984   9.067
   56    H    VAL   8           H        VAL   8  -7.039  -5.913   7.737
   57    HA   VAL   8           HA       VAL   8  -7.440  -8.853   7.749
   58    HB   VAL   8           HB       VAL   8  -6.623  -9.091   5.646
   59   1HG1  VAL   8          1HG2      VAL   8  -8.279  -7.315   5.256
   60   2HG1  VAL   8          2HG2      VAL   8  -7.019  -6.083   5.474
   61   3HG1  VAL   8          3HG2      VAL   8  -6.929  -7.217   4.098
   62   1HG2  VAL   8          1HG1      VAL   8  -4.695  -6.805   6.161
   63   2HG2  VAL   8          2HG1      VAL   8  -4.337  -8.544   6.311
   64   3HG2  VAL   8          3HG1      VAL   8  -4.696  -7.848   4.714
   65    H    ARG   9           H        ARG   9  -5.649 -10.040   8.588
   66    HA   ARG   9           HA       ARG   9  -3.492  -8.339   9.749
   67   1HB   ARG   9          1HB       ARG   9  -4.021 -10.177  11.169
   68   2HB   ARG   9          2HB       ARG   9  -3.982 -11.351   9.820
   69   1HG   ARG   9          1HG       ARG   9  -1.550  -9.701  10.440
   70   2HG   ARG   9          2HG       ARG   9  -1.902 -11.114  11.442
   71   1HD   ARG   9          1HD       ARG   9  -1.823 -11.272   8.392
   72   2HD   ARG   9          2HD       ARG   9  -0.406 -11.567   9.421
   73    HE   ARG   9           HE       ARG   9  -1.443 -13.480  10.338
   74   1HH1  ARG   9          2HH1      ARG   9  -3.383 -12.025   7.737
   75   2HH1  ARG   9          1HH1      ARG   9  -4.218 -13.512   7.361
   76   1HH2  ARG   9          1HH2      ARG   9  -2.597 -15.392   9.875
   77   2HH2  ARG   9          2HH2      ARG   9  -3.816 -15.408   8.630
   78    H    LEU  10           H        LEU  10  -1.909  -7.696   8.406
   79    HA   LEU  10           HA       LEU  10  -1.891  -8.399   5.701
   80   1HB   LEU  10          1HB       LEU  10  -0.907  -6.385   7.087
   81   2HB   LEU  10          2HB       LEU  10   0.571  -7.367   7.076
   82    HG   LEU  10           HG       LEU  10   0.972  -6.270   5.139
   83   1HD1  LEU  10          1HD2      LEU  10   0.492  -8.551   4.364
   84   2HD1  LEU  10          2HD2      LEU  10  -1.202  -8.092   4.035
   85   3HD1  LEU  10          3HD2      LEU  10   0.127  -7.337   3.117
   86   1HD2  LEU  10          1HD1      LEU  10  -0.936  -4.724   5.533
   87   2HD2  LEU  10          2HD1      LEU  10  -0.740  -5.109   3.809
   88   3HD2  LEU  10          3HD1      LEU  10  -2.028  -5.897   4.755
   89    H    LYS  11           H        LYS  11  -1.861 -10.760   5.688
   90    HA   LYS  11           HA       LYS  11   0.411 -12.290   6.561
   91   1HB   LYS  11          1HB       LYS  11  -1.660 -13.397   6.372
   92   2HB   LYS  11          2HB       LYS  11  -1.993 -12.743   4.757
   93   1HG   LYS  11          1HG       LYS  11   0.307 -14.633   5.199
   94   2HG   LYS  11          2HG       LYS  11  -1.357 -15.199   4.907
   95   1HD   LYS  11          1HD       LYS  11   0.298 -13.423   3.064
   96   2HD   LYS  11          2HD       LYS  11  -0.320 -15.050   2.722
   97   1HE   LYS  11          1HE       LYS  11  -2.653 -14.178   2.997
   98   2HE   LYS  11          2HE       LYS  11  -1.971 -12.543   3.281
   99   1HZ   LYS  11          1HZ       LYS  11  -1.446 -14.080   0.860
  100   2HZ   LYS  11          2HZ       LYS  11  -2.748 -13.076   0.993
  101   3HZ   LYS  11          3HZ       LYS  11  -1.234 -12.466   1.123
  102    H    THR  12           H        THR  12  -0.285 -10.469   3.701
  103    HA   THR  12           HA       THR  12   1.793 -11.644   2.028
  104    HB   THR  12           HB       THR  12   0.367  -8.987   1.709
  105    HG1  THR  12           HG1      THR  12  -1.069 -10.769   2.063
  106   1HG2  THR  12          1HG2      THR  12   0.711  -9.465  -0.696
  107   2HG2  THR  12          2HG2      THR  12   2.251  -9.403   0.203
  108   3HG2  THR  12          3HG2      THR  12   1.554 -10.972  -0.263
  109    H    GLY  13           H        GLY  13   1.707  -9.279   4.522
  110   1HA   GLY  13          1HA       GLY  13   2.663  -7.236   4.979
  111   2HA   GLY  13          2HA       GLY  13   4.105  -8.248   4.949
  112    H    LEU  14           H        LEU  14   2.121  -7.388   2.252
  113    HA   LEU  14           HA       LEU  14   2.723  -6.796   0.125
  114   1HB   LEU  14          1HB       LEU  14   2.446  -4.429   1.833
  115   2HB   LEU  14          2HB       LEU  14   3.253  -4.197   0.256
  116    HG   LEU  14           HG       LEU  14   1.492  -5.787  -0.732
  117   1HD1  LEU  14          1HD1      LEU  14   0.038  -5.050   1.827
  118   2HD1  LEU  14          2HD1      LEU  14  -0.699  -5.814   0.401
  119   3HD1  LEU  14          3HD1      LEU  14   0.554  -6.680   1.324
  120   1HD2  LEU  14          1HD2      LEU  14   0.622  -3.043   0.222
  121   2HD2  LEU  14          2HD2      LEU  14   1.449  -3.439  -1.299
  122   3HD2  LEU  14          3HD2      LEU  14  -0.209  -4.004  -1.011
  123    H    GLN  15           H        GLN  15   4.707  -8.253   0.860
  124    HA   GLN  15           HA       GLN  15   7.259  -7.105   0.884
  125   1HB   GLN  15          1HB       GLN  15   6.578  -9.818  -0.302
  126   2HB   GLN  15          2HB       GLN  15   8.149  -9.269   0.321
  127   1HG   GLN  15          1HG       GLN  15   5.592  -9.666   1.908
  128   2HG   GLN  15          2HG       GLN  15   7.065 -10.640   2.003
  129   1HE2  GLN  15          2HE2      GLN  15   5.850  -9.559   4.192
  130   2HE2  GLN  15          1HE2      GLN  15   6.817  -8.248   4.874
  131    H    ALA  16           H        ALA  16   5.973  -8.784  -2.050
  132    HA   ALA  16           HA       ALA  16   6.879  -6.634  -3.756
  133   1HB   ALA  16          1HB       ALA  16   9.083  -7.445  -3.041
  134   2HB   ALA  16          2HB       ALA  16   8.680  -9.077  -3.637
  135   3HB   ALA  16          3HB       ALA  16   8.818  -7.724  -4.780
  136    H    ARG  17           H        ARG  17   6.077 -10.106  -3.511
  137    HA   ARG  17           HA       ARG  17   5.219  -9.926  -6.343
  138   1HB   ARG  17          1HB       ARG  17   5.767 -12.433  -4.723
  139   2HB   ARG  17          2HB       ARG  17   5.365 -12.337  -6.454
  140   1HG   ARG  17          1HG       ARG  17   7.804 -11.191  -5.050
  141   2HG   ARG  17          2HG       ARG  17   7.789 -12.481  -6.273
  142   1HD   ARG  17          1HD       ARG  17   7.048 -10.867  -7.982
  143   2HD   ARG  17          2HD       ARG  17   6.875  -9.606  -6.745
  144    HE   ARG  17           HE       ARG  17   9.506 -10.877  -7.344
  145   1HH1  ARG  17          2HH1      ARG  17   7.497  -7.958  -6.929
  146   2HH1  ARG  17          1HH1      ARG  17   8.837  -6.871  -7.145
  147   1HH2  ARG  17          1HH2      ARG  17  11.248  -9.434  -7.519
  148   2HH2  ARG  17          2HH2      ARG  17  11.001  -7.712  -7.423
  149    HA   PRO  18           HA       PRO  18   1.267 -11.909  -4.355
  150   1HB   PRO  18          1HB       PRO  18   1.080 -11.890  -1.624
  151   2HB   PRO  18          2HB       PRO  18   1.938 -13.222  -2.462
  152   1HG   PRO  18          1HG       PRO  18   3.179 -10.667  -1.373
  153   2HG   PRO  18          2HG       PRO  18   3.663 -12.296  -0.893
  154   1HD   PRO  18          1HD       PRO  18   5.025 -11.153  -2.872
  155   2HD   PRO  18          2HD       PRO  18   4.411 -12.801  -3.171
  156    H    ALA  19           H        ALA  19   2.975  -9.547  -2.402
  157    HA   ALA  19           HA       ALA  19   0.977  -7.682  -1.778
  158   1HB   ALA  19          1HB       ALA  19   3.907  -7.497  -2.504
  159   2HB   ALA  19          2HB       ALA  19   3.008  -6.244  -1.586
  160   3HB   ALA  19          3HB       ALA  19   3.272  -7.877  -0.879
  161    H    ALA  20           H        ALA  20   3.134  -8.028  -4.578
  162    HA   ALA  20           HA       ALA  20   2.398  -5.623  -5.982
  163   1HB   ALA  20          1HB       ALA  20   4.501  -6.895  -6.415
  164   2HB   ALA  20          2HB       ALA  20   3.527  -8.273  -6.978
  165   3HB   ALA  20          3HB       ALA  20   3.506  -6.740  -7.887
  166    H    LEU  21           H        LEU  21   1.314  -8.998  -5.943
  167    HA   LEU  21           HA       LEU  21  -0.619  -8.816  -8.053
  168   1HB   LEU  21          1HB       LEU  21   0.307 -10.902  -7.076
  169   2HB   LEU  21          2HB       LEU  21  -0.598 -10.602  -5.582
  170    HG   LEU  21           HG       LEU  21  -1.865 -10.955  -8.339
  171   1HD1  LEU  21          1HD1      LEU  21  -0.628 -12.967  -7.587
  172   2HD1  LEU  21          2HD1      LEU  21  -1.486 -12.907  -6.030
  173   3HD1  LEU  21          3HD1      LEU  21  -2.386 -13.241  -7.531
  174   1HD2  LEU  21          1HD2      LEU  21  -3.278  -9.757  -6.643
  175   2HD2  LEU  21          2HD2      LEU  21  -3.924 -11.366  -7.044
  176   3HD2  LEU  21          3HD2      LEU  21  -3.035 -11.116  -5.523
  177    H    PHE  22           H        PHE  22  -0.773  -8.287  -4.553
  178    HA   PHE  22           HA       PHE  22  -3.546  -7.713  -4.259
  179   1HB   PHE  22          1HB       PHE  22  -2.395  -8.074  -2.257
  180   2HB   PHE  22          2HB       PHE  22  -1.007  -7.097  -2.771
  181    HD1  PHE  22           HD1      PHE  22  -4.657  -6.631  -1.956
  182    HD2  PHE  22           HD2      PHE  22  -0.705  -4.952  -2.081
  183    HE1  PHE  22           HE1      PHE  22  -5.607  -4.362  -1.648
  184    HE2  PHE  22           HE2      PHE  22  -1.660  -2.675  -1.682
  185    HZ   PHE  22           HZ       PHE  22  -4.102  -2.393  -1.471
  186    H    VAL  23           H        VAL  23  -0.765  -5.437  -4.479
  187    HA   VAL  23           HA       VAL  23  -2.230  -3.075  -4.820
  188    HB   VAL  23           HB       VAL  23   0.504  -4.008  -5.732
  189   1HG1  VAL  23          1HG2      VAL  23  -0.649  -1.213  -6.079
  190   2HG1  VAL  23          2HG2      VAL  23   1.048  -1.686  -6.314
  191   3HG1  VAL  23          3HG2      VAL  23  -0.210  -2.333  -7.393
  192   1HG2  VAL  23          1HG1      VAL  23  -0.503  -1.964  -3.694
  193   2HG2  VAL  23          2HG1      VAL  23   0.171  -3.571  -3.328
  194   3HG2  VAL  23          3HG1      VAL  23   1.203  -2.303  -4.028
  195    H    GLN  24           H        GLN  24  -1.058  -5.346  -7.295
  196    HA   GLN  24           HA       GLN  24  -1.925  -4.255  -9.644
  197   1HB   GLN  24          1HB       GLN  24  -0.604  -6.274  -9.324
  198   2HB   GLN  24          2HB       GLN  24  -1.984  -7.123  -8.610
  199   1HG   GLN  24          1HG       GLN  24  -2.273  -5.995 -11.372
  200   2HG   GLN  24          2HG       GLN  24  -1.255  -7.430 -11.147
  201   1HE2  GLN  24          2HE2      GLN  24  -3.173  -8.289  -8.762
  202   2HE2  GLN  24          1HE2      GLN  24  -4.417  -9.086  -9.697
  203    H    GLU  25           H        GLU  25  -3.886  -6.478  -7.559
  204    HA   GLU  25           HA       GLU  25  -6.143  -6.005  -9.310
  205   1HB   GLU  25          1HB       GLU  25  -7.366  -7.464  -7.592
  206   2HB   GLU  25          2HB       GLU  25  -6.005  -8.221  -8.448
  207   1HG   GLU  25          1HG       GLU  25  -4.571  -8.052  -6.563
  208   2HG   GLU  25          2HG       GLU  25  -5.633  -6.882  -5.755
  209    H    ALA  26           H        ALA  26  -5.265  -4.879  -6.079
  210    HA   ALA  26           HA       ALA  26  -7.604  -3.470  -5.361
  211   1HB   ALA  26          1HB       ALA  26  -4.682  -2.632  -5.184
  212   2HB   ALA  26          2HB       ALA  26  -6.013  -1.949  -4.216
  213   3HB   ALA  26          3HB       ALA  26  -5.517  -3.650  -3.982
  214    H    ASN  27           H        ASN  27  -4.860  -2.627  -7.428
  215    HA   ASN  27           HA       ASN  27  -5.702  -0.089  -8.409
  216   1HB   ASN  27          1HB       ASN  27  -3.736  -2.236  -9.012
  217   2HB   ASN  27          2HB       ASN  27  -4.192  -1.209 -10.377
  218   1HD2  ASN  27          2HD2      ASN  27  -2.199  -1.459  -7.705
  219   2HD2  ASN  27          1HD2      ASN  27  -1.653   0.201  -7.508
  220    H    ARG  28           H        ARG  28  -6.120  -3.440  -9.570
  221    HA   ARG  28           HA       ARG  28  -7.142  -2.980 -12.174
  222   1HB   ARG  28          1HB       ARG  28  -8.024  -4.977 -10.061
  223   2HB   ARG  28          2HB       ARG  28  -8.455  -5.073 -11.778
  224   1HG   ARG  28          1HG       ARG  28  -6.086  -5.326 -12.402
  225   2HG   ARG  28          2HG       ARG  28  -5.602  -5.139 -10.702
  226   1HD   ARG  28          1HD       ARG  28  -5.688  -7.531 -11.311
  227   2HD   ARG  28          2HD       ARG  28  -6.956  -7.155 -10.123
  228    HE   ARG  28           HE       ARG  28  -8.607  -7.422 -11.778
  229   1HH1  ARG  28          1HH2      ARG  28  -5.333  -7.906 -13.022
  230   2HH1  ARG  28          2HH2      ARG  28  -5.850  -8.544 -14.557
  231   1HH2  ARG  28          2HH1      ARG  28  -9.309  -8.236 -13.819
  232   2HH2  ARG  28          1HH1      ARG  28  -8.145  -8.760 -15.004
  233    H    PHE  29           H        PHE  29  -8.811  -3.181  -9.045
  234    HA   PHE  29           HA       PHE  29 -11.389  -2.416 -10.102
  235   1HB   PHE  29          1HB       PHE  29 -10.226  -2.263  -7.300
  236   2HB   PHE  29          2HB       PHE  29 -11.940  -2.086  -7.704
  237    HD1  PHE  29           HD1      PHE  29  -9.416  -4.409  -6.746
  238    HD2  PHE  29           HD2      PHE  29 -12.929  -4.077  -9.203
  239    HE1  PHE  29           HE1      PHE  29  -9.734  -6.870  -6.619
  240    HE2  PHE  29           HE2      PHE  29 -13.143  -6.544  -9.233
  241    HZ   PHE  29           HZ       PHE  29 -11.570  -7.944  -7.931
  242    H    THR  30           H        THR  30 -12.135  -0.468 -10.526
  243    HA   THR  30           HA       THR  30 -10.387   1.818 -10.642
  244    HB   THR  30           HB       THR  30 -13.403   1.728 -10.895
  245    HG1  THR  30           HG1      THR  30 -13.067   1.200 -13.050
  246   1HG2  THR  30          1HG2      THR  30 -13.091   3.541 -12.501
  247   2HG2  THR  30          2HG2      THR  30 -12.434   3.940 -10.892
  248   3HG2  THR  30          3HG2      THR  30 -11.324   3.491 -12.220
  249    H    SER  31           H        SER  31 -10.326   1.248  -8.011
  250    HA   SER  31           HA       SER  31 -12.170   3.093  -6.634
  251   1HB   SER  31          1HB       SER  31 -10.905   0.481  -5.691
  252   2HB   SER  31          2HB       SER  31 -12.111   1.451  -4.807
  253    HG   SER  31           HG       SER  31 -12.919  -0.433  -6.071
  254    H    ASP  32           H        ASP  32 -11.390   4.434  -5.098
  255    HA   ASP  32           HA       ASP  32  -8.529   4.831  -4.818
  256   1HB   ASP  32          1HB       ASP  32 -10.358   6.559  -4.601
  257   2HB   ASP  32          2HB       ASP  32 -10.823   5.776  -3.070
  258    H    VAL  33           H        VAL  33  -7.850   2.813  -4.310
  259    HA   VAL  33           HA       VAL  33  -8.984   1.252  -2.158
  260    HB   VAL  33           HB       VAL  33  -6.582   0.844  -3.974
  261   1HG1  VAL  33          1HG1      VAL  33  -6.424  -0.496  -1.871
  262   2HG1  VAL  33          2HG1      VAL  33  -8.065  -1.114  -2.165
  263   3HG1  VAL  33          3HG1      VAL  33  -6.748  -1.528  -3.293
  264   1HG2  VAL  33          1HG2      VAL  33  -8.831   1.070  -5.017
  265   2HG2  VAL  33          2HG2      VAL  33  -8.236  -0.601  -5.160
  266   3HG2  VAL  33          3HG2      VAL  33  -9.461  -0.182  -3.934
  267    H    PHE  34           H        PHE  34  -8.088   0.640  -0.239
  268    HA   PHE  34           HA       PHE  34  -5.890   2.408   0.721
  269   1HB   PHE  34          1HB       PHE  34  -8.631   2.130   1.990
  270   2HB   PHE  34          2HB       PHE  34  -7.229   2.870   2.769
  271    HD1  PHE  34           HD1      PHE  34 -10.101   3.581   0.843
  272    HD2  PHE  34           HD2      PHE  34  -5.951   4.613   1.205
  273    HE1  PHE  34           HE1      PHE  34 -10.571   5.802  -0.172
  274    HE2  PHE  34           HE2      PHE  34  -6.422   6.867   0.221
  275    HZ   PHE  34           HZ       PHE  34  -8.737   7.432  -0.499
  276    H    LEU  35           H        LEU  35  -5.060   1.947   2.793
  277    HA   LEU  35           HA       LEU  35  -5.510  -0.738   3.917
  278   1HB   LEU  35          1HB       LEU  35  -3.002   0.147   2.547
  279   2HB   LEU  35          2HB       LEU  35  -2.848  -0.848   4.016
  280    HG   LEU  35           HG       LEU  35  -4.733  -1.566   1.777
  281   1HD1  LEU  35          1HD2      LEU  35  -2.373  -1.534   0.922
  282   2HD1  LEU  35          2HD2      LEU  35  -1.879  -2.563   2.284
  283   3HD1  LEU  35          3HD2      LEU  35  -2.975  -3.208   1.038
  284   1HD2  LEU  35          1HD1      LEU  35  -3.527  -3.134   4.092
  285   2HD2  LEU  35          2HD1      LEU  35  -5.206  -2.561   3.951
  286   3HD2  LEU  35          3HD1      LEU  35  -4.595  -3.815   2.842
  287    H    GLU  36           H        GLU  36  -6.010  -0.204   5.693
  288    HA   GLU  36           HA       GLU  36  -5.135   2.290   7.126
  289   1HB   GLU  36          1HB       GLU  36  -7.190   0.224   7.585
  290   2HB   GLU  36          2HB       GLU  36  -7.073   1.659   8.607
  291   1HG   GLU  36          1HG       GLU  36  -7.769   2.993   6.643
  292   2HG   GLU  36          2HG       GLU  36  -7.834   1.538   5.650
  293    H    LYS  37           H        LYS  37  -2.946   1.305   7.854
  294    HA   LYS  37           HA       LYS  37  -2.860  -1.335   8.986
  295   1HB   LYS  37          1HB       LYS  37  -0.942  -0.241   7.827
  296   2HB   LYS  37          2HB       LYS  37  -0.920   1.000   9.114
  297   1HG   LYS  37          1HG       LYS  37  -0.630  -0.671  10.792
  298   2HG   LYS  37          2HG       LYS  37  -0.687  -2.001   9.609
  299   1HD   LYS  37          1HD       LYS  37   1.357  -1.233   8.535
  300   2HD   LYS  37          2HD       LYS  37   1.434   0.192   9.599
  301   1HE   LYS  37          1HE       LYS  37   1.539  -2.707  10.566
  302   2HE   LYS  37          2HE       LYS  37   2.947  -1.666  10.292
  303   1HZ   LYS  37          1HZ       LYS  37   2.043  -0.151  11.935
  304   2HZ   LYS  37          2HZ       LYS  37   0.762  -1.155  12.208
  305   3HZ   LYS  37          3HZ       LYS  37   2.289  -1.649  12.573
  306    H    ASP  38           H        ASP  38  -4.204  -1.619  10.757
  307    HA   ASP  38           HA       ASP  38  -5.071  -1.320  12.822
  308   1HB   ASP  38          1HB       ASP  38  -2.644   0.428  13.346
  309   2HB   ASP  38          2HB       ASP  38  -3.739  -0.253  14.558
  310    H    GLY  39           H        GLY  39  -5.580   0.572  10.532
  311   1HA   GLY  39          1HA       GLY  39  -7.293   2.340  10.752
  312   2HA   GLY  39          2HA       GLY  39  -6.435   2.845  12.237
  313    H    LYS  40           H        LYS  40  -3.776   2.307  10.593
  314    HA   LYS  40           HA       LYS  40  -3.444   5.064   9.702
  315   1HB   LYS  40          1HB       LYS  40  -1.745   2.546   9.636
  316   2HB   LYS  40          2HB       LYS  40  -1.147   4.170   9.208
  317   1HG   LYS  40          1HG       LYS  40  -1.581   4.952  11.504
  318   2HG   LYS  40          2HG       LYS  40  -2.260   3.353  11.923
  319   1HD   LYS  40          1HD       LYS  40   0.206   3.640  12.563
  320   2HD   LYS  40          2HD       LYS  40  -0.179   2.246  11.518
  321   1HE   LYS  40          1HE       LYS  40   0.397   3.561   9.519
  322   2HE   LYS  40          2HE       LYS  40   0.824   4.954  10.535
  323   1HZ   LYS  40          1HZ       LYS  40   2.128   2.314  10.599
  324   2HZ   LYS  40          2HZ       LYS  40   2.748   3.664   9.890
  325   3HZ   LYS  40          3HZ       LYS  40   2.547   3.614  11.525
  326    H    LYS  41           H        LYS  41  -5.255   4.700   8.126
  327    HA   LYS  41           HA       LYS  41  -4.903   2.854   5.950
  328   1HB   LYS  41          1HB       LYS  41  -7.001   3.631   6.873
  329   2HB   LYS  41          2HB       LYS  41  -6.643   5.247   6.214
  330   1HG   LYS  41          1HG       LYS  41  -6.443   3.890   3.933
  331   2HG   LYS  41          2HG       LYS  41  -7.488   2.760   4.770
  332   1HD   LYS  41          1HD       LYS  41  -9.116   4.187   3.930
  333   2HD   LYS  41          2HD       LYS  41  -8.802   4.993   5.489
  334   1HE   LYS  41          1HE       LYS  41  -7.133   6.458   4.347
  335   2HE   LYS  41          2HE       LYS  41  -7.339   5.441   2.899
  336   1HZ   LYS  41          1HZ       LYS  41  -9.649   6.156   2.847
  337   2HZ   LYS  41          2HZ       LYS  41  -9.379   7.195   4.096
  338   3HZ   LYS  41          3HZ       LYS  41  -8.614   7.426   2.648
  339    H    VAL  42           H        VAL  42  -3.932   3.173   4.103
  340    HA   VAL  42           HA       VAL  42  -3.194   5.834   2.951
  341    HB   VAL  42           HB       VAL  42  -1.235   4.726   3.890
  342   1HG1  VAL  42          1HG2      VAL  42  -2.297   2.496   4.026
  343   2HG1  VAL  42          2HG2      VAL  42  -2.178   2.320   2.265
  344   3HG1  VAL  42          3HG2      VAL  42  -0.692   2.365   3.261
  345   1HG2  VAL  42          1HG1      VAL  42  -0.814   5.770   1.720
  346   2HG2  VAL  42          2HG1      VAL  42   0.210   4.334   1.974
  347   3HG2  VAL  42          3HG1      VAL  42  -1.207   4.233   0.911
  348    H    ASN  43           H        ASN  43  -2.588   5.443   0.520
  349    HA   ASN  43           HA       ASN  43  -4.865   4.066  -0.712
  350   1HB   ASN  43          1HB       ASN  43  -3.911   6.209  -1.669
  351   2HB   ASN  43          2HB       ASN  43  -2.430   5.291  -2.049
  352   1HD2  ASN  43          2HD2      ASN  43  -5.822   5.833  -2.902
  353   2HD2  ASN  43          1HD2      ASN  43  -5.782   4.852  -4.349
  354    H    ALA  44           H        ALA  44  -4.816   2.119  -0.428
  355    HA   ALA  44           HA       ALA  44  -2.892   0.246   0.063
  356   1HB   ALA  44          1HB       ALA  44  -5.383  -0.038   0.159
  357   2HB   ALA  44          2HB       ALA  44  -5.413  -0.089  -1.609
  358   3HB   ALA  44          3HB       ALA  44  -4.612  -1.391  -0.701
  359    H    LYS  45           H        LYS  45  -4.019   1.322  -3.142
  360    HA   LYS  45           HA       LYS  45  -2.471  -0.797  -4.468
  361   1HB   LYS  45          1HB       LYS  45  -3.418   0.255  -6.540
  362   2HB   LYS  45          2HB       LYS  45  -4.638  -0.366  -5.409
  363   1HG   LYS  45          1HG       LYS  45  -5.216   1.843  -4.677
  364   2HG   LYS  45          2HG       LYS  45  -3.718   2.522  -5.314
  365   1HD   LYS  45          1HD       LYS  45  -5.404   3.171  -6.857
  366   2HD   LYS  45          2HD       LYS  45  -4.504   1.865  -7.653
  367   1HE   LYS  45          1HE       LYS  45  -6.280   0.243  -6.910
  368   2HE   LYS  45          2HE       LYS  45  -7.186   1.590  -6.193
  369   1HZ   LYS  45          1HZ       LYS  45  -6.505   1.370  -9.035
  370   2HZ   LYS  45          2HZ       LYS  45  -7.963   1.011  -8.365
  371   3HZ   LYS  45          3HZ       LYS  45  -7.404   2.558  -8.320
  372    H    SER  46           H        SER  46  -1.731   2.312  -3.278
  373    HA   SER  46           HA       SER  46   0.228   2.733  -5.469
  374   1HB   SER  46          1HB       SER  46  -0.737   4.575  -3.252
  375   2HB   SER  46          2HB       SER  46   0.476   4.999  -4.484
  376    HG   SER  46           HG       SER  46  -2.202   4.195  -4.982
  377    H    ILE  47           H        ILE  47   2.293   3.542  -4.881
  378    HA   ILE  47           HA       ILE  47   4.110   2.146  -3.603
  379    HB   ILE  47           HB       ILE  47   4.767   4.063  -4.771
  380   1HG1  ILE  47          1HG1      ILE  47   6.089   3.462  -2.534
  381   2HG1  ILE  47          2HG1      ILE  47   6.500   4.901  -3.508
  382   1HG2  ILE  47          1HG2      ILE  47   2.777   5.450  -4.362
  383   2HG2  ILE  47          2HG2      ILE  47   3.361   5.797  -2.718
  384   3HG2  ILE  47          3HG2      ILE  47   4.280   6.379  -4.121
  385   1HD1  ILE  47          1HD1      ILE  47   5.137   6.318  -2.031
  386   2HD1  ILE  47          2HD1      ILE  47   4.700   4.898  -1.058
  387   3HD1  ILE  47          3HD1      ILE  47   6.388   5.453  -1.103
  388    H    MET  48           H        MET  48   2.563   4.828  -1.754
  389    HA   MET  48           HA       MET  48   3.781   3.972   0.676
  390   1HB   MET  48          1HB       MET  48   3.096   6.284   0.231
  391   2HB   MET  48          2HB       MET  48   1.386   5.796   0.252
  392   1HG   MET  48          1HG       MET  48   1.644   5.018   2.575
  393   2HG   MET  48          2HG       MET  48   3.364   5.416   2.549
  394   1HE   MET  48          1HE       MET  48  -0.232   6.822   2.178
  395   2HE   MET  48          2HE       MET  48   0.012   8.580   2.310
  396   3HE   MET  48          3HE       MET  48   0.622   7.701   0.882
  397    H    GLY  49           H        GLY  49   0.830   2.929  -0.916
  398   1HA   GLY  49          1HA       GLY  49  -0.542   1.955   1.440
  399   2HA   GLY  49          2HA       GLY  49  -0.853   1.519  -0.263
  400    H    LEU  50           H        LEU  50   1.351   0.488  -1.255
  401    HA   LEU  50           HA       LEU  50   1.775  -2.080  -0.179
  402   1HB   LEU  50          1HB       LEU  50   2.793  -0.328  -2.270
  403   2HB   LEU  50          2HB       LEU  50   4.127  -1.194  -1.498
  404    HG   LEU  50           HG       LEU  50   1.677  -2.631  -2.576
  405   1HD1  LEU  50          1HD1      LEU  50   4.447  -2.302  -3.801
  406   2HD1  LEU  50          2HD1      LEU  50   3.166  -3.378  -4.402
  407   3HD1  LEU  50          3HD1      LEU  50   2.935  -1.613  -4.451
  408   1HD2  LEU  50          1HD2      LEU  50   4.453  -3.523  -1.665
  409   2HD2  LEU  50          2HD2      LEU  50   2.933  -3.789  -0.789
  410   3HD2  LEU  50          3HD2      LEU  50   3.210  -4.605  -2.347
  411    H    MET  51           H        MET  51   4.210   0.442  -0.465
  412    HA   MET  51           HA       MET  51   6.216  -0.764   1.005
  413   1HB   MET  51          1HB       MET  51   5.643   2.136   0.308
  414   2HB   MET  51          2HB       MET  51   7.208   1.573   0.917
  415   1HG   MET  51          1HG       MET  51   7.312  -0.062  -0.967
  416   2HG   MET  51          2HG       MET  51   5.840   0.669  -1.625
  417   1HE   MET  51          1HE       MET  51   6.787   3.640  -0.431
  418   2HE   MET  51          2HE       MET  51   8.371   3.062   0.136
  419   3HE   MET  51          3HE       MET  51   8.281   4.260  -1.179
  420    H    SER  52           H        SER  52   3.744   1.600   2.147
  421    HA   SER  52           HA       SER  52   5.204   1.778   4.694
  422   1HB   SER  52          1HB       SER  52   2.601   3.017   3.800
  423   2HB   SER  52          2HB       SER  52   3.481   3.394   5.307
  424    HG   SER  52           HG       SER  52   4.645   3.609   2.711
  425    H    LEU  53           H        LEU  53   1.724   1.288   4.069
  426    HA   LEU  53           HA       LEU  53   1.411   0.210   6.758
  427   1HB   LEU  53          1HB       LEU  53  -0.501   0.752   4.512
  428   2HB   LEU  53          2HB       LEU  53  -0.962   0.138   6.119
  429    HG   LEU  53           HG       LEU  53  -1.225   2.433   6.373
  430   1HD1  LEU  53          1HD1      LEU  53   1.603   1.824   7.290
  431   2HD1  LEU  53          2HD1      LEU  53   0.596   3.171   7.880
  432   3HD1  LEU  53          3HD1      LEU  53   0.106   1.487   8.198
  433   1HD2  LEU  53          1HD2      LEU  53  -0.136   3.200   4.295
  434   2HD2  LEU  53          2HD2      LEU  53   0.420   4.145   5.693
  435   3HD2  LEU  53          3HD2      LEU  53   1.458   2.869   5.012
  436    H    ALA  54           H        ALA  54   0.883  -0.946   3.420
  437    HA   ALA  54           HA       ALA  54  -0.027  -3.554   4.029
  438   1HB   ALA  54          1HB       ALA  54   1.448  -2.365   1.650
  439   2HB   ALA  54          2HB       ALA  54   0.664  -3.956   1.657
  440   3HB   ALA  54          3HB       ALA  54  -0.316  -2.484   1.846
  441    H    VAL  55           H        VAL  55   3.230  -2.236   3.483
  442    HA   VAL  55           HA       VAL  55   4.511  -4.813   3.895
  443    HB   VAL  55           HB       VAL  55   5.643  -1.980   3.769
  444   1HG1  VAL  55          1HG2      VAL  55   7.042  -4.698   3.793
  445   2HG1  VAL  55          2HG2      VAL  55   7.825  -3.148   3.400
  446   3HG1  VAL  55          3HG2      VAL  55   7.180  -3.430   5.036
  447   1HG2  VAL  55          1HG1      VAL  55   4.638  -2.891   1.672
  448   2HG2  VAL  55          2HG1      VAL  55   6.401  -2.675   1.550
  449   3HG2  VAL  55          3HG1      VAL  55   5.717  -4.301   1.795
  450    H    SER  56           H        SER  56   3.020  -4.973   5.772
  451    HA   SER  56           HA       SER  56   4.674  -4.863   8.178
  452   1HB   SER  56          1HB       SER  56   2.138  -3.273   7.729
  453   2HB   SER  56          2HB       SER  56   2.524  -3.886   9.362
  454    HG   SER  56           HG       SER  56   4.418  -2.465   7.778
  455    H    THR  57           H        THR  57   4.388  -7.151   7.002
  456    HA   THR  57           HA       THR  57   2.272  -8.724   7.137
  457    HB   THR  57           HB       THR  57   4.830  -9.646   8.445
  458    HG1  THR  57           HG1      THR  57   5.463  -9.908   6.170
  459   1HG2  THR  57          1HG2      THR  57   4.356 -11.609   6.981
  460   2HG2  THR  57          2HG2      THR  57   3.013 -11.272   8.110
  461   3HG2  THR  57          3HG2      THR  57   2.882 -10.793   6.398
  462    H    GLY  58           H        GLY  58   0.855  -9.491   8.518
  463   1HA   GLY  58          1HA       GLY  58   0.034 -10.314  10.594
  464   2HA   GLY  58          2HA       GLY  58   1.525  -9.757  11.370
  465    H    THR  59           H        THR  59   0.543  -7.016   9.676
  466    HA   THR  59           HA       THR  59  -0.565  -5.974  12.200
  467    HB   THR  59           HB       THR  59  -0.247  -4.476   9.567
  468    HG1  THR  59           HG1      THR  59   1.750  -5.404  10.293
  469   1HG2  THR  59          1HG2      THR  59  -0.272  -3.617  12.491
  470   2HG2  THR  59          2HG2      THR  59  -0.127  -2.540  11.088
  471   3HG2  THR  59          3HG2      THR  59  -1.635  -3.454  11.359
  472    H    GLU  60           H        GLU  60  -2.756  -5.501  12.506
  473    HA   GLU  60           HA       GLU  60  -4.505  -6.544  10.400
  474   1HB   GLU  60          1HB       GLU  60  -6.296  -6.306  11.944
  475   2HB   GLU  60          2HB       GLU  60  -4.940  -7.080  12.777
  476   1HG   GLU  60          1HG       GLU  60  -4.335  -5.021  13.928
  477   2HG   GLU  60          2HG       GLU  60  -5.482  -4.091  12.947
  478    H    VAL  61           H        VAL  61  -4.350  -5.272   8.716
  479    HA   VAL  61           HA       VAL  61  -4.939  -2.389   9.149
  480    HB   VAL  61           HB       VAL  61  -3.466  -1.876   7.294
  481   1HG1  VAL  61          1HG1      VAL  61  -2.234  -4.064   9.043
  482   2HG1  VAL  61          2HG1      VAL  61  -1.313  -2.873   8.090
  483   3HG1  VAL  61          3HG1      VAL  61  -2.315  -2.332   9.456
  484   1HG2  VAL  61          1HG2      VAL  61  -3.141  -4.890   7.071
  485   2HG2  VAL  61          2HG2      VAL  61  -4.027  -3.864   5.906
  486   3HG2  VAL  61          3HG2      VAL  61  -2.255  -3.672   6.115
  487    H    THR  62           H        THR  62  -6.607  -1.530   8.073
  488    HA   THR  62           HA       THR  62  -8.469  -3.353   6.870
  489    HB   THR  62           HB       THR  62  -8.686  -0.369   6.791
  490    HG1  THR  62           HG1      THR  62  -9.140  -0.305   8.951
  491   1HG2  THR  62          1HG2      THR  62 -11.055  -0.973   7.374
  492   2HG2  THR  62          2HG2      THR  62 -10.502  -1.824   5.914
  493   3HG2  THR  62          3HG2      THR  62 -10.575  -2.685   7.467
  494    H    LEU  63           H        LEU  63  -8.565  -3.925   4.736
  495    HA   LEU  63           HA       LEU  63  -7.295  -2.100   2.796
  496   1HB   LEU  63          1HB       LEU  63  -7.089  -4.754   3.079
  497   2HB   LEU  63          2HB       LEU  63  -8.425  -4.705   1.889
  498    HG   LEU  63           HG       LEU  63  -5.851  -3.068   1.705
  499   1HD1  LEU  63          1HD1      LEU  63  -5.439  -5.510   1.799
  500   2HD1  LEU  63          2HD1      LEU  63  -6.527  -5.733   0.410
  501   3HD1  LEU  63          3HD1      LEU  63  -5.013  -4.810   0.223
  502   1HD2  LEU  63          1HD2      LEU  63  -7.971  -3.826  -0.354
  503   2HD2  LEU  63          2HD2      LEU  63  -7.706  -2.204   0.330
  504   3HD2  LEU  63          3HD2      LEU  63  -6.468  -2.942  -0.710
  505    H    ILE  64           H        ILE  64  -8.424  -0.752   1.687
  506    HA   ILE  64           HA       ILE  64 -11.409  -0.911   1.616
  507    HB   ILE  64           HB       ILE  64  -9.470   1.426   1.387
  508   1HG1  ILE  64          1HG1      ILE  64 -11.336   0.692   3.666
  509   2HG1  ILE  64          2HG1      ILE  64  -9.565   0.478   3.673
  510   1HG2  ILE  64          1HG2      ILE  64 -11.558   1.832   0.157
  511   2HG2  ILE  64          2HG2      ILE  64 -12.496   1.439   1.618
  512   3HG2  ILE  64          3HG2      ILE  64 -11.435   2.871   1.602
  513   1HD1  ILE  64          1HD1      ILE  64  -9.296   2.919   3.306
  514   2HD1  ILE  64          2HD1      ILE  64 -11.073   3.118   3.382
  515   3HD1  ILE  64          3HD1      ILE  64 -10.160   2.548   4.817
  516    H    ALA  65           H        ALA  65 -12.452  -0.103  -0.275
  517    HA   ALA  65           HA       ALA  65 -10.801   0.750  -2.497
  518   1HB   ALA  65          1HB       ALA  65 -11.056  -1.696  -3.042
  519   2HB   ALA  65          2HB       ALA  65 -12.825  -1.498  -2.906
  520   3HB   ALA  65          3HB       ALA  65 -11.936  -0.659  -4.187
  521    H    GLN  66           H        GLN  66 -11.542   2.632  -2.788
  522    HA   GLN  66           HA       GLN  66 -14.481   3.012  -2.562
  523   1HB   GLN  66          1HB       GLN  66 -12.924   4.099  -0.846
  524   2HB   GLN  66          2HB       GLN  66 -12.105   4.903  -2.209
  525   1HG   GLN  66          1HG       GLN  66 -14.665   5.516  -2.756
  526   2HG   GLN  66          2HG       GLN  66 -14.733   5.436  -0.972
  527   1HE2  GLN  66          2HE2      GLN  66 -12.708   6.641  -3.670
  528   2HE2  GLN  66          1HE2      GLN  66 -12.142   8.111  -2.863
  529    H    GLY  67           H        GLY  67 -14.298   2.098  -4.813
  530   1HA   GLY  67          1HA       GLY  67 -14.007   4.314  -6.776
  531   2HA   GLY  67          2HA       GLY  67 -13.142   2.811  -6.968
  532    H    GLU  68           H        GLU  68 -14.385   2.880  -8.966
  533    HA   GLU  68           HA       GLU  68 -17.097   2.261  -9.237
  534   1HB   GLU  68          1HB       GLU  68 -14.704   1.117 -10.780
  535   2HB   GLU  68          2HB       GLU  68 -16.388   1.105 -11.323
  536   1HG   GLU  68          1HG       GLU  68 -16.362   3.653 -11.111
  537   2HG   GLU  68          2HG       GLU  68 -14.602   3.531 -10.914
  538    H    ASP  69           H        ASP  69 -14.369   0.089  -8.208
  539    HA   ASP  69           HA       ASP  69 -16.444  -2.028  -7.879
  540   1HB   ASP  69          1HB       ASP  69 -13.555  -2.697  -8.114
  541   2HB   ASP  69          2HB       ASP  69 -14.975  -3.698  -8.437
  542    H    GLU  70           H        GLU  70 -16.344  -0.009  -6.091
  543    HA   GLU  70           HA       GLU  70 -14.311  -0.017  -4.234
  544   1HB   GLU  70          1HB       GLU  70 -16.184   0.685  -2.642
  545   2HB   GLU  70          2HB       GLU  70 -15.893   1.678  -4.081
  546   1HG   GLU  70          1HG       GLU  70 -17.924   1.273  -4.970
  547   2HG   GLU  70          2HG       GLU  70 -17.827  -0.461  -4.599
  548    H    GLN  71           H        GLN  71 -17.381  -1.403  -3.084
  549    HA   GLN  71           HA       GLN  71 -16.427  -3.094  -1.205
  550   1HB   GLN  71          1HB       GLN  71 -18.814  -3.101  -3.002
  551   2HB   GLN  71          2HB       GLN  71 -18.460  -4.601  -2.118
  552   1HG   GLN  71          1HG       GLN  71 -18.743  -1.858  -0.836
  553   2HG   GLN  71          2HG       GLN  71 -19.968  -3.138  -0.829
  554   1HE2  GLN  71          2HE2      GLN  71 -17.564  -5.173  -0.616
  555   2HE2  GLN  71          1HE2      GLN  71 -17.210  -5.146   1.090
  556    H    GLU  72           H        GLU  72 -16.632  -3.919  -4.695
  557    HA   GLU  72           HA       GLU  72 -15.982  -6.682  -4.312
  558   1HB   GLU  72          1HB       GLU  72 -16.880  -6.477  -6.381
  559   2HB   GLU  72          2HB       GLU  72 -16.468  -4.760  -6.484
  560   1HG   GLU  72          1HG       GLU  72 -14.217  -5.256  -7.194
  561   2HG   GLU  72          2HG       GLU  72 -14.515  -7.006  -7.062
  562    H    ALA  73           H        ALA  73 -14.024  -3.722  -5.043
  563    HA   ALA  73           HA       ALA  73 -11.561  -5.092  -5.430
  564   1HB   ALA  73          1HB       ALA  73 -12.420  -2.321  -4.547
  565   2HB   ALA  73          2HB       ALA  73 -10.731  -2.718  -5.001
  566   3HB   ALA  73          3HB       ALA  73 -12.072  -2.830  -6.189
  567    H    LEU  74           H        LEU  74 -12.898  -3.239  -2.655
  568    HA   LEU  74           HA       LEU  74 -10.750  -3.752  -0.901
  569   1HB   LEU  74          1HB       LEU  74 -12.327  -3.006   0.863
  570   2HB   LEU  74          2HB       LEU  74 -12.312  -2.004  -0.614
  571    HG   LEU  74           HG       LEU  74 -14.263  -3.748  -1.280
  572   1HD1  LEU  74          1HD1      LEU  74 -14.552  -3.150   1.694
  573   2HD1  LEU  74          2HD1      LEU  74 -15.799  -3.869   0.639
  574   3HD1  LEU  74          3HD1      LEU  74 -14.293  -4.759   0.965
  575   1HD2  LEU  74          1HD2      LEU  74 -14.446  -1.076   0.179
  576   2HD2  LEU  74          2HD2      LEU  74 -14.207  -1.324  -1.563
  577   3HD2  LEU  74          3HD2      LEU  74 -15.735  -1.808  -0.810
  578    H    GLU  75           H        GLU  75 -13.738  -5.705  -1.453
  579    HA   GLU  75           HA       GLU  75 -13.157  -7.635   0.560
  580   1HB   GLU  75          1HB       GLU  75 -14.560  -7.945  -2.123
  581   2HB   GLU  75          2HB       GLU  75 -14.586  -9.137  -0.794
  582   1HG   GLU  75          1HG       GLU  75 -15.602  -6.283  -0.641
  583   2HG   GLU  75          2HG       GLU  75 -16.621  -7.732  -0.750
  584    H    LYS  76           H        LYS  76 -12.293  -7.608  -2.960
  585    HA   LYS  76           HA       LYS  76 -10.877 -10.018  -3.183
  586   1HB   LYS  76          1HB       LYS  76 -10.223  -7.233  -4.224
  587   2HB   LYS  76          2HB       LYS  76  -9.499  -8.727  -4.857
  588   1HG   LYS  76          1HG       LYS  76 -12.476  -8.387  -4.697
  589   2HG   LYS  76          2HG       LYS  76 -11.604  -7.632  -6.033
  590   1HD   LYS  76          1HD       LYS  76 -11.368 -10.598  -5.337
  591   2HD   LYS  76          2HD       LYS  76 -12.361  -9.947  -6.662
  592   1HE   LYS  76          1HE       LYS  76 -10.292  -8.926  -7.662
  593   2HE   LYS  76          2HE       LYS  76  -9.331  -9.597  -6.338
  594   1HZ   LYS  76          1HZ       LYS  76 -10.877 -11.176  -8.278
  595   2HZ   LYS  76          2HZ       LYS  76  -9.246 -10.961  -8.297
  596   3HZ   LYS  76          3HZ       LYS  76  -9.948 -11.783  -7.057
  597    H    LEU  77           H        LEU  77  -9.670  -6.816  -2.434
  598    HA   LEU  77           HA       LEU  77  -6.991  -7.684  -2.001
  599   1HB   LEU  77          1HB       LEU  77  -8.392  -5.068  -1.441
  600   2HB   LEU  77          2HB       LEU  77  -6.657  -5.365  -1.170
  601    HG   LEU  77           HG       LEU  77  -6.864  -4.408  -3.410
  602   1HD1  LEU  77          1HD2      LEU  77  -6.686  -7.444  -3.605
  603   2HD1  LEU  77          2HD2      LEU  77  -6.133  -6.289  -4.836
  604   3HD1  LEU  77          3HD2      LEU  77  -5.307  -6.353  -3.252
  605   1HD2  LEU  77          1HD1      LEU  77  -9.266  -5.066  -3.817
  606   2HD2  LEU  77          2HD1      LEU  77  -8.176  -5.474  -5.182
  607   3HD2  LEU  77          3HD1      LEU  77  -8.703  -6.732  -4.043
  608    H    ALA  78           H        ALA  78  -9.348  -6.498   0.542
  609    HA   ALA  78           HA       ALA  78  -7.427  -7.138   2.601
  610   1HB   ALA  78          1HB       ALA  78 -10.436  -6.802   2.891
  611   2HB   ALA  78          2HB       ALA  78  -9.255  -6.911   4.205
  612   3HB   ALA  78          3HB       ALA  78  -9.191  -5.542   3.111
  613    H    ALA  79           H        ALA  79  -9.821  -9.103   0.837
  614    HA   ALA  79           HA       ALA  79  -9.711 -11.389   2.549
  615   1HB   ALA  79          1HB       ALA  79 -11.252 -11.040   0.564
  616   2HB   ALA  79          2HB       ALA  79  -9.815 -11.193  -0.489
  617   3HB   ALA  79          3HB       ALA  79 -10.354 -12.586   0.480
  618    H    TYR  80           H        TYR  80  -7.912 -10.437  -0.383
  619    HA   TYR  80           HA       TYR  80  -6.259 -12.689  -0.628
  620   1HB   TYR  80          1HB       TYR  80  -6.790 -11.011  -2.318
  621   2HB   TYR  80          2HB       TYR  80  -5.827  -9.808  -1.457
  622    HD1  TYR  80           HD1      TYR  80  -5.157 -13.411  -2.267
  623    HD2  TYR  80           HD2      TYR  80  -3.855  -9.326  -2.639
  624    HE1  TYR  80           HE1      TYR  80  -3.027 -14.183  -3.282
  625    HE2  TYR  80           HE2      TYR  80  -1.677 -10.112  -3.584
  626    HH   TYR  80           HH       TYR  80  -0.836 -13.544  -3.621
  627    H    VAL  81           H        VAL  81  -5.388  -9.487   0.591
  628    HA   VAL  81           HA       VAL  81  -2.778  -9.625   1.267
  629    HB   VAL  81           HB       VAL  81  -3.357  -8.052   3.129
  630   1HG1  VAL  81          1HG2      VAL  81  -3.306  -7.359   0.739
  631   2HG1  VAL  81          2HG2      VAL  81  -5.053  -7.727   0.647
  632   3HG1  VAL  81          3HG2      VAL  81  -4.478  -6.423   1.718
  633   1HG2  VAL  81          1HG1      VAL  81  -6.209  -8.930   2.428
  634   2HG2  VAL  81          2HG1      VAL  81  -5.362  -9.288   3.933
  635   3HG2  VAL  81          3HG1      VAL  81  -5.788  -7.615   3.553
  636    H    GLN  82           H        GLN  82  -5.370 -11.073   3.236
  637    HA   GLN  82           HA       GLN  82  -3.331 -11.772   5.289
  638   1HB   GLN  82          1HB       GLN  82  -5.276 -11.580   6.835
  639   2HB   GLN  82          2HB       GLN  82  -5.108 -10.113   5.865
  640   1HG   GLN  82          1HG       GLN  82  -6.947 -10.941   4.412
  641   2HG   GLN  82          2HG       GLN  82  -6.932 -12.455   5.272
  642   1HE2  GLN  82          2HE2      GLN  82  -8.630  -9.868   5.064
  643   2HE2  GLN  82          1HE2      GLN  82  -9.161  -9.466   6.711
  644    H    GLU  83           H        GLU  83  -4.426 -13.322   2.734
  645    HA   GLU  83           HA       GLU  83  -5.487 -15.561   4.355
  646   1HB   GLU  83          1HB       GLU  83  -6.887 -16.093   2.485
  647   2HB   GLU  83          2HB       GLU  83  -6.920 -14.321   2.749
  648   1HG   GLU  83          1HG       GLU  83  -5.329 -13.987   0.934
  649   2HG   GLU  83          2HG       GLU  83  -5.247 -15.740   0.637
  650    H    GLU  84           H        GLU  84  -3.393 -15.177   1.392
  651    HA   GLU  84           HA       GLU  84  -2.755 -18.043   1.725
  652   1HB   GLU  84          1HB       GLU  84  -1.725 -17.806  -0.496
  653   2HB   GLU  84          2HB       GLU  84  -3.439 -17.292  -0.503
  654   1HG   GLU  84          1HG       GLU  84  -2.758 -14.938  -0.316
  655   2HG   GLU  84          2HG       GLU  84  -1.110 -15.485   0.053
  656    H    VAL  85           H        VAL  85  -1.729 -17.265   3.663
  657    HA   VAL  85           HA       VAL  85   0.248 -16.192   4.710
  658    HB   VAL  85           HB       VAL  85   1.519 -18.340   5.385
  659   1HG1  VAL  85          1HG1      VAL  85  -1.561 -18.610   5.622
  660   2HG1  VAL  85          2HG1      VAL  85  -0.360 -19.520   6.574
  661   3HG1  VAL  85          3HG1      VAL  85  -0.488 -17.782   6.776
  662   1HG2  VAL  85          1HG2      VAL  85   1.246 -19.669   3.244
  663   2HG2  VAL  85          2HG2      VAL  85   0.694 -20.569   4.661
  664   3HG2  VAL  85          3HG2      VAL  85  -0.498 -19.828   3.562
  Start of MODEL    8
    1   1H    VAL   2          1H        VAL   2 -16.562   6.939  -1.548
    2   2H    VAL   2          2H        VAL   2 -16.621   6.083  -2.994
    3   3H    VAL   2          3H        VAL   2 -17.909   7.068  -2.546
    4    HA   VAL   2           HA       VAL   2 -18.419   5.694  -0.698
    5    HB   VAL   2           HB       VAL   2 -18.105   4.054  -3.226
    6   1HG1  VAL   2          1HG2      VAL   2 -18.831   2.793  -1.207
    7   2HG1  VAL   2          2HG2      VAL   2 -20.142   3.970  -0.953
    8   3HG1  VAL   2          3HG2      VAL   2 -20.148   2.931  -2.399
    9   1HG2  VAL   2          1HG1      VAL   2 -19.146   6.252  -3.686
   10   2HG2  VAL   2          2HG1      VAL   2 -20.342   4.939  -3.817
   11   3HG2  VAL   2          3HG1      VAL   2 -20.315   5.976  -2.370
   12    H    GLN   3           H        GLN   3 -17.000   5.184   0.971
   13    HA   GLN   3           HA       GLN   3 -14.770   3.366   0.248
   14   1HB   GLN   3          1HB       GLN   3 -14.340   5.690   1.239
   15   2HB   GLN   3          2HB       GLN   3 -15.062   5.076   2.741
   16   1HG   GLN   3          1HG       GLN   3 -13.334   3.288   2.816
   17   2HG   GLN   3          2HG       GLN   3 -12.632   3.912   1.304
   18   1HE2  GLN   3          2HE2      GLN   3 -12.676   4.248   4.758
   19   2HE2  GLN   3          1HE2      GLN   3 -11.654   5.672   4.803
   20    H    GLN   4           H        GLN   4 -14.679   1.337   1.018
   21    HA   GLN   4           HA       GLN   4 -15.967   0.793   3.636
   22   1HB   GLN   4          1HB       GLN   4 -17.487  -0.117   1.996
   23   2HB   GLN   4          2HB       GLN   4 -16.154  -0.803   1.059
   24   1HG   GLN   4          1HG       GLN   4 -17.285  -2.572   2.256
   25   2HG   GLN   4          2HG       GLN   4 -15.646  -2.366   2.904
   26   1HE2  GLN   4          2HE2      GLN   4 -18.703  -3.046   3.797
   27   2HE2  GLN   4          1HE2      GLN   4 -18.719  -2.345   5.416
   28    H    LYS   5           H        LYS   5 -14.770  -1.035   4.797
   29    HA   LYS   5           HA       LYS   5 -12.190  -1.761   3.623
   30   1HB   LYS   5          1HB       LYS   5 -10.961  -0.964   5.585
   31   2HB   LYS   5          2HB       LYS   5 -11.704   0.381   4.692
   32   1HG   LYS   5          1HG       LYS   5 -13.073  -0.912   7.057
   33   2HG   LYS   5          2HG       LYS   5 -11.879   0.397   7.280
   34   1HD   LYS   5          1HD       LYS   5 -13.202   1.966   6.104
   35   2HD   LYS   5          2HD       LYS   5 -14.201   0.705   5.359
   36   1HE   LYS   5          1HE       LYS   5 -14.157   1.296   8.344
   37   2HE   LYS   5          2HE       LYS   5 -15.409   1.859   7.214
   38   1HZ   LYS   5          1HZ       LYS   5 -14.744  -0.969   7.691
   39   2HZ   LYS   5          2HZ       LYS   5 -16.022  -0.167   8.357
   40   3HZ   LYS   5          3HZ       LYS   5 -15.943  -0.394   6.724
   41    H    VAL   6           H        VAL   6 -11.464  -3.701   4.404
   42    HA   VAL   6           HA       VAL   6 -12.854  -4.867   6.756
   43    HB   VAL   6           HB       VAL   6 -12.768  -7.088   5.568
   44   1HG1  VAL   6          1HG1      VAL   6 -14.427  -4.897   4.255
   45   2HG1  VAL   6          2HG1      VAL   6 -14.772  -6.645   4.177
   46   3HG1  VAL   6          3HG1      VAL   6 -14.860  -5.787   5.736
   47   1HG2  VAL   6          1HG2      VAL   6 -11.106  -6.444   3.827
   48   2HG2  VAL   6          2HG2      VAL   6 -12.601  -7.103   3.118
   49   3HG2  VAL   6          3HG2      VAL   6 -12.306  -5.348   3.108
   50    H    GLU   7           H        GLU   7 -11.263  -5.414   8.282
   51    HA   GLU   7           HA       GLU   7  -8.558  -4.976   7.289
   52   1HB   GLU   7          1HB       GLU   7  -7.860  -4.959   9.626
   53   2HB   GLU   7          2HB       GLU   7  -9.234  -3.879   9.355
   54   1HG   GLU   7          1HG       GLU   7  -9.722  -4.973  11.379
   55   2HG   GLU   7          2HG       GLU   7 -10.696  -5.869  10.192
   56    H    VAL   8           H        VAL   8  -6.740  -6.249   8.021
   57    HA   VAL   8           HA       VAL   8  -7.236  -9.162   8.114
   58    HB   VAL   8           HB       VAL   8  -6.356  -9.551   6.047
   59   1HG1  VAL   8          1HG2      VAL   8  -8.117  -7.827   5.617
   60   2HG1  VAL   8          2HG2      VAL   8  -6.852  -6.582   5.603
   61   3HG1  VAL   8          3HG2      VAL   8  -6.856  -7.864   4.357
   62   1HG2  VAL   8          1HG1      VAL   8  -4.099  -8.806   6.660
   63   2HG2  VAL   8          2HG1      VAL   8  -4.503  -8.343   4.995
   64   3HG2  VAL   8          3HG1      VAL   8  -4.547  -7.124   6.295
   65    H    ARG   9           H        ARG   9  -5.333 -10.257   9.103
   66    HA   ARG   9           HA       ARG   9  -3.392  -8.258  10.172
   67   1HB   ARG   9          1HB       ARG   9  -3.892  -9.708  11.908
   68   2HB   ARG   9          2HB       ARG   9  -3.799 -11.165  10.873
   69   1HG   ARG   9          1HG       ARG   9  -1.316  -9.598  10.912
   70   2HG   ARG   9          2HG       ARG   9  -1.731 -10.236  12.508
   71   1HD   ARG   9          1HD       ARG   9  -2.062 -12.490  11.550
   72   2HD   ARG   9          2HD       ARG   9  -1.720 -11.848   9.931
   73    HE   ARG   9           HE       ARG   9   0.235 -12.149  12.165
   74   1HH1  ARG   9          1HH2      ARG   9  -0.496 -11.509   8.762
   75   2HH1  ARG   9          2HH2      ARG   9   1.128 -11.817   8.211
   76   1HH2  ARG   9          2HH1      ARG   9   2.393 -12.478  11.461
   77   2HH2  ARG   9          1HH1      ARG   9   2.811 -12.357   9.777
   78    H    LEU  10           H        LEU  10  -2.791  -7.627   8.344
   79    HA   LEU  10           HA       LEU  10  -2.151  -8.306   5.914
   80   1HB   LEU  10          1HB       LEU  10  -1.738  -6.181   7.079
   81   2HB   LEU  10          2HB       LEU  10  -0.383  -6.898   7.960
   82    HG   LEU  10           HG       LEU  10   0.936  -7.041   5.908
   83   1HD1  LEU  10          1HD1      LEU  10  -1.533  -5.798   4.599
   84   2HD1  LEU  10          2HD1      LEU  10   0.065  -6.008   3.839
   85   3HD1  LEU  10          3HD1      LEU  10  -0.902  -7.434   4.277
   86   1HD2  LEU  10          1HD2      LEU  10   0.833  -5.025   7.363
   87   2HD2  LEU  10          2HD2      LEU  10   1.169  -4.625   5.666
   88   3HD2  LEU  10          3HD2      LEU  10  -0.466  -4.370   6.333
   89    H    LYS  11           H        LYS  11  -1.687 -10.580   5.560
   90    HA   LYS  11           HA       LYS  11   0.958 -11.394   6.601
   91   1HB   LYS  11          1HB       LYS  11  -0.635 -13.007   7.125
   92   2HB   LYS  11          2HB       LYS  11  -1.409 -12.939   5.524
   93   1HG   LYS  11          1HG       LYS  11   1.462 -13.833   5.696
   94   2HG   LYS  11          2HG       LYS  11   0.106 -14.956   6.024
   95   1HD   LYS  11          1HD       LYS  11   0.489 -13.240   3.526
   96   2HD   LYS  11          2HD       LYS  11   0.439 -15.005   3.581
   97   1HE   LYS  11          1HE       LYS  11  -1.838 -13.112   4.230
   98   2HE   LYS  11          2HE       LYS  11  -1.670 -14.186   2.824
   99   1HZ   LYS  11          1HZ       LYS  11  -1.665 -16.057   4.368
  100   2HZ   LYS  11          2HZ       LYS  11  -1.861 -15.043   5.649
  101   3HZ   LYS  11          3HZ       LYS  11  -3.056 -15.201   4.537
  102    H    THR  12           H        THR  12  -0.601 -10.291   3.665
  103    HA   THR  12           HA       THR  12   1.324 -11.181   1.799
  104    HB   THR  12           HB       THR  12   0.749  -8.847   0.733
  105    HG1  THR  12           HG1      THR  12  -1.069  -7.885   1.690
  106   1HG2  THR  12          1HG2      THR  12  -1.481 -10.828   1.372
  107   2HG2  THR  12          2HG2      THR  12  -1.485  -9.651   0.033
  108   3HG2  THR  12          3HG2      THR  12  -0.309 -10.983   0.046
  109    H    GLY  13           H        GLY  13   1.248  -8.642   4.205
  110   1HA   GLY  13          1HA       GLY  13   2.594  -6.943   4.864
  111   2HA   GLY  13          2HA       GLY  13   3.850  -8.190   4.938
  112    H    LEU  14           H        LEU  14   2.105  -6.843   2.274
  113    HA   LEU  14           HA       LEU  14   2.804  -6.339   0.101
  114   1HB   LEU  14          1HB       LEU  14   3.557  -4.273   2.077
  115   2HB   LEU  14          2HB       LEU  14   3.970  -3.996   0.378
  116    HG   LEU  14           HG       LEU  14   1.638  -3.227   1.306
  117   1HD1  LEU  14          1HD2      LEU  14   2.249  -3.099  -1.075
  118   2HD1  LEU  14          2HD2      LEU  14   1.723  -4.785  -1.285
  119   3HD1  LEU  14          3HD2      LEU  14   0.543  -3.539  -0.827
  120   1HD2  LEU  14          1HD1      LEU  14   0.937  -5.421   2.231
  121   2HD2  LEU  14          2HD1      LEU  14  -0.175  -4.870   0.952
  122   3HD2  LEU  14          3HD1      LEU  14   1.032  -6.133   0.600
  123    H    GLN  15           H        GLN  15   4.315  -8.369   0.821
  124    HA   GLN  15           HA       GLN  15   7.132  -7.852   0.470
  125   1HB   GLN  15          1HB       GLN  15   5.444 -10.374   0.543
  126   2HB   GLN  15          2HB       GLN  15   7.223 -10.397   0.445
  127   1HG   GLN  15          1HG       GLN  15   7.472  -9.341   2.553
  128   2HG   GLN  15          2HG       GLN  15   5.823  -8.698   2.513
  129   1HE2  GLN  15          2HE2      GLN  15   6.979 -12.160   2.099
  130   2HE2  GLN  15          1HE2      GLN  15   5.942 -12.725   3.405
  131    H    ALA  16           H        ALA  16   6.311  -6.521  -1.501
  132    HA   ALA  16           HA       ALA  16   6.542  -6.078  -3.710
  133   1HB   ALA  16          1HB       ALA  16   8.760  -7.071  -3.394
  134   2HB   ALA  16          2HB       ALA  16   8.102  -8.688  -3.745
  135   3HB   ALA  16          3HB       ALA  16   8.124  -7.438  -5.017
  136    H    ARG  17           H        ARG  17   6.371  -9.596  -4.012
  137    HA   ARG  17           HA       ARG  17   4.696  -9.596  -6.323
  138   1HB   ARG  17          1HB       ARG  17   5.196 -11.739  -4.232
  139   2HB   ARG  17          2HB       ARG  17   4.467 -12.032  -5.824
  140   1HG   ARG  17          1HG       ARG  17   6.508 -11.927  -6.875
  141   2HG   ARG  17          2HG       ARG  17   7.061 -10.571  -5.858
  142   1HD   ARG  17          1HD       ARG  17   6.856 -13.464  -4.923
  143   2HD   ARG  17          2HD       ARG  17   8.365 -12.642  -5.390
  144    HE   ARG  17           HE       ARG  17   7.284 -10.965  -3.489
  145   1HH1  ARG  17          1HH2      ARG  17   8.156 -14.430  -3.426
  146   2HH1  ARG  17          2HH2      ARG  17   8.385 -14.384  -1.676
  147   1HH2  ARG  17          2HH1      ARG  17   7.556 -10.998  -1.345
  148   2HH2  ARG  17          1HH1      ARG  17   8.106 -12.430  -0.489
  149    HA   PRO  18           HA       PRO  18   0.994 -10.733  -3.537
  150   1HB   PRO  18          1HB       PRO  18   1.242 -10.516  -0.790
  151   2HB   PRO  18          2HB       PRO  18   1.655 -12.011  -1.685
  152   1HG   PRO  18          1HG       PRO  18   3.566  -9.810  -0.809
  153   2HG   PRO  18          2HG       PRO  18   3.721 -11.587  -0.578
  154   1HD   PRO  18          1HD       PRO  18   4.955 -10.326  -2.642
  155   2HD   PRO  18          2HD       PRO  18   4.183 -11.921  -2.883
  156    H    ALA  19           H        ALA  19   3.134  -8.290  -2.252
  157    HA   ALA  19           HA       ALA  19   1.319  -6.376  -1.290
  158   1HB   ALA  19          1HB       ALA  19   3.811  -6.449  -1.180
  159   2HB   ALA  19          2HB       ALA  19   3.840  -6.068  -2.925
  160   3HB   ALA  19          3HB       ALA  19   3.171  -4.877  -1.758
  161    H    ALA  20           H        ALA  20   2.739  -6.826  -4.528
  162    HA   ALA  20           HA       ALA  20   1.284  -4.544  -5.698
  163   1HB   ALA  20          1HB       ALA  20   2.923  -6.822  -6.948
  164   2HB   ALA  20          2HB       ALA  20   2.362  -5.358  -7.794
  165   3HB   ALA  20          3HB       ALA  20   3.570  -5.225  -6.490
  166    H    LEU  21           H        LEU  21   0.935  -8.120  -5.487
  167    HA   LEU  21           HA       LEU  21  -1.226  -8.330  -7.313
  168   1HB   LEU  21          1HB       LEU  21   0.029 -10.153  -6.031
  169   2HB   LEU  21          2HB       LEU  21  -1.049  -9.808  -4.664
  170    HG   LEU  21           HG       LEU  21  -1.829 -11.710  -6.056
  171   1HD1  LEU  21          1HD2      LEU  21  -3.511 -10.319  -4.899
  172   2HD1  LEU  21          2HD2      LEU  21  -3.624  -9.269  -6.335
  173   3HD1  LEU  21          3HD2      LEU  21  -4.137 -10.971  -6.436
  174   1HD2  LEU  21          1HD1      LEU  21  -0.866 -10.940  -8.194
  175   2HD2  LEU  21          2HD1      LEU  21  -2.602 -11.301  -8.365
  176   3HD2  LEU  21          3HD1      LEU  21  -2.051  -9.613  -8.259
  177    H    PHE  22           H        PHE  22  -1.135  -7.621  -3.860
  178    HA   PHE  22           HA       PHE  22  -3.779  -6.955  -3.235
  179   1HB   PHE  22          1HB       PHE  22  -2.110  -7.162  -1.531
  180   2HB   PHE  22          2HB       PHE  22  -1.017  -6.088  -2.408
  181    HD1  PHE  22           HD1      PHE  22  -0.800  -3.869  -2.030
  182    HD2  PHE  22           HD2      PHE  22  -4.065  -6.023  -0.248
  183    HE1  PHE  22           HE1      PHE  22  -1.285  -1.918  -0.575
  184    HE2  PHE  22           HE2      PHE  22  -4.451  -4.138   1.325
  185    HZ   PHE  22           HZ       PHE  22  -3.037  -2.098   1.193
  186    H    VAL  23           H        VAL  23  -1.199  -4.520  -3.994
  187    HA   VAL  23           HA       VAL  23  -2.941  -2.372  -4.264
  188    HB   VAL  23           HB       VAL  23  -1.087  -1.257  -5.337
  189   1HG1  VAL  23          1HG1      VAL  23  -0.713  -1.611  -2.928
  190   2HG1  VAL  23          2HG1      VAL  23   0.158  -3.117  -3.295
  191   3HG1  VAL  23          3HG1      VAL  23   0.776  -1.554  -3.859
  192   1HG2  VAL  23          1HG2      VAL  23  -0.877  -2.783  -7.026
  193   2HG2  VAL  23          2HG2      VAL  23   0.729  -2.406  -6.357
  194   3HG2  VAL  23          3HG2      VAL  23  -0.108  -3.973  -5.973
  195    H    GLN  24           H        GLN  24  -2.045  -4.787  -6.722
  196    HA   GLN  24           HA       GLN  24  -2.979  -3.268  -8.992
  197   1HB   GLN  24          1HB       GLN  24  -2.502  -5.187 -10.303
  198   2HB   GLN  24          2HB       GLN  24  -1.151  -4.907  -9.176
  199   1HG   GLN  24          1HG       GLN  24  -1.952  -6.662  -7.714
  200   2HG   GLN  24          2HG       GLN  24  -3.419  -6.880  -8.690
  201   1HE2  GLN  24          2HE2      GLN  24  -3.416  -8.291 -10.279
  202   2HE2  GLN  24          1HE2      GLN  24  -1.981  -9.073 -10.958
  203    H    GLU  25           H        GLU  25  -4.345  -5.915  -7.000
  204    HA   GLU  25           HA       GLU  25  -6.706  -6.055  -8.667
  205   1HB   GLU  25          1HB       GLU  25  -6.355  -6.871  -5.732
  206   2HB   GLU  25          2HB       GLU  25  -7.660  -7.389  -6.830
  207   1HG   GLU  25          1HG       GLU  25  -4.695  -8.014  -7.070
  208   2HG   GLU  25          2HG       GLU  25  -5.972  -9.164  -6.638
  209    H    ALA  26           H        ALA  26  -5.830  -4.621  -5.535
  210    HA   ALA  26           HA       ALA  26  -8.024  -3.033  -4.891
  211   1HB   ALA  26          1HB       ALA  26  -5.066  -2.328  -4.956
  212   2HB   ALA  26          2HB       ALA  26  -6.292  -1.508  -3.960
  213   3HB   ALA  26          3HB       ALA  26  -5.864  -3.211  -3.628
  214    H    ASN  27           H        ASN  27  -5.311  -2.338  -7.101
  215    HA   ASN  27           HA       ASN  27  -6.111   0.106  -8.149
  216   1HB   ASN  27          1HB       ASN  27  -4.191  -2.005  -8.543
  217   2HB   ASN  27          2HB       ASN  27  -4.863  -1.626 -10.126
  218   1HD2  ASN  27          2HD2      ASN  27  -2.961  -0.506  -7.444
  219   2HD2  ASN  27          1HD2      ASN  27  -2.317   0.965  -8.184
  220    H    ARG  28           H        ARG  28  -6.975  -3.173  -9.174
  221    HA   ARG  28           HA       ARG  28  -7.936  -2.455 -11.863
  222   1HB   ARG  28          1HB       ARG  28  -8.517  -4.792  -9.992
  223   2HB   ARG  28          2HB       ARG  28  -9.094  -4.684 -11.671
  224   1HG   ARG  28          1HG       ARG  28  -6.780  -4.547 -12.493
  225   2HG   ARG  28          2HG       ARG  28  -6.167  -4.564 -10.824
  226   1HD   ARG  28          1HD       ARG  28  -7.050  -6.840 -10.490
  227   2HD   ARG  28          2HD       ARG  28  -7.766  -6.813 -12.118
  228    HE   ARG  28           HE       ARG  28  -4.990  -6.247 -12.324
  229   1HH1  ARG  28          2HH1      ARG  28  -7.099  -8.907 -11.413
  230   2HH1  ARG  28          1HH1      ARG  28  -6.186 -10.135 -12.251
  231   1HH2  ARG  28          1HH2      ARG  28  -3.680  -7.850 -13.306
  232   2HH2  ARG  28          2HH2      ARG  28  -4.160  -9.525 -13.294
  233    H    PHE  29           H        PHE  29  -9.220  -3.162  -8.718
  234    HA   PHE  29           HA       PHE  29 -11.923  -2.399  -8.860
  235   1HB   PHE  29          1HB       PHE  29  -9.648  -2.183  -6.854
  236   2HB   PHE  29          2HB       PHE  29 -11.298  -1.808  -6.433
  237    HD1  PHE  29           HD1      PHE  29 -12.613  -4.031  -8.145
  238    HD2  PHE  29           HD2      PHE  29  -9.305  -4.071  -5.396
  239    HE1  PHE  29           HE1      PHE  29 -13.193  -6.353  -7.503
  240    HE2  PHE  29           HE2      PHE  29  -9.850  -6.401  -4.767
  241    HZ   PHE  29           HZ       PHE  29 -11.837  -7.531  -5.771
  242    H    THR  30           H        THR  30 -12.546  -0.452  -9.764
  243    HA   THR  30           HA       THR  30 -10.801   1.862  -9.686
  244    HB   THR  30           HB       THR  30 -13.546   1.225 -10.662
  245    HG1  THR  30           HG1      THR  30 -11.609   0.638 -11.779
  246   1HG2  THR  30          1HG2      THR  30 -12.334   3.976 -10.870
  247   2HG2  THR  30          2HG2      THR  30 -13.864   3.396 -11.615
  248   3HG2  THR  30          3HG2      THR  30 -13.707   3.498  -9.844
  249    H    SER  31           H        SER  31 -10.807   1.332  -7.210
  250    HA   SER  31           HA       SER  31 -12.568   3.236  -5.800
  251   1HB   SER  31          1HB       SER  31 -11.269   0.639  -4.836
  252   2HB   SER  31          2HB       SER  31 -12.325   1.702  -3.880
  253    HG   SER  31           HG       SER  31 -12.991  -0.045  -6.001
  254    H    ASP  32           H        ASP  32 -11.683   4.532  -4.226
  255    HA   ASP  32           HA       ASP  32  -8.825   5.042  -4.166
  256   1HB   ASP  32          1HB       ASP  32 -11.180   5.788  -2.370
  257   2HB   ASP  32          2HB       ASP  32  -9.520   6.345  -2.088
  258    H    VAL  33           H        VAL  33  -8.125   2.833  -3.884
  259    HA   VAL  33           HA       VAL  33  -9.053   1.304  -1.644
  260    HB   VAL  33           HB       VAL  33  -6.773   0.932  -3.603
  261   1HG1  VAL  33          1HG1      VAL  33  -8.009  -0.994  -1.590
  262   2HG1  VAL  33          2HG1      VAL  33  -6.908  -1.465  -2.912
  263   3HG1  VAL  33          3HG1      VAL  33  -6.327  -0.395  -1.619
  264   1HG2  VAL  33          1HG2      VAL  33  -9.047   1.115  -4.522
  265   2HG2  VAL  33          2HG2      VAL  33  -8.443  -0.548  -4.682
  266   3HG2  VAL  33          3HG2      VAL  33  -9.623  -0.138  -3.405
  267    H    PHE  34           H        PHE  34  -8.057   0.722   0.220
  268    HA   PHE  34           HA       PHE  34  -5.706   2.325   1.014
  269   1HB   PHE  34          1HB       PHE  34  -8.288   2.405   2.597
  270   2HB   PHE  34          2HB       PHE  34  -6.735   3.100   3.053
  271    HD1  PHE  34           HD1      PHE  34  -9.848   3.942   1.739
  272    HD2  PHE  34           HD2      PHE  34  -5.652   4.627   1.102
  273    HE1  PHE  34           HE1      PHE  34 -10.383   6.051   0.560
  274    HE2  PHE  34           HE2      PHE  34  -6.187   6.756  -0.091
  275    HZ   PHE  34           HZ       PHE  34  -8.555   7.460  -0.366
  276    H    LEU  35           H        LEU  35  -5.022   1.774   3.270
  277    HA   LEU  35           HA       LEU  35  -5.823  -0.893   4.207
  278   1HB   LEU  35          1HB       LEU  35  -3.917  -1.194   2.519
  279   2HB   LEU  35          2HB       LEU  35  -2.879  -0.332   3.683
  280    HG   LEU  35           HG       LEU  35  -3.539  -2.001   5.432
  281   1HD1  LEU  35          1HD1      LEU  35  -4.998  -3.316   3.100
  282   2HD1  LEU  35          2HD1      LEU  35  -4.803  -4.015   4.724
  283   3HD1  LEU  35          3HD1      LEU  35  -5.773  -2.540   4.499
  284   1HD2  LEU  35          1HD2      LEU  35  -2.524  -3.257   2.844
  285   2HD2  LEU  35          2HD2      LEU  35  -1.526  -2.416   4.057
  286   3HD2  LEU  35          3HD2      LEU  35  -2.343  -3.942   4.478
  287    H    GLU  36           H        GLU  36  -6.272  -0.445   6.256
  288    HA   GLU  36           HA       GLU  36  -5.071   1.949   7.545
  289   1HB   GLU  36          1HB       GLU  36  -7.417   0.257   8.443
  290   2HB   GLU  36          2HB       GLU  36  -7.029   1.937   8.888
  291   1HG   GLU  36          1HG       GLU  36  -7.407   2.646   6.569
  292   2HG   GLU  36          2HG       GLU  36  -7.761   0.986   6.093
  293    H    LYS  37           H        LYS  37  -3.055   1.034   8.378
  294    HA   LYS  37           HA       LYS  37  -2.564  -1.492   9.513
  295   1HB   LYS  37          1HB       LYS  37  -1.470   1.301   9.597
  296   2HB   LYS  37          2HB       LYS  37  -0.715   0.039  10.579
  297   1HG   LYS  37          1HG       LYS  37  -1.217  -0.443   7.633
  298   2HG   LYS  37          2HG       LYS  37   0.191   0.513   8.156
  299   1HD   LYS  37          1HD       LYS  37  -0.466  -2.336   8.996
  300   2HD   LYS  37          2HD       LYS  37   0.888  -1.825   7.966
  301   1HE   LYS  37          1HE       LYS  37   0.449  -0.952  10.862
  302   2HE   LYS  37          2HE       LYS  37   1.525  -2.272  10.368
  303   1HZ   LYS  37          1HZ       LYS  37   1.779   0.541   9.528
  304   2HZ   LYS  37          2HZ       LYS  37   2.679  -0.202  10.692
  305   3HZ   LYS  37          3HZ       LYS  37   2.799  -0.702   9.130
  306    H    ASP  38           H        ASP  38  -4.444  -1.900  10.985
  307    HA   ASP  38           HA       ASP  38  -5.589  -1.790  12.948
  308   1HB   ASP  38          1HB       ASP  38  -2.942  -0.660  13.893
  309   2HB   ASP  38          2HB       ASP  38  -4.322  -0.930  14.969
  310    H    GLY  39           H        GLY  39  -5.617   0.416  10.941
  311   1HA   GLY  39          1HA       GLY  39  -7.157   2.384  11.408
  312   2HA   GLY  39          2HA       GLY  39  -6.098   2.666  12.815
  313    H    LYS  40           H        LYS  40  -3.577   2.004  11.198
  314    HA   LYS  40           HA       LYS  40  -3.166   4.731  10.283
  315   1HB   LYS  40          1HB       LYS  40  -1.255   2.465   9.815
  316   2HB   LYS  40          2HB       LYS  40  -0.895   4.167  10.091
  317   1HG   LYS  40          1HG       LYS  40  -1.754   2.092  12.153
  318   2HG   LYS  40          2HG       LYS  40  -0.156   2.813  11.938
  319   1HD   LYS  40          1HD       LYS  40  -0.897   4.059  13.713
  320   2HD   LYS  40          2HD       LYS  40  -1.426   5.099  12.374
  321   1HE   LYS  40          1HE       LYS  40  -3.233   4.767  14.059
  322   2HE   LYS  40          2HE       LYS  40  -3.669   4.049  12.495
  323   1HZ   LYS  40          1HZ       LYS  40  -2.927   1.922  13.366
  324   2HZ   LYS  40          2HZ       LYS  40  -2.628   2.608  14.837
  325   3HZ   LYS  40          3HZ       LYS  40  -4.164   2.532  14.250
  326    H    LYS  41           H        LYS  41  -4.923   4.498   8.647
  327    HA   LYS  41           HA       LYS  41  -4.493   2.692   6.427
  328   1HB   LYS  41          1HB       LYS  41  -6.744   3.417   7.207
  329   2HB   LYS  41          2HB       LYS  41  -6.291   5.067   6.789
  330   1HG   LYS  41          1HG       LYS  41  -5.844   3.952   4.373
  331   2HG   LYS  41          2HG       LYS  41  -7.078   2.834   4.957
  332   1HD   LYS  41          1HD       LYS  41  -8.461   4.431   4.080
  333   2HD   LYS  41          2HD       LYS  41  -8.232   5.223   5.658
  334   1HE   LYS  41          1HE       LYS  41  -6.392   5.506   3.270
  335   2HE   LYS  41          2HE       LYS  41  -7.774   6.600   3.481
  336   1HZ   LYS  41          1HZ       LYS  41  -6.823   7.267   5.599
  337   2HZ   LYS  41          2HZ       LYS  41  -5.489   6.341   5.325
  338   3HZ   LYS  41          3HZ       LYS  41  -5.824   7.609   4.338
  339    H    VAL  42           H        VAL  42  -3.860   2.965   4.500
  340    HA   VAL  42           HA       VAL  42  -3.045   5.636   3.447
  341    HB   VAL  42           HB       VAL  42  -1.042   4.500   4.302
  342   1HG1  VAL  42          1HG2      VAL  42  -2.019   2.251   4.374
  343   2HG1  VAL  42          2HG2      VAL  42  -1.963   2.153   2.599
  344   3HG1  VAL  42          3HG2      VAL  42  -0.445   2.228   3.543
  345   1HG2  VAL  42          1HG1      VAL  42  -0.780   5.712   2.197
  346   2HG2  VAL  42          2HG1      VAL  42   0.318   4.324   2.317
  347   3HG2  VAL  42          3HG1      VAL  42  -1.136   4.213   1.296
  348    H    ASN  43           H        ASN  43  -2.479   5.351   1.035
  349    HA   ASN  43           HA       ASN  43  -4.794   4.129  -0.308
  350   1HB   ASN  43          1HB       ASN  43  -3.926   6.282  -1.143
  351   2HB   ASN  43          2HB       ASN  43  -2.311   5.572  -1.339
  352   1HD2  ASN  43          2HD2      ASN  43  -5.581   4.204  -2.232
  353   2HD2  ASN  43          1HD2      ASN  43  -5.200   4.176  -3.945
  354    H    ALA  44           H        ALA  44  -4.776   2.162  -0.145
  355    HA   ALA  44           HA       ALA  44  -2.853   0.271   0.357
  356   1HB   ALA  44          1HB       ALA  44  -5.311   0.029  -1.427
  357   2HB   ALA  44          2HB       ALA  44  -4.494  -1.344  -0.655
  358   3HB   ALA  44          3HB       ALA  44  -5.321  -0.113   0.343
  359    H    LYS  45           H        LYS  45  -3.999   1.348  -2.801
  360    HA   LYS  45           HA       LYS  45  -2.398  -0.569  -4.313
  361   1HB   LYS  45          1HB       LYS  45  -3.159   0.817  -6.260
  362   2HB   LYS  45          2HB       LYS  45  -4.477   0.132  -5.284
  363   1HG   LYS  45          1HG       LYS  45  -5.003   2.219  -4.311
  364   2HG   LYS  45          2HG       LYS  45  -3.422   2.925  -4.732
  365   1HD   LYS  45          1HD       LYS  45  -5.312   3.743  -6.189
  366   2HD   LYS  45          2HD       LYS  45  -3.958   3.008  -7.059
  367   1HE   LYS  45          1HE       LYS  45  -6.047   2.175  -8.007
  368   2HE   LYS  45          2HE       LYS  45  -5.147   0.874  -7.200
  369   1HZ   LYS  45          1HZ       LYS  45  -6.601   1.175  -5.302
  370   2HZ   LYS  45          2HZ       LYS  45  -7.486   2.306  -6.116
  371   3HZ   LYS  45          3HZ       LYS  45  -7.442   0.751  -6.648
  372    H    SER  46           H        SER  46  -1.634   2.391  -2.776
  373    HA   SER  46           HA       SER  46   0.446   2.968  -4.807
  374   1HB   SER  46          1HB       SER  46  -1.151   4.775  -4.059
  375   2HB   SER  46          2HB       SER  46  -0.405   4.681  -2.453
  376    HG   SER  46           HG       SER  46   0.511   6.293  -3.950
  377    H    ILE  47           H        ILE  47   2.328   4.075  -3.742
  378    HA   ILE  47           HA       ILE  47   4.100   2.187  -2.651
  379    HB   ILE  47           HB       ILE  47   4.757   4.267  -3.818
  380   1HG1  ILE  47          1HG1      ILE  47   6.077   2.841  -1.985
  381   2HG1  ILE  47          2HG1      ILE  47   6.817   4.256  -2.723
  382   1HG2  ILE  47          1HG2      ILE  47   3.107   5.785  -2.673
  383   2HG2  ILE  47          2HG2      ILE  47   3.999   5.592  -1.166
  384   3HG2  ILE  47          3HG2      ILE  47   4.765   6.434  -2.527
  385   1HD1  ILE  47          1HD1      ILE  47   5.361   4.215  -0.055
  386   2HD1  ILE  47          2HD1      ILE  47   7.123   4.291  -0.291
  387   3HD1  ILE  47          3HD1      ILE  47   6.098   5.650  -0.815
  388    H    MET  48           H        MET  48   2.377   4.845  -0.925
  389    HA   MET  48           HA       MET  48   3.615   4.079   1.545
  390   1HB   MET  48          1HB       MET  48   2.857   6.352   1.130
  391   2HB   MET  48          2HB       MET  48   1.196   5.799   0.899
  392   1HG   MET  48          1HG       MET  48   1.274   4.949   3.305
  393   2HG   MET  48          2HG       MET  48   2.895   5.643   3.441
  394   1HE   MET  48          1HE       MET  48   2.365   8.245   1.601
  395   2HE   MET  48          2HE       MET  48   2.076   9.467   2.862
  396   3HE   MET  48          3HE       MET  48   3.366   8.259   3.074
  397    H    GLY  49           H        GLY  49   0.989   2.678  -0.265
  398   1HA   GLY  49          1HA       GLY  49  -0.074   1.369   2.130
  399   2HA   GLY  49          2HA       GLY  49  -0.529   1.034   0.434
  400    H    LEU  50           H        LEU  50   1.545   0.309  -0.934
  401    HA   LEU  50           HA       LEU  50   2.447  -2.180  -0.285
  402   1HB   LEU  50          1HB       LEU  50   2.933  -0.332  -2.287
  403   2HB   LEU  50          2HB       LEU  50   4.505  -0.476  -1.485
  404    HG   LEU  50           HG       LEU  50   4.717  -2.100  -3.106
  405   1HD1  LEU  50          1HD2      LEU  50   5.218  -3.048  -0.833
  406   2HD1  LEU  50          2HD2      LEU  50   3.545  -3.602  -0.726
  407   3HD1  LEU  50          3HD2      LEU  50   4.610  -4.298  -1.943
  408   1HD2  LEU  50          1HD1      LEU  50   2.419  -2.042  -3.934
  409   2HD2  LEU  50          2HD1      LEU  50   2.967  -3.719  -3.713
  410   3HD2  LEU  50          3HD1      LEU  50   1.870  -2.974  -2.528
  411    H    MET  51           H        MET  51   4.622   0.605  -0.227
  412    HA   MET  51           HA       MET  51   6.761  -0.761   1.023
  413   1HB   MET  51          1HB       MET  51   6.872   1.236  -0.658
  414   2HB   MET  51          2HB       MET  51   6.289   2.224   0.688
  415   1HG   MET  51          1HG       MET  51   8.251   1.263   2.042
  416   2HG   MET  51          2HG       MET  51   8.909   0.735   0.486
  417   1HE   MET  51          1HE       MET  51   6.815   3.844   1.496
  418   2HE   MET  51          2HE       MET  51   7.981   3.684   2.840
  419   3HE   MET  51          3HE       MET  51   8.067   5.089   1.748
  420    H    SER  52           H        SER  52   4.339   1.659   2.005
  421    HA   SER  52           HA       SER  52   5.630   1.889   4.622
  422   1HB   SER  52          1HB       SER  52   3.060   3.221   3.761
  423   2HB   SER  52          2HB       SER  52   4.101   3.663   5.124
  424    HG   SER  52           HG       SER  52   5.772   4.042   3.509
  425    H    LEU  53           H        LEU  53   2.096   1.494   4.094
  426    HA   LEU  53           HA       LEU  53   1.986   0.382   6.785
  427   1HB   LEU  53          1HB       LEU  53  -0.158   1.072   4.741
  428   2HB   LEU  53          2HB       LEU  53  -0.471   0.382   6.349
  429    HG   LEU  53           HG       LEU  53  -0.575   2.617   6.914
  430   1HD1  LEU  53          1HD2      LEU  53   2.389   1.967   6.863
  431   2HD1  LEU  53          2HD2      LEU  53   1.643   3.233   7.884
  432   3HD1  LEU  53          3HD2      LEU  53   1.250   1.500   8.149
  433   1HD2  LEU  53          1HD1      LEU  53   1.654   3.169   4.903
  434   2HD2  LEU  53          2HD1      LEU  53  -0.070   3.515   4.652
  435   3HD2  LEU  53          3HD1      LEU  53   0.837   4.389   5.911
  436    H    ALA  54           H        ALA  54   0.897  -0.734   3.689
  437    HA   ALA  54           HA       ALA  54  -0.096  -3.289   4.422
  438   1HB   ALA  54          1HB       ALA  54  -0.745  -2.050   2.387
  439   2HB   ALA  54          2HB       ALA  54   0.906  -2.225   1.758
  440   3HB   ALA  54          3HB       ALA  54  -0.116  -3.659   1.974
  441    H    VAL  55           H        VAL  55   3.225  -2.239   3.828
  442    HA   VAL  55           HA       VAL  55   4.282  -4.869   3.415
  443    HB   VAL  55           HB       VAL  55   5.382  -2.658   2.878
  444   1HG1  VAL  55          1HG2      VAL  55   4.929  -1.551   5.062
  445   2HG1  VAL  55          2HG2      VAL  55   6.003  -2.720   5.865
  446   3HG1  VAL  55          3HG2      VAL  55   6.662  -1.570   4.676
  447   1HG2  VAL  55          1HG1      VAL  55   6.926  -4.659   4.568
  448   2HG2  VAL  55          2HG1      VAL  55   6.606  -4.784   2.824
  449   3HG2  VAL  55          3HG1      VAL  55   7.651  -3.479   3.444
  450    H    SER  56           H        SER  56   2.930  -3.427   6.260
  451    HA   SER  56           HA       SER  56   4.800  -4.735   8.025
  452   1HB   SER  56          1HB       SER  56   2.152  -3.464   8.798
  453   2HB   SER  56          2HB       SER  56   3.597  -3.657   9.798
  454    HG   SER  56           HG       SER  56   3.255  -1.974   7.520
  455    H    THR  57           H        THR  57   4.398  -6.889   6.987
  456    HA   THR  57           HA       THR  57   2.259  -8.482   7.302
  457    HB   THR  57           HB       THR  57   4.939  -9.518   8.195
  458    HG1  THR  57           HG1      THR  57   5.078  -9.512   5.649
  459   1HG2  THR  57          1HG2      THR  57   4.229 -11.350   6.653
  460   2HG2  THR  57          2HG2      THR  57   2.988 -11.018   7.890
  461   3HG2  THR  57          3HG2      THR  57   2.776 -10.409   6.230
  462    H    GLY  58           H        GLY  58   0.912  -8.900   8.875
  463   1HA   GLY  58          1HA       GLY  58   0.409  -9.947  10.976
  464   2HA   GLY  58          2HA       GLY  58   1.868  -9.255  11.683
  465    H    THR  59           H        THR  59   0.579  -6.722   9.869
  466    HA   THR  59           HA       THR  59  -0.581  -5.627  12.349
  467    HB   THR  59           HB       THR  59  -0.448  -4.323   9.604
  468    HG1  THR  59           HG1      THR  59   1.631  -4.984  10.339
  469   1HG2  THR  59          1HG2      THR  59  -0.479  -3.181  12.430
  470   2HG2  THR  59          2HG2      THR  59  -0.530  -2.246  10.917
  471   3HG2  THR  59          3HG2      THR  59  -1.902  -3.289  11.374
  472    H    GLU  60           H        GLU  60  -2.816  -5.394  12.676
  473    HA   GLU  60           HA       GLU  60  -4.509  -6.738  10.661
  474   1HB   GLU  60          1HB       GLU  60  -6.301  -6.531  12.283
  475   2HB   GLU  60          2HB       GLU  60  -4.887  -7.317  13.010
  476   1HG   GLU  60          1HG       GLU  60  -4.210  -5.162  14.052
  477   2HG   GLU  60          2HG       GLU  60  -5.649  -4.396  13.354
  478    H    VAL  61           H        VAL  61  -4.202  -5.394   9.011
  479    HA   VAL  61           HA       VAL  61  -5.016  -2.554   9.356
  480    HB   VAL  61           HB       VAL  61  -3.753  -2.085   7.365
  481   1HG1  VAL  61          1HG1      VAL  61  -2.468  -2.459   9.520
  482   2HG1  VAL  61          2HG1      VAL  61  -2.216  -4.144   9.018
  483   3HG1  VAL  61          3HG1      VAL  61  -1.509  -2.819   8.059
  484   1HG2  VAL  61          1HG2      VAL  61  -4.321  -4.176   6.133
  485   2HG2  VAL  61          2HG2      VAL  61  -2.564  -3.830   6.134
  486   3HG2  VAL  61          3HG2      VAL  61  -3.229  -5.078   7.224
  487    H    THR  62           H        THR  62  -6.810  -1.775   8.494
  488    HA   THR  62           HA       THR  62  -8.631  -3.650   7.249
  489    HB   THR  62           HB       THR  62  -9.128  -0.686   7.395
  490    HG1  THR  62           HG1      THR  62  -9.484  -0.823   9.529
  491   1HG2  THR  62          1HG2      THR  62 -11.412  -1.490   7.966
  492   2HG2  THR  62          2HG2      THR  62 -10.862  -2.201   6.443
  493   3HG2  THR  62          3HG2      THR  62 -10.824  -3.170   7.937
  494    H    LEU  63           H        LEU  63  -8.617  -4.154   5.123
  495    HA   LEU  63           HA       LEU  63  -7.334  -2.299   3.262
  496   1HB   LEU  63          1HB       LEU  63  -7.112  -4.844   3.234
  497   2HB   LEU  63          2HB       LEU  63  -8.746  -4.882   2.526
  498    HG   LEU  63           HG       LEU  63  -6.529  -3.093   1.449
  499   1HD1  LEU  63          1HD2      LEU  63  -5.703  -5.411   1.544
  500   2HD1  LEU  63          2HD2      LEU  63  -7.163  -5.970   0.704
  501   3HD1  LEU  63          3HD2      LEU  63  -6.002  -4.914  -0.141
  502   1HD2  LEU  63          1HD1      LEU  63  -9.030  -4.336   0.217
  503   2HD2  LEU  63          2HD1      LEU  63  -8.820  -2.623   0.660
  504   3HD2  LEU  63          3HD1      LEU  63  -7.851  -3.325  -0.656
  505    H    ILE  64           H        ILE  64  -8.335  -0.746   2.411
  506    HA   ILE  64           HA       ILE  64 -11.299  -0.577   2.446
  507    HB   ILE  64           HB       ILE  64  -9.089   1.502   2.131
  508   1HG1  ILE  64          1HG1      ILE  64 -11.088   0.999   4.371
  509   2HG1  ILE  64          2HG1      ILE  64  -9.323   0.754   4.461
  510   1HG2  ILE  64          1HG2      ILE  64 -12.104   1.844   2.209
  511   2HG2  ILE  64          2HG2      ILE  64 -10.915   3.171   2.268
  512   3HG2  ILE  64          3HG2      ILE  64 -11.042   2.152   0.812
  513   1HD1  ILE  64          1HD1      ILE  64  -9.027   3.193   3.916
  514   2HD1  ILE  64          2HD1      ILE  64 -10.794   3.380   3.932
  515   3HD1  ILE  64          3HD1      ILE  64  -9.932   2.941   5.431
  516    H    ALA  65           H        ALA  65 -12.365   0.139   0.659
  517    HA   ALA  65           HA       ALA  65 -10.900   0.694  -1.801
  518   1HB   ALA  65          1HB       ALA  65 -13.176  -1.328  -1.639
  519   2HB   ALA  65          2HB       ALA  65 -12.453  -0.695  -3.140
  520   3HB   ALA  65          3HB       ALA  65 -11.482  -1.706  -2.039
  521    H    GLN  66           H        GLN  66 -11.523   2.766  -1.847
  522    HA   GLN  66           HA       GLN  66 -14.386   3.310  -1.281
  523   1HB   GLN  66          1HB       GLN  66 -12.635   4.467   0.165
  524   2HB   GLN  66          2HB       GLN  66 -11.955   5.187  -1.307
  525   1HG   GLN  66          1HG       GLN  66 -14.551   5.768  -1.662
  526   2HG   GLN  66          2HG       GLN  66 -14.533   5.750   0.107
  527   1HE2  GLN  66          2HE2      GLN  66 -12.260   7.032   0.902
  528   2HE2  GLN  66          1HE2      GLN  66 -12.093   8.583   0.111
  529    H    GLY  67           H        GLY  67 -14.450   2.185  -3.477
  530   1HA   GLY  67          1HA       GLY  67 -14.378   4.314  -5.568
  531   2HA   GLY  67          2HA       GLY  67 -13.559   2.786  -5.782
  532    H    GLU  68           H        GLU  68 -14.880   2.935  -7.648
  533    HA   GLU  68           HA       GLU  68 -17.515   2.482  -8.053
  534   1HB   GLU  68          1HB       GLU  68 -16.854   1.422 -10.083
  535   2HB   GLU  68          2HB       GLU  68 -15.537   2.571  -9.715
  536   1HG   GLU  68          1HG       GLU  68 -14.065   0.824  -9.137
  537   2HG   GLU  68          2HG       GLU  68 -15.394  -0.293  -8.793
  538    H    ASP  69           H        ASP  69 -15.097   0.017  -6.932
  539    HA   ASP  69           HA       ASP  69 -17.400  -1.853  -6.591
  540   1HB   ASP  69          1HB       ASP  69 -15.455  -3.571  -6.626
  541   2HB   ASP  69          2HB       ASP  69 -16.146  -3.033  -8.150
  542    H    GLU  70           H        GLU  70 -16.366   0.246  -4.715
  543    HA   GLU  70           HA       GLU  70 -14.462  -0.321  -3.071
  544   1HB   GLU  70          1HB       GLU  70 -15.775   0.730  -1.260
  545   2HB   GLU  70          2HB       GLU  70 -15.845   1.567  -2.809
  546   1HG   GLU  70          1HG       GLU  70 -18.002   1.706  -2.579
  547   2HG   GLU  70          2HG       GLU  70 -18.088  -0.019  -2.981
  548    H    GLN  71           H        GLN  71 -17.638  -1.651  -1.941
  549    HA   GLN  71           HA       GLN  71 -16.623  -3.300  -0.057
  550   1HB   GLN  71          1HB       GLN  71 -19.003  -2.855  -0.493
  551   2HB   GLN  71          2HB       GLN  71 -18.959  -3.979  -1.870
  552   1HG   GLN  71          1HG       GLN  71 -19.848  -5.034   0.202
  553   2HG   GLN  71          2HG       GLN  71 -18.363  -5.832  -0.359
  554   1HE2  GLN  71          2HE2      GLN  71 -16.353  -5.431   0.776
  555   2HE2  GLN  71          1HE2      GLN  71 -16.429  -4.957   2.473
  556    H    GLU  72           H        GLU  72 -16.862  -4.267  -3.553
  557    HA   GLU  72           HA       GLU  72 -16.014  -7.011  -3.050
  558   1HB   GLU  72          1HB       GLU  72 -17.207  -6.633  -5.083
  559   2HB   GLU  72          2HB       GLU  72 -16.222  -5.207  -5.483
  560   1HG   GLU  72          1HG       GLU  72 -14.252  -6.581  -5.868
  561   2HG   GLU  72          2HG       GLU  72 -15.096  -8.046  -5.355
  562    H    ALA  73           H        ALA  73 -14.496  -3.940  -3.964
  563    HA   ALA  73           HA       ALA  73 -11.960  -4.822  -4.783
  564   1HB   ALA  73          1HB       ALA  73 -13.072  -2.331  -3.455
  565   2HB   ALA  73          2HB       ALA  73 -11.504  -2.406  -4.315
  566   3HB   ALA  73          3HB       ALA  73 -13.044  -2.661  -5.194
  567    H    LEU  74           H        LEU  74 -13.042  -3.366  -1.754
  568    HA   LEU  74           HA       LEU  74 -10.623  -3.846  -0.326
  569   1HB   LEU  74          1HB       LEU  74 -11.893  -2.880   1.548
  570   2HB   LEU  74          2HB       LEU  74 -12.168  -2.024   0.005
  571    HG   LEU  74           HG       LEU  74 -14.194  -3.818  -0.112
  572   1HD1  LEU  74          1HD1      LEU  74 -13.860  -2.948   2.789
  573   2HD1  LEU  74          2HD1      LEU  74 -15.284  -3.766   2.089
  574   3HD1  LEU  74          3HD1      LEU  74 -13.721  -4.625   2.185
  575   1HD2  LEU  74          1HD2      LEU  74 -14.082  -1.044   1.164
  576   2HD2  LEU  74          2HD2      LEU  74 -14.235  -1.413  -0.562
  577   3HD2  LEU  74          3HD2      LEU  74 -15.558  -1.828   0.540
  578    H    GLU  75           H        GLU  75 -13.769  -5.675  -0.422
  579    HA   GLU  75           HA       GLU  75 -12.956  -7.425   1.678
  580   1HB   GLU  75          1HB       GLU  75 -14.772  -8.892   0.934
  581   2HB   GLU  75          2HB       GLU  75 -15.302  -7.201   1.006
  582   1HG   GLU  75          1HG       GLU  75 -14.815  -7.024  -1.449
  583   2HG   GLU  75          2HG       GLU  75 -14.557  -8.786  -1.488
  584    H    LYS  76           H        LYS  76 -12.685  -7.830  -1.942
  585    HA   LYS  76           HA       LYS  76 -11.538 -10.440  -1.540
  586   1HB   LYS  76          1HB       LYS  76 -11.517 -10.682  -3.739
  587   2HB   LYS  76          2HB       LYS  76 -12.602  -9.278  -3.710
  588   1HG   LYS  76          1HG       LYS  76 -10.823  -7.821  -4.393
  589   2HG   LYS  76          2HG       LYS  76  -9.581  -9.046  -4.036
  590   1HD   LYS  76          1HD       LYS  76 -10.498 -10.531  -5.782
  591   2HD   LYS  76          2HD       LYS  76 -11.721  -9.316  -6.199
  592   1HE   LYS  76          1HE       LYS  76  -9.915  -7.713  -6.803
  593   2HE   LYS  76          2HE       LYS  76  -8.692  -8.932  -6.367
  594   1HZ   LYS  76          1HZ       LYS  76  -9.640 -10.337  -8.084
  595   2HZ   LYS  76          2HZ       LYS  76 -10.673  -9.128  -8.519
  596   3HZ   LYS  76          3HZ       LYS  76  -9.041  -8.925  -8.680
  597    H    LEU  77           H        LEU  77 -10.150  -7.176  -1.972
  598    HA   LEU  77           HA       LEU  77  -7.443  -7.895  -2.040
  599   1HB   LEU  77          1HB       LEU  77  -9.188  -5.609  -1.705
  600   2HB   LEU  77          2HB       LEU  77  -7.734  -5.443  -0.694
  601    HG   LEU  77           HG       LEU  77  -7.592  -4.642  -3.200
  602   1HD1  LEU  77          1HD1      LEU  77  -5.685  -6.607  -1.897
  603   2HD1  LEU  77          2HD1      LEU  77  -5.257  -5.424  -3.168
  604   3HD1  LEU  77          3HD1      LEU  77  -5.786  -4.853  -1.556
  605   1HD2  LEU  77          1HD2      LEU  77  -7.130  -7.663  -3.428
  606   2HD2  LEU  77          2HD2      LEU  77  -8.487  -6.801  -4.189
  607   3HD2  LEU  77          3HD2      LEU  77  -6.808  -6.465  -4.697
  608    H    ALA  78           H        ALA  78  -9.412  -6.924   0.843
  609    HA   ALA  78           HA       ALA  78  -7.308  -7.419   2.705
  610   1HB   ALA  78          1HB       ALA  78  -9.247  -5.986   3.217
  611   2HB   ALA  78          2HB       ALA  78 -10.319  -7.407   3.108
  612   3HB   ALA  78          3HB       ALA  78  -9.090  -7.305   4.393
  613    H    ALA  79           H        ALA  79  -9.776  -9.543   1.212
  614    HA   ALA  79           HA       ALA  79  -9.329 -11.781   2.937
  615   1HB   ALA  79          1HB       ALA  79  -9.933 -11.640  -0.051
  616   2HB   ALA  79          2HB       ALA  79 -10.126 -13.084   0.974
  617   3HB   ALA  79          3HB       ALA  79 -11.154 -11.651   1.246
  618    H    TYR  80           H        TYR  80  -7.930 -10.822  -0.203
  619    HA   TYR  80           HA       TYR  80  -6.037 -12.770  -0.655
  620   1HB   TYR  80          1HB       TYR  80  -6.722 -10.988  -2.188
  621   2HB   TYR  80          2HB       TYR  80  -5.936  -9.781  -1.159
  622    HD1  TYR  80           HD1      TYR  80  -4.996 -13.045  -2.780
  623    HD2  TYR  80           HD2      TYR  80  -3.862  -9.006  -1.811
  624    HE1  TYR  80           HE1      TYR  80  -2.695 -13.501  -3.581
  625    HE2  TYR  80           HE2      TYR  80  -1.539  -9.473  -2.604
  626    HH   TYR  80           HH       TYR  80  -0.491 -12.762  -3.372
  627    H    VAL  81           H        VAL  81  -5.381  -9.622   0.817
  628    HA   VAL  81           HA       VAL  81  -2.699  -9.863   1.472
  629    HB   VAL  81           HB       VAL  81  -3.153  -8.096   3.121
  630   1HG1  VAL  81          1HG2      VAL  81  -4.948  -7.964   0.672
  631   2HG1  VAL  81          2HG2      VAL  81  -4.365  -6.562   1.610
  632   3HG1  VAL  81          3HG2      VAL  81  -3.206  -7.575   0.693
  633   1HG2  VAL  81          1HG1      VAL  81  -6.072  -8.857   2.614
  634   2HG2  VAL  81          2HG1      VAL  81  -5.182  -9.153   4.111
  635   3HG2  VAL  81          3HG1      VAL  81  -5.522  -7.483   3.610
  636    H    GLN  82           H        GLN  82  -5.468 -11.271   3.287
  637    HA   GLN  82           HA       GLN  82  -3.437 -12.046   5.306
  638   1HB   GLN  82          1HB       GLN  82  -5.220 -11.946   6.929
  639   2HB   GLN  82          2HB       GLN  82  -5.275 -10.454   5.979
  640   1HG   GLN  82          1HG       GLN  82  -7.086 -11.534   4.577
  641   2HG   GLN  82          2HG       GLN  82  -6.971 -12.934   5.626
  642   1HE2  GLN  82          2HE2      GLN  82  -8.368  -9.940   5.215
  643   2HE2  GLN  82          1HE2      GLN  82  -9.054  -9.619   6.819
  644    H    GLU  83           H        GLU  83  -4.479 -13.388   2.619
  645    HA   GLU  83           HA       GLU  83  -5.556 -15.799   3.986
  646   1HB   GLU  83          1HB       GLU  83  -7.017 -16.111   2.148
  647   2HB   GLU  83          2HB       GLU  83  -7.012 -14.354   2.531
  648   1HG   GLU  83          1HG       GLU  83  -5.388 -13.973   0.717
  649   2HG   GLU  83          2HG       GLU  83  -5.387 -15.702   0.325
  650    H    GLU  84           H        GLU  84  -3.007 -14.816   1.670
  651    HA   GLU  84           HA       GLU  84  -2.441 -17.700   1.415
  652   1HB   GLU  84          1HB       GLU  84  -1.512 -17.305  -0.794
  653   2HB   GLU  84          2HB       GLU  84  -3.191 -16.714  -0.785
  654   1HG   GLU  84          1HG       GLU  84  -2.388 -14.415  -0.443
  655   2HG   GLU  84          2HG       GLU  84  -0.761 -15.078  -0.160
  656    H    VAL  85           H        VAL  85  -0.942 -17.990   2.718
  657    HA   VAL  85           HA       VAL  85   0.714 -16.197   4.125
  658    HB   VAL  85           HB       VAL  85   2.198 -18.193   4.660
  659   1HG1  VAL  85          1HG1      VAL  85  -0.801 -18.926   4.945
  660   2HG1  VAL  85          2HG1      VAL  85   0.546 -19.695   5.821
  661   3HG1  VAL  85          3HG1      VAL  85   0.171 -18.008   6.119
  662   1HG2  VAL  85          1HG2      VAL  85   2.063 -19.438   2.457
  663   2HG2  VAL  85          2HG2      VAL  85   1.688 -20.479   3.834
  664   3HG2  VAL  85          3HG2      VAL  85   0.371 -19.869   2.800
  Start of MODEL    9
    1   1H    VAL   2          1H        VAL   2 -16.216   6.545  -2.021
    2   2H    VAL   2          2H        VAL   2 -16.693   5.256  -2.991
    3   3H    VAL   2          3H        VAL   2 -17.713   6.578  -2.788
    4    HA   VAL   2           HA       VAL   2 -17.971   6.095  -0.476
    5    HB   VAL   2           HB       VAL   2 -18.460   3.678  -2.267
    6   1HG1  VAL   2          1HG1      VAL   2 -19.871   4.671   0.250
    7   2HG1  VAL   2          2HG1      VAL   2 -20.366   3.276  -0.737
    8   3HG1  VAL   2          3HG1      VAL   2 -18.820   3.236   0.142
    9   1HG2  VAL   2          1HG2      VAL   2 -19.342   5.772  -3.256
   10   2HG2  VAL   2          2HG2      VAL   2 -20.664   4.722  -2.691
   11   3HG2  VAL   2          3HG2      VAL   2 -20.179   6.140  -1.731
   12    H    GLN   3           H        GLN   3 -16.967   5.260   1.371
   13    HA   GLN   3           HA       GLN   3 -14.683   3.479   0.725
   14   1HB   GLN   3          1HB       GLN   3 -14.262   5.856   1.631
   15   2HB   GLN   3          2HB       GLN   3 -14.958   5.264   3.166
   16   1HG   GLN   3          1HG       GLN   3 -13.318   3.317   2.937
   17   2HG   GLN   3          2HG       GLN   3 -12.507   4.255   1.705
   18   1HE2  GLN   3          2HE2      GLN   3 -13.717   4.661   5.089
   19   2HE2  GLN   3          1HE2      GLN   3 -12.371   5.670   5.583
   20    H    GLN   4           H        GLN   4 -14.644   1.436   1.528
   21    HA   GLN   4           HA       GLN   4 -15.728   1.093   4.243
   22   1HB   GLN   4          1HB       GLN   4 -17.178   0.126   2.044
   23   2HB   GLN   4          2HB       GLN   4 -16.244  -1.282   2.590
   24   1HG   GLN   4          1HG       GLN   4 -18.048   0.457   4.318
   25   2HG   GLN   4          2HG       GLN   4 -18.399  -1.197   3.762
   26   1HE2  GLN   4          2HE2      GLN   4 -17.147  -2.977   4.654
   27   2HE2  GLN   4          1HE2      GLN   4 -16.040  -2.733   6.021
   28    H    LYS   5           H        LYS   5 -14.631  -0.764   5.357
   29    HA   LYS   5           HA       LYS   5 -12.451  -2.080   3.900
   30   1HB   LYS   5          1HB       LYS   5 -10.979  -1.497   5.966
   31   2HB   LYS   5          2HB       LYS   5 -11.203  -0.322   4.664
   32   1HG   LYS   5          1HG       LYS   5 -11.442   0.946   6.606
   33   2HG   LYS   5          2HG       LYS   5 -13.110   0.684   6.034
   34   1HD   LYS   5          1HD       LYS   5 -13.320  -1.196   7.678
   35   2HD   LYS   5          2HD       LYS   5 -11.642  -0.874   8.196
   36   1HE   LYS   5          1HE       LYS   5 -13.983   1.062   8.407
   37   2HE   LYS   5          2HE       LYS   5 -13.209   0.198   9.749
   38   1HZ   LYS   5          1HZ       LYS   5 -11.159   1.363   9.200
   39   2HZ   LYS   5          2HZ       LYS   5 -11.937   2.198   8.014
   40   3HZ   LYS   5          3HZ       LYS   5 -12.376   2.407   9.586
   41    H    VAL   6           H        VAL   6 -11.567  -3.845   5.038
   42    HA   VAL   6           HA       VAL   6 -13.079  -4.870   7.365
   43    HB   VAL   6           HB       VAL   6 -13.099  -7.146   6.266
   44   1HG1  VAL   6          1HG2      VAL   6 -14.674  -4.906   4.933
   45   2HG1  VAL   6          2HG2      VAL   6 -15.119  -6.628   4.922
   46   3HG1  VAL   6          3HG2      VAL   6 -15.106  -5.720   6.453
   47   1HG2  VAL   6          1HG1      VAL   6 -11.445  -6.676   4.472
   48   2HG2  VAL   6          2HG1      VAL   6 -13.003  -7.215   3.795
   49   3HG2  VAL   6          3HG1      VAL   6 -12.562  -5.490   3.760
   50    H    GLU   7           H        GLU   7 -11.686  -6.270   8.725
   51    HA   GLU   7           HA       GLU   7  -8.926  -5.524   8.067
   52   1HB   GLU   7          1HB       GLU   7  -8.400  -5.755  10.401
   53   2HB   GLU   7          2HB       GLU   7  -9.913  -4.844  10.243
   54   1HG   GLU   7          1HG       GLU   7 -10.407  -6.308  11.975
   55   2HG   GLU   7          2HG       GLU   7 -11.033  -7.224  10.588
   56    H    VAL   8           H        VAL   8  -7.131  -6.863   8.816
   57    HA   VAL   8           HA       VAL   8  -7.490  -9.764   8.404
   58    HB   VAL   8           HB       VAL   8  -6.373  -9.835   6.389
   59   1HG1  VAL   8          1HG2      VAL   8  -8.333  -8.384   5.977
   60   2HG1  VAL   8          2HG2      VAL   8  -7.307  -6.946   6.234
   61   3HG1  VAL   8          3HG2      VAL   8  -6.987  -8.047   4.866
   62   1HG2  VAL   8          1HG1      VAL   8  -4.952  -7.240   7.061
   63   2HG2  VAL   8          2HG1      VAL   8  -4.288  -8.887   7.200
   64   3HG2  VAL   8          3HG1      VAL   8  -4.683  -8.229   5.600
   65    H    ARG   9           H        ARG   9  -5.426 -10.937   9.017
   66    HA   ARG   9           HA       ARG   9  -3.633  -8.958  10.331
   67   1HB   ARG   9          1HB       ARG   9  -4.107 -11.061  11.680
   68   2HB   ARG   9          2HB       ARG   9  -3.032 -11.915  10.511
   69   1HG   ARG   9          1HG       ARG   9  -1.256 -10.253  10.935
   70   2HG   ARG   9          2HG       ARG   9  -2.390  -9.282  11.892
   71   1HD   ARG   9          1HD       ARG   9  -1.116 -10.301  13.501
   72   2HD   ARG   9          2HD       ARG   9  -2.568 -11.318  13.458
   73    HE   ARG   9           HE       ARG   9  -1.226 -12.910  12.048
   74   1HH1  ARG   9          2HH1      ARG   9   0.479 -10.438  13.931
   75   2HH1  ARG   9          1HH1      ARG   9   1.901 -11.412  14.189
   76   1HH2  ARG   9          1HH2      ARG   9   0.701 -14.136  12.254
   77   2HH2  ARG   9          2HH2      ARG   9   2.064 -13.518  13.146
   78    H    LEU  10           H        LEU  10  -1.992  -8.276   9.299
   79    HA   LEU  10           HA       LEU  10  -1.705  -8.651   6.552
   80   1HB   LEU  10          1HB       LEU  10  -1.133  -6.770   8.245
   81   2HB   LEU  10          2HB       LEU  10   0.455  -7.544   8.373
   82    HG   LEU  10           HG       LEU  10   0.907  -7.092   6.040
   83   1HD1  LEU  10          1HD2      LEU  10  -2.030  -6.263   5.856
   84   2HD1  LEU  10          2HD2      LEU  10  -0.821  -6.111   4.556
   85   3HD1  LEU  10          3HD2      LEU  10  -1.312  -7.722   5.126
   86   1HD2  LEU  10          1HD1      LEU  10   1.012  -5.201   7.651
   87   2HD2  LEU  10          2HD1      LEU  10   0.588  -4.651   6.014
   88   3HD2  LEU  10          3HD1      LEU  10  -0.675  -4.783   7.266
   89    H    LYS  11           H        LYS  11  -1.530 -11.000   6.387
   90    HA   LYS  11           HA       LYS  11   0.866 -12.389   7.209
   91   1HB   LYS  11          1HB       LYS  11  -1.041 -13.716   6.791
   92   2HB   LYS  11          2HB       LYS  11  -1.432 -12.878   5.282
   93   1HG   LYS  11          1HG       LYS  11   1.027 -14.603   5.481
   94   2HG   LYS  11          2HG       LYS  11  -0.589 -15.226   5.053
   95   1HD   LYS  11          1HD       LYS  11   0.991 -13.084   3.566
   96   2HD   LYS  11          2HD       LYS  11   0.444 -14.654   2.951
   97   1HE   LYS  11          1HE       LYS  11  -1.445 -12.422   3.851
   98   2HE   LYS  11          2HE       LYS  11  -0.969 -12.775   2.155
   99   1HZ   LYS  11          1HZ       LYS  11  -2.335 -14.660   3.873
  100   2HZ   LYS  11          2HZ       LYS  11  -3.014 -13.735   2.666
  101   3HZ   LYS  11          3HZ       LYS  11  -1.879 -14.868   2.302
  102    H    THR  12           H        THR  12  -0.266 -10.829   4.258
  103    HA   THR  12           HA       THR  12   1.924 -11.043   2.502
  104    HB   THR  12           HB       THR  12   1.214  -8.579   1.957
  105    HG1  THR  12           HG1      THR  12  -0.982  -9.316   3.624
  106   1HG2  THR  12          1HG2      THR  12  -0.988 -10.648   1.717
  107   2HG2  THR  12          2HG2      THR  12  -0.820  -9.134   0.786
  108   3HG2  THR  12          3HG2      THR  12   0.375 -10.427   0.595
  109    H    GLY  13           H        GLY  13   1.173  -8.347   4.647
  110   1HA   GLY  13          1HA       GLY  13   2.448  -6.714   5.658
  111   2HA   GLY  13          2HA       GLY  13   3.802  -7.854   5.793
  112    H    LEU  14           H        LEU  14   2.170  -7.105   2.872
  113    HA   LEU  14           HA       LEU  14   3.071  -6.665   0.754
  114   1HB   LEU  14          1HB       LEU  14   3.016  -4.092   2.337
  115   2HB   LEU  14          2HB       LEU  14   3.098  -4.221   0.582
  116    HG   LEU  14           HG       LEU  14   0.803  -4.585   2.353
  117   1HD1  LEU  14          1HD2      LEU  14   0.932  -3.024   0.444
  118   2HD1  LEU  14          2HD2      LEU  14   1.038  -4.403  -0.676
  119   3HD1  LEU  14          3HD2      LEU  14  -0.436  -4.150   0.286
  120   1HD2  LEU  14          1HD1      LEU  14   1.223  -6.764   0.282
  121   2HD2  LEU  14          2HD1      LEU  14   0.987  -6.962   2.033
  122   3HD2  LEU  14          3HD1      LEU  14  -0.335  -6.341   1.027
  123    H    GLN  15           H        GLN  15   4.906  -7.993   0.925
  124    HA   GLN  15           HA       GLN  15   7.373  -6.461   1.584
  125   1HB   GLN  15          1HB       GLN  15   6.980  -9.470   1.427
  126   2HB   GLN  15          2HB       GLN  15   8.445  -8.617   1.980
  127   1HG   GLN  15          1HG       GLN  15   7.042  -7.436   3.699
  128   2HG   GLN  15          2HG       GLN  15   5.659  -8.422   3.203
  129   1HE2  GLN  15          2HE2      GLN  15   5.270 -10.088   4.527
  130   2HE2  GLN  15          1HE2      GLN  15   6.495 -10.970   5.450
  131    H    ALA  16           H        ALA  16   6.641  -9.097  -0.841
  132    HA   ALA  16           HA       ALA  16   8.346  -7.472  -2.667
  133   1HB   ALA  16          1HB       ALA  16   9.671  -9.281  -1.653
  134   2HB   ALA  16          2HB       ALA  16   8.478 -10.476  -2.223
  135   3HB   ALA  16          3HB       ALA  16   9.440  -9.547  -3.398
  136    H    ARG  17           H        ARG  17   5.659  -9.824  -2.358
  137    HA   ARG  17           HA       ARG  17   5.201  -9.273  -5.262
  138   1HB   ARG  17          1HB       ARG  17   4.863 -11.950  -3.881
  139   2HB   ARG  17          2HB       ARG  17   4.429 -11.603  -5.571
  140   1HG   ARG  17          1HG       ARG  17   6.593 -11.844  -6.231
  141   2HG   ARG  17          2HG       ARG  17   7.135 -10.709  -4.972
  142   1HD   ARG  17          1HD       ARG  17   6.543 -13.671  -4.565
  143   2HD   ARG  17          2HD       ARG  17   8.152 -12.905  -4.579
  144    HE   ARG  17           HE       ARG  17   6.507 -11.591  -2.656
  145   1HH1  ARG  17          1HH2      ARG  17   8.146 -14.695  -3.095
  146   2HH1  ARG  17          2HH2      ARG  17   8.347 -14.953  -1.379
  147   1HH2  ARG  17          2HH1      ARG  17   6.736 -11.889  -0.548
  148   2HH2  ARG  17          1HH1      ARG  17   7.517 -13.308   0.150
  149    HA   PRO  18           HA       PRO  18   0.789 -10.198  -3.623
  150   1HB   PRO  18          1HB       PRO  18   0.396 -10.751  -0.987
  151   2HB   PRO  18          2HB       PRO  18   0.784 -12.029  -2.192
  152   1HG   PRO  18          1HG       PRO  18   2.758 -10.441  -0.506
  153   2HG   PRO  18          2HG       PRO  18   2.601 -12.209  -0.518
  154   1HD   PRO  18          1HD       PRO  18   4.433 -11.051  -2.054
  155   2HD   PRO  18          2HD       PRO  18   3.375 -12.268  -2.847
  156    H    ALA  19           H        ALA  19   3.130  -8.494  -1.543
  157    HA   ALA  19           HA       ALA  19   1.608  -6.426  -0.567
  158   1HB   ALA  19          1HB       ALA  19   4.122  -6.801  -0.528
  159   2HB   ALA  19          2HB       ALA  19   4.165  -6.212  -2.209
  160   3HB   ALA  19          3HB       ALA  19   3.668  -5.114  -0.894
  161    H    ALA  20           H        ALA  20   3.056  -6.537  -3.835
  162    HA   ALA  20           HA       ALA  20   1.554  -4.129  -4.727
  163   1HB   ALA  20          1HB       ALA  20   3.360  -6.120  -6.205
  164   2HB   ALA  20          2HB       ALA  20   2.728  -4.597  -6.874
  165   3HB   ALA  20          3HB       ALA  20   3.895  -4.560  -5.530
  166    H    LEU  21           H        LEU  21   1.366  -7.681  -4.894
  167    HA   LEU  21           HA       LEU  21  -0.633  -7.873  -6.882
  168   1HB   LEU  21          1HB       LEU  21   0.632  -9.676  -5.520
  169   2HB   LEU  21          2HB       LEU  21  -0.714  -9.566  -4.372
  170    HG   LEU  21           HG       LEU  21  -1.162  -9.901  -7.365
  171   1HD1  LEU  21          1HD1      LEU  21  -0.871 -12.086  -5.271
  172   2HD1  LEU  21          2HD1      LEU  21  -1.406 -12.327  -6.952
  173   3HD1  LEU  21          3HD1      LEU  21   0.250 -11.767  -6.615
  174   1HD2  LEU  21          1HD2      LEU  21  -3.088  -9.178  -5.972
  175   2HD2  LEU  21          2HD2      LEU  21  -3.332 -10.820  -6.609
  176   3HD2  LEU  21          3HD2      LEU  21  -2.846 -10.585  -4.914
  177    H    PHE  22           H        PHE  22  -0.896  -7.435  -3.413
  178    HA   PHE  22           HA       PHE  22  -3.598  -6.945  -2.872
  179   1HB   PHE  22          1HB       PHE  22  -1.897  -7.123  -1.213
  180   2HB   PHE  22          2HB       PHE  22  -0.933  -5.849  -1.937
  181    HD1  PHE  22           HD1      PHE  22  -1.808  -3.436  -1.925
  182    HD2  PHE  22           HD2      PHE  22  -3.110  -6.552   0.733
  183    HE1  PHE  22           HE1      PHE  22  -2.192  -1.755  -0.183
  184    HE2  PHE  22           HE2      PHE  22  -3.486  -4.864   2.517
  185    HZ   PHE  22           HZ       PHE  22  -3.040  -2.456   2.071
  186    H    VAL  23           H        VAL  23  -1.076  -4.454  -3.514
  187    HA   VAL  23           HA       VAL  23  -2.883  -2.332  -3.712
  188    HB   VAL  23           HB       VAL  23  -1.077  -1.052  -4.328
  189   1HG1  VAL  23          1HG1      VAL  23  -0.413  -2.194  -2.340
  190   2HG1  VAL  23          2HG1      VAL  23   0.343  -3.489  -3.297
  191   3HG1  VAL  23          3HG1      VAL  23   0.974  -1.827  -3.374
  192   1HG2  VAL  23          1HG2      VAL  23  -1.013  -1.872  -6.529
  193   2HG2  VAL  23          2HG2      VAL  23   0.636  -1.643  -5.902
  194   3HG2  VAL  23          3HG2      VAL  23  -0.090  -3.294  -6.033
  195    H    GLN  24           H        GLN  24  -1.738  -4.551  -6.220
  196    HA   GLN  24           HA       GLN  24  -2.779  -2.994  -8.407
  197   1HB   GLN  24          1HB       GLN  24  -2.006  -4.750  -9.845
  198   2HB   GLN  24          2HB       GLN  24  -0.780  -4.382  -8.621
  199   1HG   GLN  24          1HG       GLN  24  -0.703  -6.674  -8.679
  200   2HG   GLN  24          2HG       GLN  24  -1.820  -6.400  -7.330
  201   1HE2  GLN  24          2HE2      GLN  24  -3.448  -7.864  -7.391
  202   2HE2  GLN  24          1HE2      GLN  24  -4.188  -8.524  -8.853
  203    H    GLU  25           H        GLU  25  -3.959  -5.736  -6.451
  204    HA   GLU  25           HA       GLU  25  -6.186  -6.112  -8.272
  205   1HB   GLU  25          1HB       GLU  25  -7.106  -7.534  -6.346
  206   2HB   GLU  25          2HB       GLU  25  -5.526  -8.054  -6.964
  207   1HG   GLU  25          1HG       GLU  25  -4.397  -6.812  -5.150
  208   2HG   GLU  25          2HG       GLU  25  -5.966  -6.335  -4.496
  209    H    ALA  26           H        ALA  26  -5.651  -4.489  -5.150
  210    HA   ALA  26           HA       ALA  26  -8.160  -3.338  -4.691
  211   1HB   ALA  26          1HB       ALA  26  -5.385  -2.107  -4.519
  212   2HB   ALA  26          2HB       ALA  26  -6.833  -1.493  -3.682
  213   3HB   ALA  26          3HB       ALA  26  -6.157  -3.088  -3.246
  214    H    ASN  27           H        ASN  27  -5.409  -2.069  -6.587
  215    HA   ASN  27           HA       ASN  27  -6.499   0.104  -7.889
  216   1HB   ASN  27          1HB       ASN  27  -4.399  -1.951  -8.267
  217   2HB   ASN  27          2HB       ASN  27  -4.935  -1.233  -9.781
  218   1HD2  ASN  27          2HD2      ASN  27  -2.813  -0.895  -7.235
  219   2HD2  ASN  27          1HD2      ASN  27  -2.332   0.777  -7.414
  220    H    ARG  28           H        ARG  28  -6.558  -3.311  -8.878
  221    HA   ARG  28           HA       ARG  28  -7.663  -3.078 -11.455
  222   1HB   ARG  28          1HB       ARG  28  -7.669  -5.273  -9.377
  223   2HB   ARG  28          2HB       ARG  28  -8.363  -5.497 -11.004
  224   1HG   ARG  28          1HG       ARG  28  -6.262  -5.055 -12.083
  225   2HG   ARG  28          2HG       ARG  28  -5.574  -4.414 -10.578
  226   1HD   ARG  28          1HD       ARG  28  -4.645  -6.601 -10.985
  227   2HD   ARG  28          2HD       ARG  28  -5.659  -6.634  -9.539
  228    HE   ARG  28           HE       ARG  28  -7.459  -7.506 -11.248
  229   1HH1  ARG  28          1HH2      ARG  28  -3.981  -8.205 -11.279
  230   2HH1  ARG  28          2HH2      ARG  28  -4.160  -9.770 -12.019
  231   1HH2  ARG  28          2HH1      ARG  28  -7.696  -9.566 -12.233
  232   2HH2  ARG  28          1HH1      ARG  28  -6.303 -10.556 -12.572
  233    H    PHE  29           H        PHE  29  -9.258  -2.712  -8.349
  234    HA   PHE  29           HA       PHE  29 -11.900  -3.112  -9.543
  235   1HB   PHE  29          1HB       PHE  29 -11.044  -1.744  -6.969
  236   2HB   PHE  29          2HB       PHE  29 -12.707  -2.192  -7.405
  237    HD1  PHE  29           HD1      PHE  29  -9.531  -3.189  -6.030
  238    HD2  PHE  29           HD2      PHE  29 -13.237  -4.727  -7.561
  239    HE1  PHE  29           HE1      PHE  29  -9.158  -5.313  -4.771
  240    HE2  PHE  29           HE2      PHE  29 -12.868  -6.856  -6.318
  241    HZ   PHE  29           HZ       PHE  29 -10.875  -7.118  -4.871
  242    H    THR  30           H        THR  30 -11.309  -0.184  -7.711
  243    HA   THR  30           HA       THR  30 -10.937   1.610  -9.955
  244    HB   THR  30           HB       THR  30 -13.176   2.759  -9.295
  245    HG1  THR  30           HG1      THR  30 -13.900   0.082  -8.676
  246   1HG2  THR  30          1HG2      THR  30 -14.479   1.393 -10.931
  247   2HG2  THR  30          2HG2      THR  30 -12.847   1.807 -11.506
  248   3HG2  THR  30          3HG2      THR  30 -13.174   0.172 -10.894
  249    H    SER  31           H        SER  31 -12.549   1.358  -6.907
  250    HA   SER  31           HA       SER  31 -12.457   3.353  -5.385
  251   1HB   SER  31          1HB       SER  31 -11.201   0.774  -4.431
  252   2HB   SER  31          2HB       SER  31 -12.336   1.825  -3.551
  253    HG   SER  31           HG       SER  31 -13.246  -0.132  -4.573
  254    H    ASP  32           H        ASP  32 -11.439   4.512  -3.934
  255    HA   ASP  32           HA       ASP  32  -8.523   4.859  -4.106
  256   1HB   ASP  32          1HB       ASP  32 -10.634   5.983  -2.221
  257   2HB   ASP  32          2HB       ASP  32  -8.934   6.475  -2.245
  258    H    VAL  33           H        VAL  33  -8.140   2.592  -3.650
  259    HA   VAL  33           HA       VAL  33  -9.106   1.333  -1.298
  260    HB   VAL  33           HB       VAL  33  -6.802   0.733  -3.178
  261   1HG1  VAL  33          1HG1      VAL  33  -8.132  -1.029  -1.074
  262   2HG1  VAL  33          2HG1      VAL  33  -6.914  -1.561  -2.269
  263   3HG1  VAL  33          3HG1      VAL  33  -6.474  -0.374  -1.021
  264   1HG2  VAL  33          1HG2      VAL  33  -9.085   0.944  -4.115
  265   2HG2  VAL  33          2HG2      VAL  33  -8.547  -0.750  -4.177
  266   3HG2  VAL  33          3HG2      VAL  33  -9.699  -0.211  -2.921
  267    H    PHE  34           H        PHE  34  -8.048   0.751   0.642
  268    HA   PHE  34           HA       PHE  34  -5.691   2.391   1.318
  269   1HB   PHE  34          1HB       PHE  34  -8.320   2.616   2.828
  270   2HB   PHE  34          2HB       PHE  34  -6.754   3.226   3.357
  271    HD1  PHE  34           HD1      PHE  34  -5.521   4.566   1.288
  272    HD2  PHE  34           HD2      PHE  34  -9.738   4.363   2.082
  273    HE1  PHE  34           HE1      PHE  34  -5.852   6.703   0.042
  274    HE2  PHE  34           HE2      PHE  34 -10.072   6.488   0.839
  275    HZ   PHE  34           HZ       PHE  34  -8.139   7.659  -0.179
  276    H    LEU  35           H        LEU  35  -4.642   1.782   3.252
  277    HA   LEU  35           HA       LEU  35  -5.797  -0.580   4.632
  278   1HB   LEU  35          1HB       LEU  35  -3.884  -1.499   3.293
  279   2HB   LEU  35          2HB       LEU  35  -2.813  -0.298   4.080
  280    HG   LEU  35           HG       LEU  35  -3.610  -1.263   6.297
  281   1HD1  LEU  35          1HD1      LEU  35  -5.674  -2.333   5.390
  282   2HD1  LEU  35          2HD1      LEU  35  -4.663  -3.447   4.439
  283   3HD1  LEU  35          3HD1      LEU  35  -4.631  -3.515   6.218
  284   1HD2  LEU  35          1HD2      LEU  35  -1.435  -1.873   5.290
  285   2HD2  LEU  35          2HD2      LEU  35  -2.163  -3.251   6.152
  286   3HD2  LEU  35          3HD2      LEU  35  -2.227  -3.176   4.372
  287    H    GLU  36           H        GLU  36  -6.122   0.025   6.670
  288    HA   GLU  36           HA       GLU  36  -4.411   2.214   7.745
  289   1HB   GLU  36          1HB       GLU  36  -6.802   2.231   9.221
  290   2HB   GLU  36          2HB       GLU  36  -6.095   3.434   8.167
  291   1HG   GLU  36          1HG       GLU  36  -7.984   3.262   7.054
  292   2HG   GLU  36          2HG       GLU  36  -7.199   1.910   6.262
  293    H    LYS  37           H        LYS  37  -3.060   1.262   9.208
  294    HA   LYS  37           HA       LYS  37  -3.721  -1.343  10.387
  295   1HB   LYS  37          1HB       LYS  37  -1.345  -0.801   9.867
  296   2HB   LYS  37          2HB       LYS  37  -1.483   0.630  10.926
  297   1HG   LYS  37          1HG       LYS  37  -2.242  -0.836  12.754
  298   2HG   LYS  37          2HG       LYS  37  -1.733  -2.225  11.764
  299   1HD   LYS  37          1HD       LYS  37   0.073   0.088  12.618
  300   2HD   LYS  37          2HD       LYS  37   0.001  -1.471  13.464
  301   1HE   LYS  37          1HE       LYS  37   0.757  -2.664  11.482
  302   2HE   LYS  37          2HE       LYS  37   0.693  -1.175  10.511
  303   1HZ   LYS  37          1HZ       LYS  37   2.378  -0.264  11.975
  304   2HZ   LYS  37          2HZ       LYS  37   2.492  -1.710  12.764
  305   3HZ   LYS  37          3HZ       LYS  37   2.875  -1.604  11.158
  306    H    ASP  38           H        ASP  38  -5.493  -1.137  11.659
  307    HA   ASP  38           HA       ASP  38  -6.854  -0.463  13.383
  308   1HB   ASP  38          1HB       ASP  38  -4.229   0.549  14.540
  309   2HB   ASP  38          2HB       ASP  38  -5.738   0.318  15.435
  310    H    GLY  39           H        GLY  39  -6.261   1.469  11.086
  311   1HA   GLY  39          1HA       GLY  39  -7.654   3.572  11.144
  312   2HA   GLY  39          2HA       GLY  39  -6.808   3.928  12.667
  313    H    LYS  40           H        LYS  40  -4.134   2.873  11.523
  314    HA   LYS  40           HA       LYS  40  -3.467   5.437  10.294
  315   1HB   LYS  40          1HB       LYS  40  -1.173   4.703  10.416
  316   2HB   LYS  40          2HB       LYS  40  -2.013   4.327  11.939
  317   1HG   LYS  40          1HG       LYS  40  -2.396   1.993  11.022
  318   2HG   LYS  40          2HG       LYS  40  -1.263   2.416   9.707
  319   1HD   LYS  40          1HD       LYS  40  -0.074   1.286  11.564
  320   2HD   LYS  40          2HD       LYS  40   0.428   3.001  11.538
  321   1HE   LYS  40          1HE       LYS  40  -1.286   3.561  13.198
  322   2HE   LYS  40          2HE       LYS  40  -1.924   1.912  13.150
  323   1HZ   LYS  40          1HZ       LYS  40   0.766   2.680  14.094
  324   2HZ   LYS  40          2HZ       LYS  40  -0.510   2.271  15.055
  325   3HZ   LYS  40          3HZ       LYS  40   0.165   1.143  14.066
  326    H    LYS  41           H        LYS  41  -4.806   5.350   8.563
  327    HA   LYS  41           HA       LYS  41  -4.443   3.259   6.576
  328   1HB   LYS  41          1HB       LYS  41  -6.550   3.553   6.669
  329   2HB   LYS  41          2HB       LYS  41  -6.475   5.146   7.362
  330   1HG   LYS  41          1HG       LYS  41  -6.228   4.361   4.418
  331   2HG   LYS  41          2HG       LYS  41  -7.728   4.913   5.160
  332   1HD   LYS  41          1HD       LYS  41  -6.586   7.070   5.826
  333   2HD   LYS  41          2HD       LYS  41  -5.191   6.579   4.851
  334   1HE   LYS  41          1HE       LYS  41  -6.572   8.034   3.510
  335   2HE   LYS  41          2HE       LYS  41  -6.755   6.394   2.852
  336   1HZ   LYS  41          1HZ       LYS  41  -8.628   7.705   4.706
  337   2HZ   LYS  41          2HZ       LYS  41  -8.832   7.551   3.077
  338   3HZ   LYS  41          3HZ       LYS  41  -8.814   6.211   4.026
  339    H    VAL  42           H        VAL  42  -4.072   3.486   4.487
  340    HA   VAL  42           HA       VAL  42  -3.014   5.971   3.253
  341    HB   VAL  42           HB       VAL  42  -1.033   4.517   2.434
  342   1HG1  VAL  42          1HG1      VAL  42  -1.269   5.359   5.352
  343   2HG1  VAL  42          2HG1      VAL  42   0.266   5.055   4.499
  344   3HG1  VAL  42          3HG1      VAL  42  -0.781   6.400   3.994
  345   1HG2  VAL  42          1HG2      VAL  42  -1.993   2.377   3.191
  346   2HG2  VAL  42          2HG2      VAL  42  -0.396   2.673   3.928
  347   3HG2  VAL  42          3HG2      VAL  42  -1.885   2.923   4.879
  348    H    ASN  43           H        ASN  43  -2.637   5.617   0.866
  349    HA   ASN  43           HA       ASN  43  -4.881   4.142  -0.245
  350   1HB   ASN  43          1HB       ASN  43  -4.069   6.282  -1.226
  351   2HB   ASN  43          2HB       ASN  43  -2.518   5.494  -1.595
  352   1HD2  ASN  43          2HD2      ASN  43  -5.951   4.297  -2.001
  353   2HD2  ASN  43          1HD2      ASN  43  -5.808   4.203  -3.752
  354    H    ALA  44           H        ALA  44  -4.786   2.184   0.087
  355    HA   ALA  44           HA       ALA  44  -2.764   0.373   0.395
  356   1HB   ALA  44          1HB       ALA  44  -5.201  -0.013   0.806
  357   2HB   ALA  44          2HB       ALA  44  -5.458  -0.044  -0.950
  358   3HB   ALA  44          3HB       ALA  44  -4.503  -1.329  -0.181
  359    H    LYS  45           H        LYS  45  -4.267   1.407  -2.629
  360    HA   LYS  45           HA       LYS  45  -2.910  -0.611  -4.245
  361   1HB   LYS  45          1HB       LYS  45  -3.877   0.662  -6.136
  362   2HB   LYS  45          2HB       LYS  45  -5.083   0.119  -4.954
  363   1HG   LYS  45          1HG       LYS  45  -5.352   2.321  -4.066
  364   2HG   LYS  45          2HG       LYS  45  -3.862   2.899  -4.843
  365   1HD   LYS  45          1HD       LYS  45  -5.796   3.679  -6.163
  366   2HD   LYS  45          2HD       LYS  45  -4.843   2.496  -7.081
  367   1HE   LYS  45          1HE       LYS  45  -6.431   0.700  -6.343
  368   2HE   LYS  45          2HE       LYS  45  -7.474   1.955  -5.630
  369   1HZ   LYS  45          1HZ       LYS  45  -6.665   1.883  -8.447
  370   2HZ   LYS  45          2HZ       LYS  45  -8.108   1.334  -7.863
  371   3HZ   LYS  45          3HZ       LYS  45  -7.739   2.925  -7.743
  372    H    SER  46           H        SER  46  -1.984   2.395  -2.914
  373    HA   SER  46           HA       SER  46   0.131   2.785  -4.977
  374   1HB   SER  46          1HB       SER  46  -1.191   4.638  -2.987
  375   2HB   SER  46          2HB       SER  46   0.436   4.960  -3.617
  376    HG   SER  46           HG       SER  46  -2.025   4.873  -4.961
  377    H    ILE  47           H        ILE  47   2.134   3.657  -4.160
  378    HA   ILE  47           HA       ILE  47   3.774   2.125  -2.729
  379    HB   ILE  47           HB       ILE  47   4.579   3.957  -3.931
  380   1HG1  ILE  47          1HG1      ILE  47   5.858   3.339  -1.777
  381   2HG1  ILE  47          2HG1      ILE  47   6.256   4.868  -2.587
  382   1HG2  ILE  47          1HG2      ILE  47   2.693   5.499  -3.678
  383   2HG2  ILE  47          2HG2      ILE  47   3.216   5.863  -2.014
  384   3HG2  ILE  47          3HG2      ILE  47   4.251   6.306  -3.387
  385   1HD1  ILE  47          1HD1      ILE  47   4.782   6.103  -1.016
  386   2HD1  ILE  47          2HD1      ILE  47   4.452   4.591  -0.152
  387   3HD1  ILE  47          3HD1      ILE  47   6.098   5.254  -0.171
  388    H    MET  48           H        MET  48   2.217   4.926  -1.069
  389    HA   MET  48           HA       MET  48   3.296   4.050   1.427
  390   1HB   MET  48          1HB       MET  48   2.750   6.395   0.885
  391   2HB   MET  48          2HB       MET  48   1.018   5.998   0.923
  392   1HG   MET  48          1HG       MET  48   1.288   5.221   3.270
  393   2HG   MET  48          2HG       MET  48   3.010   5.630   3.198
  394   1HE   MET  48          1HE       MET  48   2.658   6.899   5.474
  395   2HE   MET  48          2HE       MET  48   1.463   8.198   5.718
  396   3HE   MET  48          3HE       MET  48   0.914   6.526   5.443
  397    H    GLY  49           H        GLY  49   0.350   3.101  -0.242
  398   1HA   GLY  49          1HA       GLY  49  -0.929   2.220   2.238
  399   2HA   GLY  49          2HA       GLY  49  -1.507   1.918   0.562
  400    H    LEU  50           H        LEU  50   0.775   0.832  -0.586
  401    HA   LEU  50           HA       LEU  50   0.796  -1.866   0.294
  402   1HB   LEU  50          1HB       LEU  50   1.021  -1.487  -1.984
  403   2HB   LEU  50          2HB       LEU  50   2.069  -0.083  -1.757
  404    HG   LEU  50           HG       LEU  50   3.988  -1.421  -1.321
  405   1HD1  LEU  50          1HD2      LEU  50   2.138  -3.829  -1.457
  406   2HD1  LEU  50          2HD2      LEU  50   3.913  -3.880  -1.291
  407   3HD1  LEU  50          3HD2      LEU  50   2.918  -3.186   0.002
  408   1HD2  LEU  50          1HD1      LEU  50   3.353  -1.106  -3.696
  409   2HD2  LEU  50          2HD1      LEU  50   4.164  -2.670  -3.447
  410   3HD2  LEU  50          3HD1      LEU  50   2.396  -2.606  -3.635
  411    H    MET  51           H        MET  51   3.554   0.368  -0.075
  412    HA   MET  51           HA       MET  51   5.285  -1.410   1.378
  413   1HB   MET  51          1HB       MET  51   6.002  -0.038  -0.595
  414   2HB   MET  51          2HB       MET  51   5.584   1.429   0.311
  415   1HG   MET  51          1HG       MET  51   7.260   0.596   2.087
  416   2HG   MET  51          2HG       MET  51   7.870  -0.477   0.818
  417   1HE   MET  51          1HE       MET  51   6.269   3.028   0.425
  418   2HE   MET  51          2HE       MET  51   7.193   3.234   1.933
  419   3HE   MET  51          3HE       MET  51   7.673   4.124   0.467
  420    H    SER  52           H        SER  52   3.587   1.675   2.144
  421    HA   SER  52           HA       SER  52   5.178   1.918   4.567
  422   1HB   SER  52          1HB       SER  52   2.644   3.411   3.834
  423   2HB   SER  52          2HB       SER  52   3.868   3.892   5.035
  424    HG   SER  52           HG       SER  52   5.374   3.939   3.222
  425    H    LEU  53           H        LEU  53   1.579   1.637   4.217
  426    HA   LEU  53           HA       LEU  53   1.492   0.716   6.989
  427   1HB   LEU  53          1HB       LEU  53  -0.602   1.265   4.928
  428   2HB   LEU  53          2HB       LEU  53  -0.967   0.493   6.489
  429    HG   LEU  53           HG       LEU  53  -1.226   2.869   6.774
  430   1HD1  LEU  53          1HD1      LEU  53  -0.233   1.589   8.638
  431   2HD1  LEU  53          2HD1      LEU  53   1.393   1.942   8.005
  432   3HD1  LEU  53          3HD1      LEU  53   0.366   3.266   8.603
  433   1HD2  LEU  53          1HD2      LEU  53   0.275   3.523   4.874
  434   2HD2  LEU  53          2HD2      LEU  53   0.597   4.457   6.368
  435   3HD2  LEU  53          3HD2      LEU  53   1.676   3.120   5.894
  436    H    ALA  54           H        ALA  54   0.469  -0.710   3.876
  437    HA   ALA  54           HA       ALA  54  -0.309  -3.212   4.833
  438   1HB   ALA  54          1HB       ALA  54  -0.875  -2.192   2.629
  439   2HB   ALA  54          2HB       ALA  54   0.790  -2.488   2.102
  440   3HB   ALA  54          3HB       ALA  54  -0.271  -3.858   2.480
  441    H    VAL  55           H        VAL  55   2.938  -2.017   4.466
  442    HA   VAL  55           HA       VAL  55   4.199  -4.572   4.234
  443    HB   VAL  55           HB       VAL  55   5.144  -2.238   3.742
  444   1HG1  VAL  55          1HG1      VAL  55   4.659  -1.237   5.968
  445   2HG1  VAL  55          2HG1      VAL  55   5.747  -2.426   6.730
  446   3HG1  VAL  55          3HG1      VAL  55   6.398  -1.212   5.599
  447   1HG2  VAL  55          1HG2      VAL  55   6.420  -4.333   3.604
  448   2HG2  VAL  55          2HG2      VAL  55   7.429  -3.021   4.266
  449   3HG2  VAL  55          3HG2      VAL  55   6.748  -4.260   5.352
  450    H    SER  56           H        SER  56   2.411  -3.280   6.851
  451    HA   SER  56           HA       SER  56   4.170  -4.269   8.897
  452   1HB   SER  56          1HB       SER  56   1.227  -3.512   9.103
  453   2HB   SER  56          2HB       SER  56   2.385  -3.593  10.438
  454    HG   SER  56           HG       SER  56   2.356  -1.780   8.235
  455    H    THR  57           H        THR  57   4.232  -6.470   7.645
  456    HA   THR  57           HA       THR  57   2.382  -8.440   7.832
  457    HB   THR  57           HB       THR  57   5.160  -8.971   8.848
  458    HG1  THR  57           HG1      THR  57   5.791  -8.835   6.582
  459   1HG2  THR  57          1HG2      THR  57   3.297 -10.240   6.786
  460   2HG2  THR  57          2HG2      THR  57   4.857 -10.921   7.322
  461   3HG2  THR  57          3HG2      THR  57   3.497 -10.773   8.465
  462    H    GLY  58           H        GLY  58   1.161  -9.259   9.380
  463   1HA   GLY  58          1HA       GLY  58   0.856 -10.397  11.450
  464   2HA   GLY  58          2HA       GLY  58   2.255  -9.540  12.111
  465    H    THR  59           H        THR  59   0.416  -7.092  10.607
  466    HA   THR  59           HA       THR  59  -0.727  -6.512  13.274
  467    HB   THR  59           HB       THR  59  -0.937  -4.711  10.842
  468    HG1  THR  59           HG1      THR  59   1.281  -5.335  11.122
  469   1HG2  THR  59          1HG2      THR  59  -0.795  -2.976  12.638
  470   2HG2  THR  59          2HG2      THR  59  -2.157  -4.091  12.900
  471   3HG2  THR  59          3HG2      THR  59  -0.659  -4.267  13.845
  472    H    GLU  60           H        GLU  60  -3.090  -6.208  13.536
  473    HA   GLU  60           HA       GLU  60  -4.589  -7.561  11.374
  474   1HB   GLU  60          1HB       GLU  60  -5.849  -6.327  13.820
  475   2HB   GLU  60          2HB       GLU  60  -6.430  -7.646  12.745
  476   1HG   GLU  60          1HG       GLU  60  -3.928  -7.981  14.420
  477   2HG   GLU  60          2HG       GLU  60  -5.541  -8.329  15.070
  478    H    VAL  61           H        VAL  61  -4.290  -6.211   9.784
  479    HA   VAL  61           HA       VAL  61  -4.667  -3.316  10.081
  480    HB   VAL  61           HB       VAL  61  -4.051  -3.927   7.342
  481   1HG1  VAL  61          1HG2      VAL  61  -2.632  -3.074   9.848
  482   2HG1  VAL  61          2HG2      VAL  61  -2.101  -2.715   8.163
  483   3HG1  VAL  61          3HG2      VAL  61  -3.657  -2.047   8.796
  484   1HG2  VAL  61          1HG1      VAL  61  -2.361  -5.340   9.495
  485   2HG2  VAL  61          2HG1      VAL  61  -3.169  -6.182   8.162
  486   3HG2  VAL  61          3HG1      VAL  61  -1.818  -5.056   7.827
  487    H    THR  62           H        THR  62  -6.040  -2.003   8.781
  488    HA   THR  62           HA       THR  62  -8.301  -3.667   8.072
  489    HB   THR  62           HB       THR  62  -8.653  -0.695   8.212
  490    HG1  THR  62           HG1      THR  62  -7.390  -0.994   9.990
  491   1HG2  THR  62          1HG2      THR  62 -10.738  -1.414   9.386
  492   2HG2  THR  62          2HG2      THR  62 -10.565  -2.199   7.792
  493   3HG2  THR  62          3HG2      THR  62 -10.191  -3.103   9.283
  494    H    LEU  63           H        LEU  63  -8.811  -4.004   5.936
  495    HA   LEU  63           HA       LEU  63  -7.431  -2.193   4.058
  496   1HB   LEU  63          1HB       LEU  63  -7.198  -4.817   4.164
  497   2HB   LEU  63          2HB       LEU  63  -8.645  -4.766   3.121
  498    HG   LEU  63           HG       LEU  63  -6.139  -3.070   2.676
  499   1HD1  LEU  63          1HD2      LEU  63  -5.558  -5.455   2.630
  500   2HD1  LEU  63          2HD2      LEU  63  -6.877  -5.761   1.477
  501   3HD1  LEU  63          3HD2      LEU  63  -5.486  -4.757   0.995
  502   1HD2  LEU  63          1HD1      LEU  63  -8.446  -3.869   0.849
  503   2HD2  LEU  63          2HD1      LEU  63  -8.170  -2.253   1.541
  504   3HD2  LEU  63          3HD1      LEU  63  -7.025  -2.920   0.357
  505    H    ILE  64           H        ILE  64  -8.481  -0.711   3.227
  506    HA   ILE  64           HA       ILE  64 -11.429  -0.626   2.989
  507    HB   ILE  64           HB       ILE  64  -9.186   1.447   2.804
  508   1HG1  ILE  64          1HG1      ILE  64 -11.439   1.169   4.820
  509   2HG1  ILE  64          2HG1      ILE  64  -9.730   0.770   5.114
  510   1HG2  ILE  64          1HG2      ILE  64 -12.188   1.868   2.581
  511   2HG2  ILE  64          2HG2      ILE  64 -10.963   3.158   2.672
  512   3HG2  ILE  64          3HG2      ILE  64 -11.001   2.062   1.269
  513   1HD1  ILE  64          1HD1      ILE  64  -9.095   3.113   4.600
  514   2HD1  ILE  64          2HD1      ILE  64 -10.820   3.519   4.365
  515   3HD1  ILE  64          3HD1      ILE  64 -10.234   3.008   5.973
  516    H    ALA  65           H        ALA  65 -12.296   0.072   1.081
  517    HA   ALA  65           HA       ALA  65 -10.573   0.714  -1.204
  518   1HB   ALA  65          1HB       ALA  65 -12.883  -1.269  -1.325
  519   2HB   ALA  65          2HB       ALA  65 -12.010  -0.609  -2.729
  520   3HB   ALA  65          3HB       ALA  65 -11.167  -1.678  -1.577
  521    H    GLN  66           H        GLN  66 -11.187   2.830  -1.314
  522    HA   GLN  66           HA       GLN  66 -14.075   3.211  -0.802
  523   1HB   GLN  66          1HB       GLN  66 -13.553   5.101   0.422
  524   2HB   GLN  66          2HB       GLN  66 -12.098   4.168   0.648
  525   1HG   GLN  66          1HG       GLN  66 -10.750   5.587  -0.427
  526   2HG   GLN  66          2HG       GLN  66 -11.919   5.836  -1.732
  527   1HE2  GLN  66          2HE2      GLN  66 -11.647   6.725   1.815
  528   2HE2  GLN  66          1HE2      GLN  66 -12.270   8.333   1.519
  529    H    GLY  67           H        GLY  67 -14.379   2.410  -2.950
  530   1HA   GLY  67          1HA       GLY  67 -14.536   4.678  -4.791
  531   2HA   GLY  67          2HA       GLY  67 -13.512   3.340  -5.331
  532    H    GLU  68           H        GLU  68 -14.920   3.094  -7.059
  533    HA   GLU  68           HA       GLU  68 -17.670   2.513  -6.982
  534   1HB   GLU  68          1HB       GLU  68 -15.505   1.518  -8.888
  535   2HB   GLU  68          2HB       GLU  68 -17.263   1.526  -9.189
  536   1HG   GLU  68          1HG       GLU  68 -16.903   3.584 -10.056
  537   2HG   GLU  68          2HG       GLU  68 -16.816   4.092  -8.337
  538    H    ASP  69           H        ASP  69 -14.815   0.411  -6.425
  539    HA   ASP  69           HA       ASP  69 -16.764  -1.789  -5.819
  540   1HB   ASP  69          1HB       ASP  69 -13.784  -2.027  -6.311
  541   2HB   ASP  69          2HB       ASP  69 -14.928  -3.348  -6.090
  542    H    GLU  70           H        GLU  70 -16.710   0.212  -3.863
  543    HA   GLU  70           HA       GLU  70 -14.435   0.114  -2.250
  544   1HB   GLU  70          1HB       GLU  70 -15.927   1.019  -0.494
  545   2HB   GLU  70          2HB       GLU  70 -15.976   1.875  -2.031
  546   1HG   GLU  70          1HG       GLU  70 -18.165   1.827  -1.894
  547   2HG   GLU  70          2HG       GLU  70 -18.091   0.104  -2.313
  548    H    GLN  71           H        GLN  71 -17.525  -1.510  -1.329
  549    HA   GLN  71           HA       GLN  71 -16.381  -3.293   0.458
  550   1HB   GLN  71          1HB       GLN  71 -18.875  -3.214  -1.195
  551   2HB   GLN  71          2HB       GLN  71 -18.423  -4.778  -0.480
  552   1HG   GLN  71          1HG       GLN  71 -18.654  -2.184   1.081
  553   2HG   GLN  71          2HG       GLN  71 -19.874  -3.469   1.038
  554   1HE2  GLN  71          2HE2      GLN  71 -17.308  -5.400   0.839
  555   2HE2  GLN  71          1HE2      GLN  71 -16.968  -5.616   2.542
  556    H    GLU  72           H        GLU  72 -16.677  -3.665  -3.054
  557    HA   GLU  72           HA       GLU  72 -16.035  -6.432  -3.177
  558   1HB   GLU  72          1HB       GLU  72 -17.097  -5.324  -5.045
  559   2HB   GLU  72          2HB       GLU  72 -15.851  -4.059  -5.081
  560   1HG   GLU  72          1HG       GLU  72 -15.601  -5.585  -6.960
  561   2HG   GLU  72          2HG       GLU  72 -14.194  -5.638  -5.880
  562    H    ALA  73           H        ALA  73 -14.061  -3.469  -3.540
  563    HA   ALA  73           HA       ALA  73 -11.618  -4.816  -4.127
  564   1HB   ALA  73          1HB       ALA  73 -12.421  -2.061  -3.178
  565   2HB   ALA  73          2HB       ALA  73 -10.767  -2.465  -3.747
  566   3HB   ALA  73          3HB       ALA  73 -12.180  -2.579  -4.845
  567    H    LEU  74           H        LEU  74 -12.968  -3.244  -1.225
  568    HA   LEU  74           HA       LEU  74 -10.760  -3.709   0.473
  569   1HB   LEU  74          1HB       LEU  74 -12.302  -3.094   2.264
  570   2HB   LEU  74          2HB       LEU  74 -12.531  -2.086   0.812
  571    HG   LEU  74           HG       LEU  74 -14.372  -3.795   0.167
  572   1HD1  LEU  74          1HD1      LEU  74 -14.272  -4.065   3.198
  573   2HD1  LEU  74          2HD1      LEU  74 -15.576  -4.646   2.130
  574   3HD1  LEU  74          3HD1      LEU  74 -13.954  -5.372   2.016
  575   1HD2  LEU  74          1HD2      LEU  74 -14.673  -1.410   0.663
  576   2HD2  LEU  74          2HD2      LEU  74 -16.015  -2.378   1.298
  577   3HD2  LEU  74          3HD2      LEU  74 -14.752  -1.774   2.403
  578    H    GLU  75           H        GLU  75 -13.666  -5.767  -0.191
  579    HA   GLU  75           HA       GLU  75 -12.931  -7.759   1.704
  580   1HB   GLU  75          1HB       GLU  75 -14.539  -7.982  -0.863
  581   2HB   GLU  75          2HB       GLU  75 -14.393  -9.250   0.379
  582   1HG   GLU  75          1HG       GLU  75 -15.512  -6.461   0.804
  583   2HG   GLU  75          2HG       GLU  75 -16.459  -7.957   0.707
  584    H    LYS  76           H        LYS  76 -12.322  -7.704  -1.894
  585    HA   LYS  76           HA       LYS  76 -10.914 -10.163  -1.887
  586   1HB   LYS  76          1HB       LYS  76 -10.176  -7.809  -3.657
  587   2HB   LYS  76          2HB       LYS  76  -9.964  -9.545  -3.970
  588   1HG   LYS  76          1HG       LYS  76 -12.638  -9.492  -3.553
  589   2HG   LYS  76          2HG       LYS  76 -12.403  -7.840  -4.143
  590   1HD   LYS  76          1HD       LYS  76 -11.824 -10.522  -5.477
  591   2HD   LYS  76          2HD       LYS  76 -12.814  -9.189  -6.101
  592   1HE   LYS  76          1HE       LYS  76 -10.710  -7.861  -6.459
  593   2HE   LYS  76          2HE       LYS  76  -9.757  -9.216  -5.819
  594   1HZ   LYS  76          1HZ       LYS  76 -11.480  -9.280  -8.197
  595   2HZ   LYS  76          2HZ       LYS  76  -9.835  -9.193  -8.198
  596   3HZ   LYS  76          3HZ       LYS  76 -10.587 -10.544  -7.625
  597    H    LEU  77           H        LEU  77  -9.676  -6.837  -1.543
  598    HA   LEU  77           HA       LEU  77  -6.932  -7.466  -1.228
  599   1HB   LEU  77          1HB       LEU  77  -8.793  -5.236  -0.556
  600   2HB   LEU  77          2HB       LEU  77  -7.184  -5.246   0.216
  601    HG   LEU  77           HG       LEU  77  -7.482  -4.060  -2.135
  602   1HD1  LEU  77          1HD1      LEU  77  -5.442  -4.336  -0.749
  603   2HD1  LEU  77          2HD1      LEU  77  -5.265  -5.997  -1.383
  604   3HD1  LEU  77          3HD1      LEU  77  -5.099  -4.606  -2.485
  605   1HD2  LEU  77          1HD2      LEU  77  -8.310  -6.160  -3.309
  606   2HD2  LEU  77          2HD2      LEU  77  -6.747  -5.572  -3.948
  607   3HD2  LEU  77          3HD2      LEU  77  -6.786  -6.949  -2.837
  608    H    ALA  78           H        ALA  78  -9.349  -6.843   1.441
  609    HA   ALA  78           HA       ALA  78  -7.478  -7.542   3.475
  610   1HB   ALA  78          1HB       ALA  78  -9.468  -6.223   3.979
  611   2HB   ALA  78          2HB       ALA  78 -10.508  -7.615   3.571
  612   3HB   ALA  78          3HB       ALA  78  -9.407  -7.692   4.967
  613    H    ALA  79           H        ALA  79  -9.470  -9.575   1.354
  614    HA   ALA  79           HA       ALA  79  -9.077 -11.970   2.902
  615   1HB   ALA  79          1HB       ALA  79 -10.687 -11.682   0.980
  616   2HB   ALA  79          2HB       ALA  79  -9.271 -11.573  -0.111
  617   3HB   ALA  79          3HB       ALA  79  -9.600 -13.086   0.776
  618    H    TYR  80           H        TYR  80  -7.390 -10.526   0.081
  619    HA   TYR  80           HA       TYR  80  -5.508 -12.625  -0.231
  620   1HB   TYR  80          1HB       TYR  80  -6.315 -11.003  -1.902
  621   2HB   TYR  80          2HB       TYR  80  -5.346  -9.738  -1.124
  622    HD1  TYR  80           HD1      TYR  80  -3.274  -9.297  -2.055
  623    HD2  TYR  80           HD2      TYR  80  -4.837 -13.300  -2.224
  624    HE1  TYR  80           HE1      TYR  80  -1.079 -10.120  -2.904
  625    HE2  TYR  80           HE2      TYR  80  -2.672 -14.122  -3.100
  626    HH   TYR  80           HH       TYR  80  -0.534 -13.592  -3.621
  627    H    VAL  81           H        VAL  81  -5.287  -9.549   1.485
  628    HA   VAL  81           HA       VAL  81  -2.563  -9.433   2.107
  629    HB   VAL  81           HB       VAL  81  -3.371  -8.194   4.143
  630   1HG1  VAL  81          1HG1      VAL  81  -4.971  -7.718   1.607
  631   2HG1  VAL  81          2HG1      VAL  81  -4.773  -6.546   2.935
  632   3HG1  VAL  81          3HG1      VAL  81  -3.353  -7.054   1.971
  633   1HG2  VAL  81          1HG2      VAL  81  -6.063  -9.260   3.158
  634   2HG2  VAL  81          2HG2      VAL  81  -5.237  -9.761   4.640
  635   3HG2  VAL  81          3HG2      VAL  81  -5.843  -8.100   4.492
  636    H    GLN  82           H        GLN  82  -5.060 -11.545   3.551
  637    HA   GLN  82           HA       GLN  82  -3.075 -12.270   5.657
  638   1HB   GLN  82          1HB       GLN  82  -4.971 -12.136   7.199
  639   2HB   GLN  82          2HB       GLN  82  -4.888 -10.652   6.250
  640   1HG   GLN  82          1HG       GLN  82  -6.765 -11.454   4.879
  641   2HG   GLN  82          2HG       GLN  82  -6.621 -13.055   5.583
  642   1HE2  GLN  82          2HE2      GLN  82  -8.504 -10.609   5.627
  643   2HE2  GLN  82          1HE2      GLN  82  -9.065 -10.412   7.287
  644    H    GLU  83           H        GLU  83  -5.467 -13.536   3.377
  645    HA   GLU  83           HA       GLU  83  -6.274 -15.718   4.947
  646   1HB   GLU  83          1HB       GLU  83  -7.635 -16.271   3.252
  647   2HB   GLU  83          2HB       GLU  83  -7.324 -14.553   2.906
  648   1HG   GLU  83          1HG       GLU  83  -5.821 -16.866   1.581
  649   2HG   GLU  83          2HG       GLU  83  -7.328 -16.196   0.932
  650    H    GLU  84           H        GLU  84  -3.734 -15.766   2.377
  651    HA   GLU  84           HA       GLU  84  -3.149 -18.547   3.231
  652   1HB   GLU  84          1HB       GLU  84  -1.817 -18.539   1.075
  653   2HB   GLU  84          2HB       GLU  84  -3.555 -18.304   0.857
  654   1HG   GLU  84          1HG       GLU  84  -3.299 -15.947   0.486
  655   2HG   GLU  84          2HG       GLU  84  -1.598 -15.948   0.983
  656    H    VAL  85           H        VAL  85  -0.445 -17.719   1.784
  657    HA   VAL  85           HA       VAL  85   0.817 -16.038   3.823
  658    HB   VAL  85           HB       VAL  85   1.285 -18.183   4.905
  659   1HG1  VAL  85          1HG1      VAL  85   2.230 -19.396   2.213
  660   2HG1  VAL  85          2HG1      VAL  85   2.387 -20.165   3.812
  661   3HG1  VAL  85          3HG1      VAL  85   0.791 -19.888   3.138
  662   1HG2  VAL  85          1HG2      VAL  85   3.329 -16.697   4.695
  663   2HG2  VAL  85          2HG2      VAL  85   3.756 -18.410   4.771
  664   3HG2  VAL  85          3HG2      VAL  85   3.802 -17.553   3.209
  Start of MODEL   10
    1   1H    VAL   2          1H        VAL   2 -19.062   4.611   0.547
    2   2H    VAL   2          2H        VAL   2 -18.412   6.158   0.664
    3   3H    VAL   2          3H        VAL   2 -19.757   5.882  -0.308
    4    HA   VAL   2           HA       VAL   2 -18.507   4.502  -1.756
    5    HB   VAL   2           HB       VAL   2 -17.125   7.166  -1.255
    6   1HG1  VAL   2          1HG2      VAL   2 -15.944   5.636  -2.825
    7   2HG1  VAL   2          2HG2      VAL   2 -17.445   5.442  -3.756
    8   3HG1  VAL   2          3HG2      VAL   2 -16.645   7.029  -3.683
    9   1HG2  VAL   2          1HG1      VAL   2 -19.547   6.445  -2.963
   10   2HG2  VAL   2          2HG1      VAL   2 -19.589   7.400  -1.462
   11   3HG2  VAL   2          3HG1      VAL   2 -18.759   8.038  -2.902
   12    H    GLN   3           H        GLN   3 -16.671   5.647   1.105
   13    HA   GLN   3           HA       GLN   3 -14.423   3.937   0.262
   14   1HB   GLN   3          1HB       GLN   3 -14.117   6.267   1.274
   15   2HB   GLN   3          2HB       GLN   3 -14.663   5.570   2.817
   16   1HG   GLN   3          1HG       GLN   3 -12.817   3.941   2.728
   17   2HG   GLN   3          2HG       GLN   3 -12.284   4.575   1.165
   18   1HE2  GLN   3          2HE2      GLN   3 -12.379   7.364   1.485
   19   2HE2  GLN   3          1HE2      GLN   3 -11.334   7.800   2.815
   20    H    GLN   4           H        GLN   4 -14.600   1.808   0.680
   21    HA   GLN   4           HA       GLN   4 -15.923   1.036   3.262
   22   1HB   GLN   4          1HB       GLN   4 -15.861  -0.353   0.546
   23   2HB   GLN   4          2HB       GLN   4 -16.525  -1.085   2.023
   24   1HG   GLN   4          1HG       GLN   4 -17.509   1.546   0.850
   25   2HG   GLN   4          2HG       GLN   4 -18.260  -0.032   0.531
   26   1HE2  GLN   4          2HE2      GLN   4 -18.417  -1.362   2.833
   27   2HE2  GLN   4          1HE2      GLN   4 -19.250  -0.432   4.065
   28    H    LYS   5           H        LYS   5 -14.695  -0.584   4.571
   29    HA   LYS   5           HA       LYS   5 -12.379  -1.740   3.204
   30   1HB   LYS   5          1HB       LYS   5 -10.992  -0.897   5.262
   31   2HB   LYS   5          2HB       LYS   5 -11.279   0.131   3.851
   32   1HG   LYS   5          1HG       LYS   5 -11.634   1.509   5.752
   33   2HG   LYS   5          2HG       LYS   5 -13.227   1.171   5.030
   34   1HD   LYS   5          1HD       LYS   5 -13.506  -0.679   6.751
   35   2HD   LYS   5          2HD       LYS   5 -11.958  -0.145   7.463
   36   1HE   LYS   5          1HE       LYS   5 -14.425   1.613   7.154
   37   2HE   LYS   5          2HE       LYS   5 -13.881   0.846   8.659
   38   1HZ   LYS   5          1HZ       LYS   5 -11.826   2.078   8.452
   39   2HZ   LYS   5          2HZ       LYS   5 -12.374   2.827   7.095
   40   3HZ   LYS   5          3HZ       LYS   5 -13.126   3.089   8.537
   41    H    VAL   6           H        VAL   6 -11.572  -3.560   4.145
   42    HA   VAL   6           HA       VAL   6 -13.022  -4.552   6.546
   43    HB   VAL   6           HB       VAL   6 -13.016  -6.821   5.564
   44   1HG1  VAL   6          1HG2      VAL   6 -15.000  -5.362   5.324
   45   2HG1  VAL   6          2HG2      VAL   6 -14.334  -4.710   3.809
   46   3HG1  VAL   6          3HG2      VAL   6 -14.811  -6.424   3.906
   47   1HG2  VAL   6          1HG1      VAL   6 -11.108  -6.515   4.004
   48   2HG2  VAL   6          2HG1      VAL   6 -12.557  -7.128   3.168
   49   3HG2  VAL   6          3HG1      VAL   6 -12.098  -5.414   3.023
   50    H    GLU   7           H        GLU   7 -11.627  -5.295   8.133
   51    HA   GLU   7           HA       GLU   7  -8.802  -4.924   7.469
   52   1HB   GLU   7          1HB       GLU   7  -9.726  -3.814   9.440
   53   2HB   GLU   7          2HB       GLU   7 -10.140  -5.380  10.182
   54   1HG   GLU   7          1HG       GLU   7  -7.832  -5.926  10.477
   55   2HG   GLU   7          2HG       GLU   7  -7.317  -4.700   9.302
   56    H    VAL   8           H        VAL   8  -7.177  -6.289   8.109
   57    HA   VAL   8           HA       VAL   8  -7.708  -9.172   8.432
   58    HB   VAL   8           HB       VAL   8  -7.708  -9.412   6.163
   59   1HG1  VAL   8          1HG2      VAL   8  -8.084  -6.984   5.797
   60   2HG1  VAL   8          2HG2      VAL   8  -6.319  -6.724   5.850
   61   3HG1  VAL   8          3HG2      VAL   8  -7.030  -7.714   4.548
   62   1HG2  VAL   8          1HG1      VAL   8  -5.379 -10.117   6.747
   63   2HG2  VAL   8          2HG1      VAL   8  -5.567  -9.544   5.071
   64   3HG2  VAL   8          3HG1      VAL   8  -4.819  -8.490   6.299
   65    H    ARG   9           H        ARG   9  -5.481 -10.307   8.723
   66    HA   ARG   9           HA       ARG   9  -3.621  -8.176   9.663
   67   1HB   ARG   9          1HB       ARG   9  -4.344  -9.787  11.457
   68   2HB   ARG   9          2HB       ARG   9  -3.437 -11.062  10.586
   69   1HG   ARG   9          1HG       ARG   9  -1.362  -9.843  10.891
   70   2HG   ARG   9          2HG       ARG   9  -2.250  -8.362  11.307
   71   1HD   ARG   9          1HD       ARG   9  -2.172 -10.869  13.037
   72   2HD   ARG   9          2HD       ARG   9  -1.239  -9.373  13.270
   73    HE   ARG   9           HE       ARG   9  -3.096  -8.260  14.026
   74   1HH1  ARG   9          1HH2      ARG   9  -4.027 -11.436  12.819
   75   2HH1  ARG   9          2HH2      ARG   9  -5.575 -11.458  13.620
   76   1HH2  ARG   9          2HH1      ARG   9  -5.104  -8.260  15.100
   77   2HH2  ARG   9          1HH1      ARG   9  -6.222  -9.587  14.908
   78    H    LEU  10           H        LEU  10  -1.675  -8.030   8.710
   79    HA   LEU  10           HA       LEU  10  -1.421  -9.203   6.138
   80   1HB   LEU  10          1HB       LEU  10   0.337  -7.518   7.881
   81   2HB   LEU  10          2HB       LEU  10   1.079  -8.404   6.527
   82    HG   LEU  10           HG       LEU  10   0.381  -6.233   5.721
   83   1HD1  LEU  10          1HD1      LEU  10  -1.485  -8.470   4.798
   84   2HD1  LEU  10          2HD1      LEU  10  -1.169  -6.961   3.910
   85   3HD1  LEU  10          3HD1      LEU  10   0.142  -8.127   4.163
   86   1HD2  LEU  10          1HD2      LEU  10  -1.377  -5.822   7.408
   87   2HD2  LEU  10          2HD2      LEU  10  -2.005  -5.591   5.755
   88   3HD2  LEU  10          3HD2      LEU  10  -2.389  -7.080   6.658
   89    H    LYS  11           H        LYS  11  -1.499 -11.444   6.141
   90    HA   LYS  11           HA       LYS  11   0.587 -12.953   7.538
   91   1HB   LYS  11          1HB       LYS  11  -1.244 -14.297   7.018
   92   2HB   LYS  11          2HB       LYS  11  -1.498 -13.590   5.416
   93   1HG   LYS  11          1HG       LYS  11   1.000 -15.177   5.879
   94   2HG   LYS  11          2HG       LYS  11  -0.588 -15.940   5.552
   95   1HD   LYS  11          1HD       LYS  11   0.971 -14.056   3.753
   96   2HD   LYS  11          2HD       LYS  11   0.255 -15.639   3.399
   97   1HE   LYS  11          1HE       LYS  11  -2.026 -14.575   3.877
   98   2HE   LYS  11          2HE       LYS  11  -1.177 -13.011   3.905
   99   1HZ   LYS  11          1HZ       LYS  11  -0.406 -13.503   1.666
  100   2HZ   LYS  11          2HZ       LYS  11  -1.359 -14.837   1.621
  101   3HZ   LYS  11          3HZ       LYS  11  -2.047 -13.355   1.765
  102    H    THR  12           H        THR  12   0.036 -11.524   4.321
  103    HA   THR  12           HA       THR  12   2.663 -12.101   3.269
  104    HB   THR  12           HB       THR  12   2.216 -10.087   1.846
  105    HG1  THR  12           HG1      THR  12  -0.401 -10.268   3.000
  106   1HG2  THR  12          1HG2      THR  12   0.043 -12.205   1.915
  107   2HG2  THR  12          2HG2      THR  12   0.542 -11.232   0.501
  108   3HG2  THR  12          3HG2      THR  12   1.669 -12.413   1.220
  109    H    GLY  13           H        GLY  13   1.181  -9.137   4.412
  110   1HA   GLY  13          1HA       GLY  13   2.065  -7.196   5.473
  111   2HA   GLY  13          2HA       GLY  13   3.574  -8.070   5.833
  112    H    LEU  14           H        LEU  14   1.768  -8.033   2.860
  113    HA   LEU  14           HA       LEU  14   2.370  -7.631   0.683
  114   1HB   LEU  14          1HB       LEU  14   2.075  -5.084   2.239
  115   2HB   LEU  14          2HB       LEU  14   2.493  -5.063   0.509
  116    HG   LEU  14           HG       LEU  14   0.666  -6.922   0.302
  117   1HD1  LEU  14          1HD1      LEU  14  -0.305  -5.408   2.744
  118   2HD1  LEU  14          2HD1      LEU  14  -1.269  -6.550   1.776
  119   3HD1  LEU  14          3HD1      LEU  14   0.158  -7.122   2.673
  120   1HD2  LEU  14          1HD2      LEU  14   0.624  -4.773  -0.865
  121   2HD2  LEU  14          2HD2      LEU  14  -1.000  -5.199  -0.274
  122   3HD2  LEU  14          3HD2      LEU  14  -0.031  -3.978   0.582
  123    H    GLN  15           H        GLN  15   4.518  -8.797   1.291
  124    HA   GLN  15           HA       GLN  15   6.840  -7.044   1.095
  125   1HB   GLN  15          1HB       GLN  15   6.710 -10.077   1.194
  126   2HB   GLN  15          2HB       GLN  15   8.157  -9.058   1.401
  127   1HG   GLN  15          1HG       GLN  15   6.829  -7.857   3.260
  128   2HG   GLN  15          2HG       GLN  15   5.702  -9.225   3.178
  129   1HE2  GLN  15          2HE2      GLN  15   6.690  -9.075   5.608
  130   2HE2  GLN  15          1HE2      GLN  15   8.062 -10.151   5.842
  131    H    ALA  16           H        ALA  16   5.578  -6.426  -1.007
  132    HA   ALA  16           HA       ALA  16   5.973  -5.917  -3.191
  133   1HB   ALA  16          1HB       ALA  16   8.344  -6.013  -2.622
  134   2HB   ALA  16          2HB       ALA  16   8.356  -7.766  -2.928
  135   3HB   ALA  16          3HB       ALA  16   8.058  -6.631  -4.267
  136    H    ARG  17           H        ARG  17   6.564  -9.468  -2.813
  137    HA   ARG  17           HA       ARG  17   5.649  -9.932  -5.504
  138   1HB   ARG  17          1HB       ARG  17   5.797 -11.981  -3.282
  139   2HB   ARG  17          2HB       ARG  17   5.827 -12.287  -5.031
  140   1HG   ARG  17          1HG       ARG  17   7.995 -11.089  -5.195
  141   2HG   ARG  17          2HG       ARG  17   7.878 -10.665  -3.477
  142   1HD   ARG  17          1HD       ARG  17   8.385 -13.364  -4.722
  143   2HD   ARG  17          2HD       ARG  17   9.308 -12.544  -3.452
  144    HE   ARG  17           HE       ARG  17   7.287 -14.436  -3.061
  145   1HH1  ARG  17          2HH1      ARG  17   8.015 -11.147  -1.756
  146   2HH1  ARG  17          1HH1      ARG  17   6.856 -11.386  -0.455
  147   1HH2  ARG  17          1HH2      ARG  17   5.858 -14.579  -1.199
  148   2HH2  ARG  17          2HH2      ARG  17   5.745 -13.128  -0.176
  149    HA   PRO  18           HA       PRO  18   1.472 -11.575  -3.724
  150   1HB   PRO  18          1HB       PRO  18   0.891 -11.001  -1.107
  151   2HB   PRO  18          2HB       PRO  18   1.720 -12.509  -1.610
  152   1HG   PRO  18          1HG       PRO  18   3.027  -9.936  -0.620
  153   2HG   PRO  18          2HG       PRO  18   3.303 -11.595  -0.032
  154   1HD   PRO  18          1HD       PRO  18   4.949 -10.476  -1.865
  155   2HD   PRO  18          2HD       PRO  18   4.446 -12.177  -2.067
  156    H    ALA  19           H        ALA  19   2.788  -8.807  -1.929
  157    HA   ALA  19           HA       ALA  19   0.486  -7.194  -2.037
  158   1HB   ALA  19          1HB       ALA  19   2.319  -6.914  -0.508
  159   2HB   ALA  19          2HB       ALA  19   3.404  -6.436  -1.847
  160   3HB   ALA  19          3HB       ALA  19   1.987  -5.420  -1.423
  161    H    ALA  20           H        ALA  20   3.009  -7.683  -4.556
  162    HA   ALA  20           HA       ALA  20   2.345  -5.383  -6.105
  163   1HB   ALA  20          1HB       ALA  20   3.118  -8.203  -6.983
  164   2HB   ALA  20          2HB       ALA  20   3.190  -6.743  -7.999
  165   3HB   ALA  20          3HB       ALA  20   4.261  -6.902  -6.581
  166    H    LEU  21           H        LEU  21   1.001  -8.661  -5.808
  167    HA   LEU  21           HA       LEU  21  -1.107  -8.458  -7.714
  168   1HB   LEU  21          1HB       LEU  21  -0.042 -10.430  -6.332
  169   2HB   LEU  21          2HB       LEU  21  -1.265 -10.016  -5.135
  170    HG   LEU  21           HG       LEU  21  -2.052 -11.805  -6.680
  171   1HD1  LEU  21          1HD2      LEU  21  -3.467  -9.130  -7.009
  172   2HD1  LEU  21          2HD2      LEU  21  -4.205 -10.732  -7.274
  173   3HD1  LEU  21          3HD2      LEU  21  -3.662 -10.252  -5.645
  174   1HD2  LEU  21          1HD1      LEU  21  -0.776 -11.083  -8.678
  175   2HD2  LEU  21          2HD1      LEU  21  -2.511 -11.250  -9.039
  176   3HD2  LEU  21          3HD1      LEU  21  -1.802  -9.635  -8.807
  177    H    PHE  22           H        PHE  22  -0.897  -7.887  -4.156
  178    HA   PHE  22           HA       PHE  22  -3.646  -7.250  -3.759
  179   1HB   PHE  22          1HB       PHE  22  -1.252  -6.073  -2.328
  180   2HB   PHE  22          2HB       PHE  22  -2.918  -6.127  -1.733
  181    HD1  PHE  22           HD1      PHE  22  -3.022  -9.127  -3.141
  182    HD2  PHE  22           HD2      PHE  22  -0.659  -7.134  -0.177
  183    HE1  PHE  22           HE1      PHE  22  -2.553 -11.323  -2.052
  184    HE2  PHE  22           HE2      PHE  22  -0.190  -9.328   0.952
  185    HZ   PHE  22           HZ       PHE  22  -1.170 -11.420   0.005
  186    H    VAL  23           H        VAL  23  -0.927  -4.976  -4.132
  187    HA   VAL  23           HA       VAL  23  -2.379  -2.582  -4.341
  188    HB   VAL  23           HB       VAL  23   0.321  -3.555  -5.301
  189   1HG1  VAL  23          1HG2      VAL  23  -0.773  -0.727  -5.574
  190   2HG1  VAL  23          2HG2      VAL  23   0.912  -1.228  -5.845
  191   3HG1  VAL  23          3HG2      VAL  23  -0.375  -1.830  -6.914
  192   1HG2  VAL  23          1HG1      VAL  23  -0.605  -1.526  -3.213
  193   2HG2  VAL  23          2HG1      VAL  23  -0.029  -3.179  -2.882
  194   3HG2  VAL  23          3HG1      VAL  23   1.085  -1.966  -3.552
  195    H    GLN  24           H        GLN  24  -1.409  -4.939  -6.931
  196    HA   GLN  24           HA       GLN  24  -2.372  -3.203  -9.007
  197   1HB   GLN  24          1HB       GLN  24  -2.219  -5.144 -10.479
  198   2HB   GLN  24          2HB       GLN  24  -0.741  -4.955  -9.506
  199   1HG   GLN  24          1HG       GLN  24  -1.398  -6.705  -8.020
  200   2HG   GLN  24          2HG       GLN  24  -3.030  -6.787  -8.707
  201   1HE2  GLN  24          2HE2      GLN  24  -3.430  -8.007 -10.510
  202   2HE2  GLN  24          1HE2      GLN  24  -2.180  -8.947 -11.327
  203    H    GLU  25           H        GLU  25  -3.975  -5.793  -7.107
  204    HA   GLU  25           HA       GLU  25  -6.298  -5.700  -8.822
  205   1HB   GLU  25          1HB       GLU  25  -6.012  -6.746  -5.956
  206   2HB   GLU  25          2HB       GLU  25  -7.345  -7.124  -7.078
  207   1HG   GLU  25          1HG       GLU  25  -4.407  -7.774  -7.531
  208   2HG   GLU  25          2HG       GLU  25  -5.626  -8.931  -6.958
  209    H    ALA  26           H        ALA  26  -5.521  -4.527  -5.567
  210    HA   ALA  26           HA       ALA  26  -7.739  -2.983  -4.889
  211   1HB   ALA  26          1HB       ALA  26  -5.669  -3.250  -3.537
  212   2HB   ALA  26          2HB       ALA  26  -4.802  -2.247  -4.729
  213   3HB   ALA  26          3HB       ALA  26  -6.102  -1.529  -3.744
  214    H    ASN  27           H        ASN  27  -4.981  -2.170  -6.949
  215    HA   ASN  27           HA       ASN  27  -5.713   0.385  -7.863
  216   1HB   ASN  27          1HB       ASN  27  -3.840  -1.807  -8.397
  217   2HB   ASN  27          2HB       ASN  27  -4.326  -1.025  -9.899
  218   1HD2  ASN  27          2HD2      ASN  27  -2.171  -0.936  -7.401
  219   2HD2  ASN  27          1HD2      ASN  27  -1.612   0.731  -7.413
  220    H    ARG  28           H        ARG  28  -6.569  -2.856  -9.061
  221    HA   ARG  28           HA       ARG  28  -7.406  -1.922 -11.738
  222   1HB   ARG  28          1HB       ARG  28  -7.957  -4.456 -10.140
  223   2HB   ARG  28          2HB       ARG  28  -8.512  -4.191 -11.810
  224   1HG   ARG  28          1HG       ARG  28  -6.200  -3.910 -12.585
  225   2HG   ARG  28          2HG       ARG  28  -5.609  -4.017 -10.913
  226   1HD   ARG  28          1HD       ARG  28  -5.279  -6.151 -12.072
  227   2HD   ARG  28          2HD       ARG  28  -6.440  -6.333 -10.745
  228    HE   ARG  28           HE       ARG  28  -7.821  -5.745 -13.181
  229   1HH1  ARG  28          2HH1      ARG  28  -6.045  -8.297 -11.520
  230   2HH1  ARG  28          1HH1      ARG  28  -6.789  -9.606 -12.401
  231   1HH2  ARG  28          1HH2      ARG  28  -8.857  -7.447 -14.324
  232   2HH2  ARG  28          2HH2      ARG  28  -8.439  -9.110 -14.016
  233    H    PHE  29           H        PHE  29  -8.800  -2.839  -8.686
  234    HA   PHE  29           HA       PHE  29 -11.510  -2.190  -8.866
  235   1HB   PHE  29          1HB       PHE  29  -9.290  -1.880  -6.822
  236   2HB   PHE  29          2HB       PHE  29 -10.945  -1.509  -6.421
  237    HD1  PHE  29           HD1      PHE  29 -12.222  -3.721  -8.179
  238    HD2  PHE  29           HD2      PHE  29  -8.885  -3.824  -5.469
  239    HE1  PHE  29           HE1      PHE  29 -12.713  -6.099  -7.670
  240    HE2  PHE  29           HE2      PHE  29  -9.378  -6.204  -4.950
  241    HZ   PHE  29           HZ       PHE  29 -11.373  -7.302  -5.965
  242    H    THR  30           H        THR  30 -12.384  -0.385  -9.582
  243    HA   THR  30           HA       THR  30 -10.794   2.037  -9.976
  244    HB   THR  30           HB       THR  30 -13.686   1.291 -10.514
  245    HG1  THR  30           HG1      THR  30 -11.656   0.353 -11.627
  246   1HG2  THR  30          1HG2      THR  30 -12.107   3.687 -11.507
  247   2HG2  THR  30          2HG2      THR  30 -13.764   3.226 -12.002
  248   3HG2  THR  30          3HG2      THR  30 -13.437   3.716 -10.317
  249    H    SER  31           H        SER  31 -10.595   1.767  -7.425
  250    HA   SER  31           HA       SER  31 -12.449   3.630  -6.082
  251   1HB   SER  31          1HB       SER  31 -11.157   1.108  -4.974
  252   2HB   SER  31          2HB       SER  31 -12.443   2.073  -4.215
  253    HG   SER  31           HG       SER  31 -13.061   0.038  -5.320
  254    H    ASP  32           H        ASP  32 -11.544   4.895  -4.502
  255    HA   ASP  32           HA       ASP  32  -8.621   5.165  -4.423
  256   1HB   ASP  32          1HB       ASP  32 -10.128   7.101  -4.229
  257   2HB   ASP  32          2HB       ASP  32 -10.892   6.347  -2.808
  258    H    VAL  33           H        VAL  33  -8.129   3.092  -3.886
  259    HA   VAL  33           HA       VAL  33  -9.289   1.756  -1.596
  260    HB   VAL  33           HB       VAL  33  -7.858  -0.097  -2.181
  261   1HG1  VAL  33          1HG2      VAL  33  -8.864   1.434  -4.618
  262   2HG1  VAL  33          2HG2      VAL  33  -8.505  -0.308  -4.597
  263   3HG1  VAL  33          3HG2      VAL  33  -9.831   0.349  -3.596
  264   1HG2  VAL  33          1HG1      VAL  33  -5.790   1.209  -2.539
  265   2HG2  VAL  33          2HG1      VAL  33  -6.115   0.127  -3.920
  266   3HG2  VAL  33          3HG1      VAL  33  -6.466   1.868  -4.048
  267    H    PHE  34           H        PHE  34  -8.061   0.842   0.171
  268    HA   PHE  34           HA       PHE  34  -5.745   2.472   0.984
  269   1HB   PHE  34          1HB       PHE  34  -8.313   2.402   2.603
  270   2HB   PHE  34          2HB       PHE  34  -6.762   3.025   3.162
  271    HD1  PHE  34           HD1      PHE  34  -5.708   4.980   1.941
  272    HD2  PHE  34           HD2      PHE  34  -9.784   3.782   1.299
  273    HE1  PHE  34           HE1      PHE  34  -6.225   7.243   1.029
  274    HE2  PHE  34           HE2      PHE  34 -10.294   6.025   0.363
  275    HZ   PHE  34           HZ       PHE  34  -8.532   7.758   0.249
  276    H    LEU  35           H        LEU  35  -5.012   1.844   3.184
  277    HA   LEU  35           HA       LEU  35  -5.839  -0.787   4.160
  278   1HB   LEU  35          1HB       LEU  35  -4.052  -1.237   2.472
  279   2HB   LEU  35          2HB       LEU  35  -2.920  -0.247   3.434
  280    HG   LEU  35           HG       LEU  35  -4.511  -2.473   4.736
  281   1HD1  LEU  35          1HD2      LEU  35  -1.909  -2.782   3.191
  282   2HD1  LEU  35          2HD2      LEU  35  -2.676  -4.035   4.202
  283   3HD1  LEU  35          3HD2      LEU  35  -3.489  -3.458   2.727
  284   1HD2  LEU  35          1HD1      LEU  35  -1.742  -1.264   5.150
  285   2HD2  LEU  35          2HD1      LEU  35  -3.193  -0.866   6.101
  286   3HD2  LEU  35          3HD1      LEU  35  -2.492  -2.499   6.189
  287    H    GLU  36           H        GLU  36  -6.059  -0.514   6.255
  288    HA   GLU  36           HA       GLU  36  -4.796   1.887   7.499
  289   1HB   GLU  36          1HB       GLU  36  -7.285   0.544   8.515
  290   2HB   GLU  36          2HB       GLU  36  -6.835   2.260   8.605
  291   1HG   GLU  36          1HG       GLU  36  -7.280   2.517   6.218
  292   2HG   GLU  36          2HG       GLU  36  -7.595   0.798   6.041
  293    H    LYS  37           H        LYS  37  -3.084   1.076   8.747
  294    HA   LYS  37           HA       LYS  37  -3.143  -1.523  10.085
  295   1HB   LYS  37          1HB       LYS  37  -1.356   0.925  10.232
  296   2HB   LYS  37          2HB       LYS  37  -1.200  -0.422  11.376
  297   1HG   LYS  37          1HG       LYS  37  -0.876  -2.034   9.594
  298   2HG   LYS  37          2HG       LYS  37  -1.059  -0.735   8.414
  299   1HD   LYS  37          1HD       LYS  37   1.307  -1.121   8.673
  300   2HD   LYS  37          2HD       LYS  37   0.967   0.397   9.521
  301   1HE   LYS  37          1HE       LYS  37   1.155  -2.368  10.834
  302   2HE   LYS  37          2HE       LYS  37   2.489  -1.215  10.700
  303   1HZ   LYS  37          1HZ       LYS  37   1.185   0.348  11.977
  304   2HZ   LYS  37          2HZ       LYS  37  -0.031  -0.755  12.143
  305   3HZ   LYS  37          3HZ       LYS  37   1.442  -1.051  12.812
  306    H    ASP  38           H        ASP  38  -4.823  -1.825  11.440
  307    HA   ASP  38           HA       ASP  38  -6.351  -1.449  13.087
  308   1HB   ASP  38          1HB       ASP  38  -4.058   0.131  14.286
  309   2HB   ASP  38          2HB       ASP  38  -5.492  -0.428  15.166
  310    H    GLY  39           H        GLY  39  -6.255   0.456  10.796
  311   1HA   GLY  39          1HA       GLY  39  -8.008   2.260  10.722
  312   2HA   GLY  39          2HA       GLY  39  -7.325   2.814  12.270
  313    H    LYS  40           H        LYS  40  -4.475   2.253  11.156
  314    HA   LYS  40           HA       LYS  40  -4.022   4.938  10.194
  315   1HB   LYS  40          1HB       LYS  40  -2.244   2.469  10.253
  316   2HB   LYS  40          2HB       LYS  40  -1.690   4.148  10.038
  317   1HG   LYS  40          1HG       LYS  40  -2.641   4.685  12.310
  318   2HG   LYS  40          2HG       LYS  40  -3.061   2.959  12.486
  319   1HD   LYS  40          1HD       LYS  40  -0.884   3.490  13.575
  320   2HD   LYS  40          2HD       LYS  40  -0.715   2.319  12.246
  321   1HE   LYS  40          1HE       LYS  40  -0.042   4.141  10.715
  322   2HE   LYS  40          2HE       LYS  40  -0.225   5.323  12.028
  323   1HZ   LYS  40          1HZ       LYS  40   1.669   3.075  11.999
  324   2HZ   LYS  40          2HZ       LYS  40   2.047   4.658  11.740
  325   3HZ   LYS  40          3HZ       LYS  40   1.500   4.174  13.217
  326    H    LYS  41           H        LYS  41  -5.470   4.891   8.309
  327    HA   LYS  41           HA       LYS  41  -4.670   3.041   6.224
  328   1HB   LYS  41          1HB       LYS  41  -6.743   3.106   5.681
  329   2HB   LYS  41          2HB       LYS  41  -7.063   4.272   6.965
  330   1HG   LYS  41          1HG       LYS  41  -6.349   4.901   4.058
  331   2HG   LYS  41          2HG       LYS  41  -7.987   4.899   4.723
  332   1HD   LYS  41          1HD       LYS  41  -7.344   6.699   6.323
  333   2HD   LYS  41          2HD       LYS  41  -5.720   6.733   5.586
  334   1HE   LYS  41          1HE       LYS  41  -7.100   8.460   4.528
  335   2HE   LYS  41          2HE       LYS  41  -6.789   7.152   3.361
  336   1HZ   LYS  41          1HZ       LYS  41  -9.254   7.447   4.926
  337   2HZ   LYS  41          2HZ       LYS  41  -9.060   7.850   3.338
  338   3HZ   LYS  41          3HZ       LYS  41  -8.949   6.281   3.805
  339    H    VAL  42           H        VAL  42  -4.046   3.288   4.306
  340    HA   VAL  42           HA       VAL  42  -3.257   5.921   3.160
  341    HB   VAL  42           HB       VAL  42  -1.120   4.797   2.381
  342   1HG1  VAL  42          1HG1      VAL  42  -1.490   4.953   5.400
  343   2HG1  VAL  42          2HG1      VAL  42   0.073   4.964   4.546
  344   3HG1  VAL  42          3HG1      VAL  42  -1.071   6.311   4.329
  345   1HG2  VAL  42          1HG2      VAL  42  -2.024   2.495   2.657
  346   2HG2  VAL  42          2HG2      VAL  42  -0.461   2.696   3.491
  347   3HG2  VAL  42          3HG2      VAL  42  -1.981   2.702   4.422
  348    H    ASN  43           H        ASN  43  -2.906   5.731   0.756
  349    HA   ASN  43           HA       ASN  43  -5.028   4.160  -0.348
  350   1HB   ASN  43          1HB       ASN  43  -4.309   6.303  -1.337
  351   2HB   ASN  43          2HB       ASN  43  -2.727   5.581  -1.726
  352   1HD2  ASN  43          2HD2      ASN  43  -6.097   5.861  -2.690
  353   2HD2  ASN  43          1HD2      ASN  43  -5.919   4.896  -4.143
  354    H    ALA  44           H        ALA  44  -4.977   2.229  -0.252
  355    HA   ALA  44           HA       ALA  44  -3.055   0.317   0.144
  356   1HB   ALA  44          1HB       ALA  44  -5.499  -0.086   0.255
  357   2HB   ALA  44          2HB       ALA  44  -5.594   0.038  -1.515
  358   3HB   ALA  44          3HB       ALA  44  -4.705  -1.306  -0.769
  359    H    LYS  45           H        LYS  45  -4.041   1.610  -3.003
  360    HA   LYS  45           HA       LYS  45  -2.465  -0.464  -4.395
  361   1HB   LYS  45          1HB       LYS  45  -3.390   0.608  -6.429
  362   2HB   LYS  45          2HB       LYS  45  -4.657   0.052  -5.314
  363   1HG   LYS  45          1HG       LYS  45  -4.999   2.309  -4.487
  364   2HG   LYS  45          2HG       LYS  45  -3.550   2.872  -5.306
  365   1HD   LYS  45          1HD       LYS  45  -5.350   3.606  -6.655
  366   2HD   LYS  45          2HD       LYS  45  -4.635   2.234  -7.527
  367   1HE   LYS  45          1HE       LYS  45  -6.426   0.747  -6.503
  368   2HE   LYS  45          2HE       LYS  45  -7.158   2.191  -5.780
  369   1HZ   LYS  45          1HZ       LYS  45  -6.807   1.722  -8.659
  370   2HZ   LYS  45          2HZ       LYS  45  -8.202   1.593  -7.806
  371   3HZ   LYS  45          3HZ       LYS  45  -7.479   3.065  -7.965
  372    H    SER  46           H        SER  46  -1.855   2.519  -2.948
  373    HA   SER  46           HA       SER  46   0.307   3.190  -4.848
  374   1HB   SER  46          1HB       SER  46  -0.924   4.706  -2.517
  375   2HB   SER  46          2HB       SER  46   0.383   5.321  -3.554
  376    HG   SER  46           HG       SER  46  -2.220   4.552  -4.400
  377    H    ILE  47           H        ILE  47   2.261   3.955  -3.902
  378    HA   ILE  47           HA       ILE  47   3.973   2.408  -2.673
  379    HB   ILE  47           HB       ILE  47   4.555   4.565  -3.529
  380   1HG1  ILE  47          1HG1      ILE  47   6.012   3.524  -1.683
  381   2HG1  ILE  47          2HG1      ILE  47   6.249   5.241  -2.065
  382   1HG2  ILE  47          1HG2      ILE  47   2.553   5.815  -2.724
  383   2HG2  ILE  47          2HG2      ILE  47   3.233   5.799  -1.084
  384   3HG2  ILE  47          3HG2      ILE  47   4.075   6.678  -2.374
  385   1HD1  ILE  47          1HD1      ILE  47   4.843   5.895  -0.138
  386   2HD1  ILE  47          2HD1      ILE  47   4.624   4.189   0.285
  387   3HD1  ILE  47          3HD1      ILE  47   6.238   4.923   0.379
  388    H    MET  48           H        MET  48   2.211   4.764  -0.590
  389    HA   MET  48           HA       MET  48   3.303   3.573   1.792
  390   1HB   MET  48          1HB       MET  48   1.116   5.627   1.302
  391   2HB   MET  48          2HB       MET  48   1.817   5.222   2.902
  392   1HG   MET  48          1HG       MET  48   4.051   5.756   2.050
  393   2HG   MET  48          2HG       MET  48   3.351   6.174   0.478
  394   1HE   MET  48          1HE       MET  48   3.445   7.008   4.288
  395   2HE   MET  48          2HE       MET  48   2.438   8.477   4.372
  396   3HE   MET  48          3HE       MET  48   1.706   6.918   3.910
  397    H    GLY  49           H        GLY  49   0.481   2.935  -0.141
  398   1HA   GLY  49          1HA       GLY  49  -1.117   1.796   1.997
  399   2HA   GLY  49          2HA       GLY  49  -1.394   1.614   0.230
  400    H    LEU  50           H        LEU  50   0.912   0.469  -0.730
  401    HA   LEU  50           HA       LEU  50   0.886  -2.174   0.359
  402   1HB   LEU  50          1HB       LEU  50   1.563  -1.074  -2.049
  403   2HB   LEU  50          2HB       LEU  50   3.169  -1.144  -1.243
  404    HG   LEU  50           HG       LEU  50   1.288  -3.496  -1.674
  405   1HD1  LEU  50          1HD1      LEU  50   2.393  -2.613  -3.700
  406   2HD1  LEU  50          2HD1      LEU  50   3.969  -2.703  -2.881
  407   3HD1  LEU  50          3HD1      LEU  50   3.065  -4.200  -3.245
  408   1HD2  LEU  50          1HD2      LEU  50   4.091  -3.323  -0.433
  409   2HD2  LEU  50          2HD2      LEU  50   2.584  -3.730   0.415
  410   3HD2  LEU  50          3HD2      LEU  50   3.225  -4.820  -0.811
  411    H    MET  51           H        MET  51   3.611   0.096  -0.113
  412    HA   MET  51           HA       MET  51   5.405  -1.500   1.257
  413   1HB   MET  51          1HB       MET  51   5.971   0.175  -0.479
  414   2HB   MET  51          2HB       MET  51   5.535   1.470   0.656
  415   1HG   MET  51          1HG       MET  51   7.275   0.479   2.242
  416   2HG   MET  51          2HG       MET  51   7.824  -0.510   0.880
  417   1HE   MET  51          1HE       MET  51   6.401   3.102   0.914
  418   2HE   MET  51          2HE       MET  51   7.406   3.061   2.385
  419   3HE   MET  51          3HE       MET  51   7.877   4.099   1.016
  420    H    SER  52           H        SER  52   3.495   1.314   2.419
  421    HA   SER  52           HA       SER  52   5.024   1.341   4.916
  422   1HB   SER  52          1HB       SER  52   2.511   2.869   4.145
  423   2HB   SER  52          2HB       SER  52   3.619   3.250   5.488
  424    HG   SER  52           HG       SER  52   5.269   3.469   3.800
  425    H    LEU  53           H        LEU  53   1.521   1.133   4.249
  426    HA   LEU  53           HA       LEU  53   0.969   0.099   6.889
  427   1HB   LEU  53          1HB       LEU  53  -0.614   0.667   4.415
  428   2HB   LEU  53          2HB       LEU  53  -1.262  -0.294   5.757
  429    HG   LEU  53           HG       LEU  53  -1.795   2.067   6.154
  430   1HD1  LEU  53          1HD1      LEU  53  -1.159   0.754   8.144
  431   2HD1  LEU  53          2HD1      LEU  53   0.540   1.236   7.912
  432   3HD1  LEU  53          3HD1      LEU  53  -0.692   2.461   8.310
  433   1HD2  LEU  53          1HD2      LEU  53   0.027   2.971   4.706
  434   2HD2  LEU  53          2HD2      LEU  53  -0.045   3.786   6.293
  435   3HD2  LEU  53          3HD2      LEU  53   1.206   2.555   5.974
  436    H    ALA  54           H        ALA  54   0.247  -1.270   3.682
  437    HA   ALA  54           HA       ALA  54  -0.537  -3.827   4.447
  438   1HB   ALA  54          1HB       ALA  54  -0.855  -2.735   2.233
  439   2HB   ALA  54          2HB       ALA  54   0.890  -2.874   1.933
  440   3HB   ALA  54          3HB       ALA  54  -0.104  -4.341   2.063
  441    H    VAL  55           H        VAL  55   2.689  -2.572   3.805
  442    HA   VAL  55           HA       VAL  55   3.956  -5.163   3.826
  443    HB   VAL  55           HB       VAL  55   5.116  -2.359   3.998
  444   1HG1  VAL  55          1HG2      VAL  55   6.524  -5.023   3.529
  445   2HG1  VAL  55          2HG2      VAL  55   7.277  -3.410   3.425
  446   3HG1  VAL  55          3HG2      VAL  55   6.685  -4.024   4.992
  447   1HG2  VAL  55          1HG1      VAL  55   3.972  -2.981   1.887
  448   2HG2  VAL  55          2HG1      VAL  55   5.734  -2.838   1.656
  449   3HG2  VAL  55          3HG1      VAL  55   4.978  -4.444   1.780
  450    H    SER  56           H        SER  56   2.614  -3.435   6.371
  451    HA   SER  56           HA       SER  56   4.580  -4.245   8.350
  452   1HB   SER  56          1HB       SER  56   1.733  -3.179   8.459
  453   2HB   SER  56          2HB       SER  56   2.746  -3.439   9.893
  454    HG   SER  56           HG       SER  56   3.361  -1.697   7.680
  455    H    THR  57           H        THR  57   4.423  -6.550   7.174
  456    HA   THR  57           HA       THR  57   2.545  -8.452   7.493
  457    HB   THR  57           HB       THR  57   5.367  -8.794   8.551
  458    HG1  THR  57           HG1      THR  57   4.724  -9.206   5.854
  459   1HG2  THR  57          1HG2      THR  57   5.139 -11.057   7.565
  460   2HG2  THR  57          2HG2      THR  57   3.859 -10.748   8.761
  461   3HG2  THR  57          3HG2      THR  57   3.493 -10.662   7.023
  462    H    GLY  58           H        GLY  58   1.270  -9.195   9.092
  463   1HA   GLY  58          1HA       GLY  58   0.805 -10.010  11.247
  464   2HA   GLY  58          2HA       GLY  58   2.257  -9.211  11.867
  465    H    THR  59           H        THR  59   0.717  -6.805  10.049
  466    HA   THR  59           HA       THR  59  -0.545  -5.827  12.535
  467    HB   THR  59           HB       THR  59  -0.343  -4.375   9.864
  468    HG1  THR  59           HG1      THR  59   1.723  -4.999  10.668
  469   1HG2  THR  59          1HG2      THR  59  -0.550  -2.382  11.312
  470   2HG2  THR  59          2HG2      THR  59  -1.931  -3.481  11.544
  471   3HG2  THR  59          3HG2      THR  59  -0.624  -3.430  12.747
  472    H    GLU  60           H        GLU  60  -2.790  -5.583  12.720
  473    HA   GLU  60           HA       GLU  60  -4.347  -6.792  10.523
  474   1HB   GLU  60          1HB       GLU  60  -6.224  -6.621  12.055
  475   2HB   GLU  60          2HB       GLU  60  -4.898  -7.514  12.816
  476   1HG   GLU  60          1HG       GLU  60  -5.068  -4.532  13.269
  477   2HG   GLU  60          2HG       GLU  60  -6.152  -5.609  14.159
  478    H    VAL  61           H        VAL  61  -4.685  -5.486   8.910
  479    HA   VAL  61           HA       VAL  61  -5.175  -2.607   9.450
  480    HB   VAL  61           HB       VAL  61  -3.869  -2.123   7.382
  481   1HG1  VAL  61          1HG1      VAL  61  -2.419  -3.977   9.333
  482   2HG1  VAL  61          2HG1      VAL  61  -1.645  -2.775   8.271
  483   3HG1  VAL  61          3HG1      VAL  61  -2.695  -2.244   9.607
  484   1HG2  VAL  61          1HG2      VAL  61  -3.193  -5.085   7.535
  485   2HG2  VAL  61          2HG2      VAL  61  -4.181  -4.338   6.243
  486   3HG2  VAL  61          3HG2      VAL  61  -2.457  -3.900   6.440
  487    H    THR  62           H        THR  62  -6.787  -1.670   8.252
  488    HA   THR  62           HA       THR  62  -8.615  -3.634   7.022
  489    HB   THR  62           HB       THR  62  -9.070  -0.677   7.560
  490    HG1  THR  62           HG1      THR  62  -8.626  -2.028   9.479
  491   1HG2  THR  62          1HG2      THR  62 -11.463  -1.382   7.477
  492   2HG2  THR  62          2HG2      THR  62 -10.648  -1.758   5.948
  493   3HG2  THR  62          3HG2      THR  62 -10.953  -3.044   7.139
  494    H    LEU  63           H        LEU  63  -8.731  -3.978   4.904
  495    HA   LEU  63           HA       LEU  63  -7.347  -2.154   3.041
  496   1HB   LEU  63          1HB       LEU  63  -8.664  -4.882   2.810
  497   2HB   LEU  63          2HB       LEU  63  -8.248  -3.918   1.383
  498    HG   LEU  63           HG       LEU  63  -6.456  -5.500   1.866
  499   1HD1  LEU  63          1HD1      LEU  63  -5.935  -3.303   0.867
  500   2HD1  LEU  63          2HD1      LEU  63  -5.714  -2.611   2.490
  501   3HD1  LEU  63          3HD1      LEU  63  -4.602  -3.871   1.900
  502   1HD2  LEU  63          1HD2      LEU  63  -6.198  -4.028   4.517
  503   2HD2  LEU  63          2HD2      LEU  63  -6.739  -5.709   4.305
  504   3HD2  LEU  63          3HD2      LEU  63  -5.067  -5.255   3.895
  505    H    ILE  64           H        ILE  64  -8.340  -0.531   2.286
  506    HA   ILE  64           HA       ILE  64 -11.306  -0.367   2.261
  507    HB   ILE  64           HB       ILE  64  -9.265   1.844   1.793
  508   1HG1  ILE  64          1HG1      ILE  64 -10.674   1.114   4.381
  509   2HG1  ILE  64          2HG1      ILE  64  -8.917   1.058   4.086
  510   1HG2  ILE  64          1HG2      ILE  64 -12.219   1.865   2.520
  511   2HG2  ILE  64          2HG2      ILE  64 -11.184   3.308   2.367
  512   3HG2  ILE  64          3HG2      ILE  64 -11.518   2.295   0.940
  513   1HD1  ILE  64          1HD1      ILE  64  -8.969   3.520   3.626
  514   2HD1  ILE  64          2HD1      ILE  64 -10.716   3.526   3.946
  515   3HD1  ILE  64          3HD1      ILE  64  -9.579   3.149   5.262
  516    H    ALA  65           H        ALA  65 -12.300   0.555   0.459
  517    HA   ALA  65           HA       ALA  65 -10.959   1.037  -2.056
  518   1HB   ALA  65          1HB       ALA  65 -13.150  -1.072  -1.710
  519   2HB   ALA  65          2HB       ALA  65 -12.514  -0.497  -3.269
  520   3HB   ALA  65          3HB       ALA  65 -11.466  -1.429  -2.170
  521    H    GLN  66           H        GLN  66 -11.573   3.057  -2.131
  522    HA   GLN  66           HA       GLN  66 -14.465   3.530  -1.636
  523   1HB   GLN  66          1HB       GLN  66 -12.937   4.585  -0.022
  524   2HB   GLN  66          2HB       GLN  66 -11.990   5.253  -1.359
  525   1HG   GLN  66          1HG       GLN  66 -14.525   6.098  -1.978
  526   2HG   GLN  66          2HG       GLN  66 -14.553   6.144  -0.193
  527   1HE2  GLN  66          2HE2      GLN  66 -12.713   7.084  -3.082
  528   2HE2  GLN  66          1HE2      GLN  66 -11.918   8.505  -2.380
  529    H    GLY  67           H        GLY  67 -14.514   2.547  -3.793
  530   1HA   GLY  67          1HA       GLY  67 -14.424   4.565  -5.973
  531   2HA   GLY  67          2HA       GLY  67 -13.502   3.090  -6.102
  532    H    GLU  68           H        GLU  68 -14.878   2.896  -7.983
  533    HA   GLU  68           HA       GLU  68 -17.550   2.091  -8.022
  534   1HB   GLU  68          1HB       GLU  68 -15.192   0.966  -9.601
  535   2HB   GLU  68          2HB       GLU  68 -16.897   0.920 -10.095
  536   1HG   GLU  68          1HG       GLU  68 -15.209   3.433  -9.706
  537   2HG   GLU  68          2HG       GLU  68 -15.705   2.737 -11.262
  538    H    ASP  69           H        ASP  69 -14.594   0.240  -7.110
  539    HA   ASP  69           HA       ASP  69 -16.338  -2.134  -6.608
  540   1HB   ASP  69          1HB       ASP  69 -13.310  -1.945  -6.685
  541   2HB   ASP  69          2HB       ASP  69 -14.279  -3.412  -6.531
  542    H    GLU  70           H        GLU  70 -16.353   0.339  -4.904
  543    HA   GLU  70           HA       GLU  70 -14.490   0.229  -2.896
  544   1HB   GLU  70          1HB       GLU  70 -15.758   1.702  -1.729
  545   2HB   GLU  70          2HB       GLU  70 -16.262   1.982  -3.406
  546   1HG   GLU  70          1HG       GLU  70 -17.845   0.280  -1.440
  547   2HG   GLU  70          2HG       GLU  70 -18.115   2.014  -1.702
  548    H    GLN  71           H        GLN  71 -17.656  -1.480  -2.746
  549    HA   GLN  71           HA       GLN  71 -16.699  -2.801  -0.320
  550   1HB   GLN  71          1HB       GLN  71 -19.037  -2.051  -0.550
  551   2HB   GLN  71          2HB       GLN  71 -19.295  -3.248  -1.840
  552   1HG   GLN  71          1HG       GLN  71 -20.039  -3.992   0.472
  553   2HG   GLN  71          2HG       GLN  71 -18.855  -5.066  -0.309
  554   1HE2  GLN  71          2HE2      GLN  71 -17.024  -5.579   0.716
  555   2HE2  GLN  71          1HE2      GLN  71 -16.483  -4.827   2.221
  556    H    GLU  72           H        GLU  72 -15.815  -3.285  -3.365
  557    HA   GLU  72           HA       GLU  72 -15.971  -6.250  -3.399
  558   1HB   GLU  72          1HB       GLU  72 -16.571  -5.338  -5.548
  559   2HB   GLU  72          2HB       GLU  72 -15.294  -4.110  -5.456
  560   1HG   GLU  72          1HG       GLU  72 -14.718  -5.886  -7.065
  561   2HG   GLU  72          2HG       GLU  72 -13.558  -5.782  -5.732
  562    H    ALA  73           H        ALA  73 -13.749  -3.713  -4.222
  563    HA   ALA  73           HA       ALA  73 -11.340  -4.901  -4.460
  564   1HB   ALA  73          1HB       ALA  73 -12.240  -2.211  -3.385
  565   2HB   ALA  73          2HB       ALA  73 -10.579  -2.534  -3.968
  566   3HB   ALA  73          3HB       ALA  73 -11.976  -2.644  -5.078
  567    H    LEU  74           H        LEU  74 -12.454  -3.148  -1.655
  568    HA   LEU  74           HA       LEU  74 -10.440  -3.452   0.151
  569   1HB   LEU  74          1HB       LEU  74 -12.023  -2.639   1.667
  570   2HB   LEU  74          2HB       LEU  74 -12.666  -2.154   0.066
  571    HG   LEU  74           HG       LEU  74 -13.580  -4.645   1.540
  572   1HD1  LEU  74          1HD1      LEU  74 -14.878  -1.904   1.299
  573   2HD1  LEU  74          2HD1      LEU  74 -15.660  -3.350   1.977
  574   3HD1  LEU  74          3HD1      LEU  74 -14.260  -2.622   2.807
  575   1HD2  LEU  74          1HD2      LEU  74 -13.779  -4.647  -0.908
  576   2HD2  LEU  74          2HD2      LEU  74 -15.351  -4.651  -0.070
  577   3HD2  LEU  74          3HD2      LEU  74 -14.731  -3.154  -0.802
  578    H    GLU  75           H        GLU  75 -13.107  -5.817  -0.445
  579    HA   GLU  75           HA       GLU  75 -12.232  -7.371   1.860
  580   1HB   GLU  75          1HB       GLU  75 -14.165  -8.789   1.373
  581   2HB   GLU  75          2HB       GLU  75 -14.616  -7.081   1.514
  582   1HG   GLU  75          1HG       GLU  75 -14.601  -6.911  -0.989
  583   2HG   GLU  75          2HG       GLU  75 -14.286  -8.655  -1.066
  584    H    LYS  76           H        LYS  76 -12.223  -7.747  -1.757
  585    HA   LYS  76           HA       LYS  76 -11.141 -10.401  -1.407
  586   1HB   LYS  76          1HB       LYS  76 -10.678 -10.520  -3.608
  587   2HB   LYS  76          2HB       LYS  76 -12.190  -9.593  -3.565
  588   1HG   LYS  76          1HG       LYS  76 -10.912  -7.597  -4.238
  589   2HG   LYS  76          2HG       LYS  76  -9.373  -8.466  -3.936
  590   1HD   LYS  76          1HD       LYS  76 -10.206 -10.272  -5.524
  591   2HD   LYS  76          2HD       LYS  76 -11.474  -9.151  -6.041
  592   1HE   LYS  76          1HE       LYS  76  -9.712  -7.561  -6.821
  593   2HE   LYS  76          2HE       LYS  76  -8.455  -8.650  -6.195
  594   1HZ   LYS  76          1HZ       LYS  76  -9.279 -10.319  -7.727
  595   2HZ   LYS  76          2HZ       LYS  76 -10.357  -9.236  -8.351
  596   3HZ   LYS  76          3HZ       LYS  76  -8.732  -8.976  -8.502
  597    H    LEU  77           H        LEU  77  -9.640  -7.258  -1.990
  598    HA   LEU  77           HA       LEU  77  -6.928  -7.962  -1.918
  599   1HB   LEU  77          1HB       LEU  77  -8.674  -5.635  -1.644
  600   2HB   LEU  77          2HB       LEU  77  -7.190  -5.487  -0.666
  601    HG   LEU  77           HG       LEU  77  -7.154  -4.719  -3.204
  602   1HD1  LEU  77          1HD1      LEU  77  -5.452  -4.729  -1.454
  603   2HD1  LEU  77          2HD1      LEU  77  -5.152  -6.466  -1.765
  604   3HD1  LEU  77          3HD1      LEU  77  -4.772  -5.251  -3.033
  605   1HD2  LEU  77          1HD2      LEU  77  -6.427  -7.694  -3.330
  606   2HD2  LEU  77          2HD2      LEU  77  -7.775  -6.942  -4.221
  607   3HD2  LEU  77          3HD2      LEU  77  -6.089  -6.497  -4.593
  608    H    ALA  78           H        ALA  78  -8.926  -6.773   0.906
  609    HA   ALA  78           HA       ALA  78  -6.923  -7.270   2.835
  610   1HB   ALA  78          1HB       ALA  78  -9.953  -7.341   3.128
  611   2HB   ALA  78          2HB       ALA  78  -8.786  -7.225   4.462
  612   3HB   ALA  78          3HB       ALA  78  -8.919  -5.903   3.292
  613    H    ALA  79           H        ALA  79  -9.340  -9.454   1.364
  614    HA   ALA  79           HA       ALA  79  -8.999 -11.643   3.153
  615   1HB   ALA  79          1HB       ALA  79 -10.803 -11.416   1.419
  616   2HB   ALA  79          2HB       ALA  79  -9.557 -11.611   0.158
  617   3HB   ALA  79          3HB       ALA  79  -9.909 -12.954   1.273
  618    H    TYR  80           H        TYR  80  -7.429 -10.775   0.018
  619    HA   TYR  80           HA       TYR  80  -5.827 -13.089  -0.114
  620   1HB   TYR  80          1HB       TYR  80  -6.587 -11.477  -1.864
  621   2HB   TYR  80          2HB       TYR  80  -5.328 -10.369  -1.323
  622    HD1  TYR  80           HD1      TYR  80  -4.118 -13.671  -0.884
  623    HD2  TYR  80           HD2      TYR  80  -4.942 -10.797  -3.983
  624    HE1  TYR  80           HE1      TYR  80  -2.541 -14.846  -2.380
  625    HE2  TYR  80           HE2      TYR  80  -3.323 -11.960  -5.476
  626    HH   TYR  80           HH       TYR  80  -1.574 -14.897  -4.454
  627    H    VAL  81           H        VAL  81  -5.057  -9.832   1.173
  628    HA   VAL  81           HA       VAL  81  -2.310 -10.217   1.541
  629    HB   VAL  81           HB       VAL  81  -2.432  -8.346   3.106
  630   1HG1  VAL  81          1HG2      VAL  81  -2.873  -7.950   0.681
  631   2HG1  VAL  81          2HG2      VAL  81  -4.607  -8.194   0.984
  632   3HG1  VAL  81          3HG2      VAL  81  -3.775  -6.799   1.717
  633   1HG2  VAL  81          1HG1      VAL  81  -5.420  -8.973   3.141
  634   2HG2  VAL  81          2HG1      VAL  81  -4.296  -9.221   4.484
  635   3HG2  VAL  81          3HG1      VAL  81  -4.662  -7.569   3.935
  636    H    GLN  82           H        GLN  82  -4.911 -11.259   3.661
  637    HA   GLN  82           HA       GLN  82  -3.045 -12.255   5.727
  638   1HB   GLN  82          1HB       GLN  82  -5.145 -12.627   6.987
  639   2HB   GLN  82          2HB       GLN  82  -5.113 -11.004   6.295
  640   1HG   GLN  82          1HG       GLN  82  -6.513 -11.960   4.344
  641   2HG   GLN  82          2HG       GLN  82  -6.450 -13.459   5.233
  642   1HE2  GLN  82          2HE2      GLN  82  -8.045 -10.526   4.954
  643   2HE2  GLN  82          1HE2      GLN  82  -9.250 -10.765   6.234
  644    H    GLU  83           H        GLU  83  -5.416 -13.360   3.415
  645    HA   GLU  83           HA       GLU  83  -6.255 -15.684   3.506
  646   1HB   GLU  83          1HB       GLU  83  -6.074 -14.128   1.655
  647   2HB   GLU  83          2HB       GLU  83  -4.466 -14.772   1.235
  648   1HG   GLU  83          1HG       GLU  83  -5.478 -17.038   0.907
  649   2HG   GLU  83          2HG       GLU  83  -7.087 -16.331   1.186
  650    H    GLU  84           H        GLU  84  -2.858 -15.751   2.260
  651    HA   GLU  84           HA       GLU  84  -2.913 -18.580   3.160
  652   1HB   GLU  84          1HB       GLU  84  -1.127 -18.994   1.519
  653   2HB   GLU  84          2HB       GLU  84  -2.652 -18.461   0.803
  654   1HG   GLU  84          1HG       GLU  84  -0.648 -16.319   1.378
  655   2HG   GLU  84          2HG       GLU  84  -0.283 -17.455   0.058
  656    H    VAL  85           H        VAL  85   0.258 -17.883   2.472
  657    HA   VAL  85           HA       VAL  85   0.741 -17.077   5.298
  658    HB   VAL  85           HB       VAL  85   2.337 -18.923   5.693
  659   1HG1  VAL  85          1HG1      VAL  85  -0.265 -20.198   4.591
  660   2HG1  VAL  85          2HG1      VAL  85   0.922 -21.004   5.648
  661   3HG1  VAL  85          3HG1      VAL  85   0.005 -19.639   6.259
  662   1HG2  VAL  85          1HG2      VAL  85   3.230 -19.256   3.344
  663   2HG2  VAL  85          2HG2      VAL  85   2.779 -20.785   4.108
  664   3HG2  VAL  85          3HG2      VAL  85   1.712 -20.060   2.878
  Start of MODEL   11
    1   1H    VAL   2          1H        VAL   2 -16.977   5.199  -3.241
    2   2H    VAL   2          2H        VAL   2 -17.550   3.622  -3.131
    3   3H    VAL   2          3H        VAL   2 -18.608   4.877  -3.497
    4    HA   VAL   2           HA       VAL   2 -18.256   5.856  -1.348
    5    HB   VAL   2           HB       VAL   2 -18.888   2.890  -1.066
    6   1HG1  VAL   2          1HG1      VAL   2 -20.071   5.395   0.202
    7   2HG1  VAL   2          2HG1      VAL   2 -20.580   3.722   0.532
    8   3HG1  VAL   2          3HG1      VAL   2 -18.947   4.258   0.990
    9   1HG2  VAL   2          1HG2      VAL   2 -20.681   5.052  -2.232
   10   2HG2  VAL   2          2HG2      VAL   2 -19.994   3.659  -3.105
   11   3HG2  VAL   2          3HG2      VAL   2 -21.192   3.396  -1.811
   12    H    GLN   3           H        GLN   3 -17.292   5.238   0.992
   13    HA   GLN   3           HA       GLN   3 -14.734   3.818   0.437
   14   1HB   GLN   3          1HB       GLN   3 -14.578   6.223   1.204
   15   2HB   GLN   3          2HB       GLN   3 -15.254   5.711   2.768
   16   1HG   GLN   3          1HG       GLN   3 -13.335   4.268   3.192
   17   2HG   GLN   3          2HG       GLN   3 -12.849   4.353   1.490
   18   1HE2  GLN   3          2HE2      GLN   3 -13.229   6.420   4.419
   19   2HE2  GLN   3          1HE2      GLN   3 -11.941   7.516   3.957
   20    H    GLN   4           H        GLN   4 -14.589   1.807   1.233
   21    HA   GLN   4           HA       GLN   4 -15.788   1.362   3.903
   22   1HB   GLN   4          1HB       GLN   4 -17.325   0.750   1.874
   23   2HB   GLN   4          2HB       GLN   4 -16.302  -0.679   1.733
   24   1HG   GLN   4          1HG       GLN   4 -17.927   0.154   4.178
   25   2HG   GLN   4          2HG       GLN   4 -18.388  -1.085   2.998
   26   1HE2  GLN   4          2HE2      GLN   4 -16.871  -0.559   5.993
   27   2HE2  GLN   4          1HE2      GLN   4 -15.889  -2.019   6.057
   28    H    LYS   5           H        LYS   5 -14.612  -0.411   5.098
   29    HA   LYS   5           HA       LYS   5 -12.485  -1.748   3.633
   30   1HB   LYS   5          1HB       LYS   5 -10.938  -0.968   5.611
   31   2HB   LYS   5          2HB       LYS   5 -11.199   0.034   4.180
   32   1HG   LYS   5          1HG       LYS   5 -11.399   1.581   5.900
   33   2HG   LYS   5          2HG       LYS   5 -13.080   1.197   5.470
   34   1HD   LYS   5          1HD       LYS   5 -13.155  -0.415   7.392
   35   2HD   LYS   5          2HD       LYS   5 -11.451   0.006   7.745
   36   1HE   LYS   5          1HE       LYS   5 -12.086   2.380   8.024
   37   2HE   LYS   5          2HE       LYS   5 -13.797   1.935   7.838
   38   1HZ   LYS   5          1HZ       LYS   5 -11.953   0.955   9.909
   39   2HZ   LYS   5          2HZ       LYS   5 -13.149   2.067  10.131
   40   3HZ   LYS   5          3HZ       LYS   5 -13.535   0.507   9.759
   41    H    VAL   6           H        VAL   6 -11.733  -3.542   4.665
   42    HA   VAL   6           HA       VAL   6 -13.099  -4.386   7.171
   43    HB   VAL   6           HB       VAL   6 -13.257  -6.683   6.171
   44   1HG1  VAL   6          1HG1      VAL   6 -14.712  -4.469   4.664
   45   2HG1  VAL   6          2HG1      VAL   6 -15.228  -6.170   4.759
   46   3HG1  VAL   6          3HG1      VAL   6 -15.205  -5.162   6.226
   47   1HG2  VAL   6          1HG2      VAL   6 -11.552  -6.383   4.387
   48   2HG2  VAL   6          2HG2      VAL   6 -13.114  -6.921   3.719
   49   3HG2  VAL   6          3HG2      VAL   6 -12.618  -5.216   3.574
   50    H    GLU   7           H        GLU   7 -11.517  -4.917   8.696
   51    HA   GLU   7           HA       GLU   7  -8.798  -5.026   7.576
   52   1HB   GLU   7          1HB       GLU   7  -8.048  -4.801   9.928
   53   2HB   GLU   7          2HB       GLU   7  -9.138  -3.475   9.480
   54   1HG   GLU   7          1HG       GLU   7 -10.960  -4.489  10.711
   55   2HG   GLU   7          2HG       GLU   7 -10.043  -6.000  10.927
   56    H    VAL   8           H        VAL   8  -7.210  -6.442   8.110
   57    HA   VAL   8           HA       VAL   8  -8.008  -9.075   9.152
   58    HB   VAL   8           HB       VAL   8  -7.462 -10.269   7.159
   59   1HG1  VAL   8          1HG2      VAL   8  -8.861  -7.706   6.290
   60   2HG1  VAL   8          2HG2      VAL   8  -8.812  -9.224   5.349
   61   3HG1  VAL   8          3HG2      VAL   8  -9.656  -9.175   6.921
   62   1HG2  VAL   8          1HG1      VAL   8  -6.407  -7.648   6.028
   63   2HG2  VAL   8          2HG1      VAL   8  -5.414  -9.021   6.586
   64   3HG2  VAL   8          3HG1      VAL   8  -6.473  -9.211   5.170
   65    H    ARG   9           H        ARG   9  -5.723 -10.512   8.848
   66    HA   ARG   9           HA       ARG   9  -3.700  -8.668   9.959
   67   1HB   ARG   9          1HB       ARG   9  -3.899 -10.938  10.928
   68   2HB   ARG   9          2HB       ARG   9  -3.442 -11.613   9.320
   69   1HG   ARG   9          1HG       ARG   9  -1.286 -10.281   9.550
   70   2HG   ARG   9          2HG       ARG   9  -1.757 -10.040  11.257
   71   1HD   ARG   9          1HD       ARG   9  -0.371 -12.030  11.124
   72   2HD   ARG   9          2HD       ARG   9  -2.027 -12.550  11.448
   73    HE   ARG   9           HE       ARG   9  -0.433 -12.965   9.015
   74   1HH1  ARG   9          2HH1      ARG   9  -3.667 -13.145  10.455
   75   2HH1  ARG   9          1HH1      ARG   9  -4.312 -14.160   9.189
   76   1HH2  ARG   9          1HH2      ARG   9  -1.259 -14.356   7.431
   77   2HH2  ARG   9          2HH2      ARG   9  -2.972 -14.661   7.317
   78    H    LEU  10           H        LEU  10  -2.075  -7.865   8.876
   79    HA   LEU  10           HA       LEU  10  -2.024  -7.930   6.022
   80   1HB   LEU  10          1HB       LEU  10  -1.526  -6.000   7.483
   81   2HB   LEU  10          2HB       LEU  10  -0.157  -6.864   8.197
   82    HG   LEU  10           HG       LEU  10   1.093  -6.740   6.144
   83   1HD1  LEU  10          1HD2      LEU  10  -1.406  -5.432   4.972
   84   2HD1  LEU  10          2HD2      LEU  10   0.179  -5.577   4.168
   85   3HD1  LEU  10          3HD2      LEU  10  -0.768  -7.037   4.533
   86   1HD2  LEU  10          1HD1      LEU  10   0.989  -4.842   7.747
   87   2HD2  LEU  10          2HD1      LEU  10   1.281  -4.297   6.082
   88   3HD2  LEU  10          3HD1      LEU  10  -0.343  -4.125   6.802
   89    H    LYS  11           H        LYS  11  -1.885 -10.333   5.950
   90    HA   LYS  11           HA       LYS  11   0.509 -11.708   6.758
   91   1HB   LYS  11          1HB       LYS  11  -1.597 -12.873   6.555
   92   2HB   LYS  11          2HB       LYS  11  -1.811 -12.357   4.872
   93   1HG   LYS  11          1HG       LYS  11   0.498 -14.111   5.652
   94   2HG   LYS  11          2HG       LYS  11  -1.114 -14.736   5.196
   95   1HD   LYS  11          1HD       LYS  11   0.622 -12.902   3.492
   96   2HD   LYS  11          2HD       LYS  11   0.198 -14.584   3.126
   97   1HE   LYS  11          1HE       LYS  11  -2.184 -13.996   2.980
   98   2HE   LYS  11          2HE       LYS  11  -1.838 -12.365   3.601
   99   1HZ   LYS  11          1HZ       LYS  11  -0.840 -13.372   1.057
  100   2HZ   LYS  11          2HZ       LYS  11  -2.165 -12.399   1.249
  101   3HZ   LYS  11          3HZ       LYS  11  -0.660 -11.867   1.684
  102    H    THR  12           H        THR  12  -0.529 -10.037   3.781
  103    HA   THR  12           HA       THR  12   1.603 -10.873   2.087
  104    HB   THR  12           HB       THR  12   1.144  -8.515   1.081
  105    HG1  THR  12           HG1      THR  12  -0.843  -7.618   1.890
  106   1HG2  THR  12          1HG2      THR  12  -1.220 -10.393   1.401
  107   2HG2  THR  12          2HG2      THR  12  -0.998  -9.189   0.109
  108   3HG2  THR  12          3HG2      THR  12   0.094 -10.587   0.215
  109    H    GLY  13           H        GLY  13   1.252  -8.242   4.449
  110   1HA   GLY  13          1HA       GLY  13   2.649  -6.650   5.279
  111   2HA   GLY  13          2HA       GLY  13   3.910  -7.892   5.289
  112    H    LEU  14           H        LEU  14   2.267  -6.776   2.468
  113    HA   LEU  14           HA       LEU  14   3.081  -6.036   0.415
  114   1HB   LEU  14          1HB       LEU  14   3.178  -3.912   2.498
  115   2HB   LEU  14          2HB       LEU  14   3.679  -3.544   0.843
  116    HG   LEU  14           HG       LEU  14   1.237  -3.109   1.305
  117   1HD1  LEU  14          1HD2      LEU  14   2.081  -3.463  -0.969
  118   2HD1  LEU  14          2HD2      LEU  14   1.821  -5.213  -0.800
  119   3HD1  LEU  14          3HD2      LEU  14   0.434  -4.098  -0.783
  120   1HD2  LEU  14          1HD1      LEU  14   0.831  -5.091   2.763
  121   2HD2  LEU  14          2HD1      LEU  14  -0.315  -5.006   1.401
  122   3HD2  LEU  14          3HD1      LEU  14   1.049  -6.148   1.348
  123    H    GLN  15           H        GLN  15   5.099  -7.649   1.291
  124    HA   GLN  15           HA       GLN  15   7.584  -6.139   1.241
  125   1HB   GLN  15          1HB       GLN  15   8.303  -8.806   0.948
  126   2HB   GLN  15          2HB       GLN  15   8.184  -7.868   2.444
  127   1HG   GLN  15          1HG       GLN  15   6.972  -9.811   2.898
  128   2HG   GLN  15          2HG       GLN  15   5.738  -8.581   2.591
  129   1HE2  GLN  15          2HE2      GLN  15   6.824 -11.606   1.956
  130   2HE2  GLN  15          1HE2      GLN  15   5.941 -12.024   0.461
  131    H    ALA  16           H        ALA  16   5.935  -8.357  -1.058
  132    HA   ALA  16           HA       ALA  16   7.118  -6.826  -3.213
  133   1HB   ALA  16          1HB       ALA  16   9.049  -8.173  -2.603
  134   2HB   ALA  16          2HB       ALA  16   8.100  -9.668  -2.790
  135   3HB   ALA  16          3HB       ALA  16   8.443  -8.644  -4.209
  136    H    ARG  17           H        ARG  17   6.728 -10.092  -4.023
  137    HA   ARG  17           HA       ARG  17   4.893  -9.644  -6.023
  138   1HB   ARG  17          1HB       ARG  17   6.282 -11.546  -6.039
  139   2HB   ARG  17          2HB       ARG  17   5.544 -12.212  -4.566
  140   1HG   ARG  17          1HG       ARG  17   4.809 -13.194  -6.838
  141   2HG   ARG  17          2HG       ARG  17   3.537 -12.762  -5.682
  142   1HD   ARG  17          1HD       ARG  17   3.052 -12.032  -8.034
  143   2HD   ARG  17          2HD       ARG  17   3.019 -10.729  -6.837
  144    HE   ARG  17           HE       ARG  17   5.354 -11.247  -8.632
  145   1HH1  ARG  17          2HH1      ARG  17   3.124  -9.023  -6.968
  146   2HH1  ARG  17          1HH1      ARG  17   3.751  -7.610  -7.771
  147   1HH2  ARG  17          1HH2      ARG  17   6.234  -9.367  -9.576
  148   2HH2  ARG  17          2HH2      ARG  17   5.588  -7.793  -9.208
  149    HA   PRO  18           HA       PRO  18   1.146 -11.321  -3.644
  150   1HB   PRO  18          1HB       PRO  18   1.217 -11.546  -0.901
  151   2HB   PRO  18          2HB       PRO  18   1.966 -12.830  -1.909
  152   1HG   PRO  18          1HG       PRO  18   3.359 -10.365  -0.763
  153   2HG   PRO  18          2HG       PRO  18   3.838 -12.041  -0.463
  154   1HD   PRO  18          1HD       PRO  18   5.018 -10.704  -2.444
  155   2HD   PRO  18          2HD       PRO  18   4.423 -12.358  -2.794
  156    H    ALA  19           H        ALA  19   3.120  -9.126  -1.831
  157    HA   ALA  19           HA       ALA  19   1.280  -7.354  -0.702
  158   1HB   ALA  19          1HB       ALA  19   4.007  -7.149  -2.031
  159   2HB   ALA  19          2HB       ALA  19   3.388  -5.945  -0.855
  160   3HB   ALA  19          3HB       ALA  19   3.717  -7.635  -0.347
  161    H    ALA  20           H        ALA  20   2.955  -7.288  -3.831
  162    HA   ALA  20           HA       ALA  20   1.562  -4.846  -4.786
  163   1HB   ALA  20          1HB       ALA  20   3.399  -6.887  -6.142
  164   2HB   ALA  20          2HB       ALA  20   2.867  -5.343  -6.860
  165   3HB   ALA  20          3HB       ALA  20   3.932  -5.343  -5.430
  166    H    LEU  21           H        LEU  21   1.231  -8.380  -5.024
  167    HA   LEU  21           HA       LEU  21  -0.677  -8.425  -7.144
  168   1HB   LEU  21          1HB       LEU  21   0.524 -10.312  -5.833
  169   2HB   LEU  21          2HB       LEU  21  -0.796 -10.179  -4.663
  170    HG   LEU  21           HG       LEU  21  -1.158 -11.946  -6.409
  171   1HD1  LEU  21          1HD2      LEU  21  -3.088 -10.889  -5.294
  172   2HD1  LEU  21          2HD2      LEU  21  -3.114  -9.618  -6.538
  173   3HD1  LEU  21          3HD2      LEU  21  -3.465 -11.304  -6.983
  174   1HD2  LEU  21          1HD1      LEU  21  -0.027 -10.762  -8.273
  175   2HD2  LEU  21          2HD1      LEU  21  -1.682 -11.244  -8.714
  176   3HD2  LEU  21          3HD1      LEU  21  -1.334  -9.553  -8.289
  177    H    PHE  22           H        PHE  22  -0.933  -8.121  -3.672
  178    HA   PHE  22           HA       PHE  22  -3.663  -7.599  -3.210
  179   1HB   PHE  22          1HB       PHE  22  -2.234  -7.995  -1.389
  180   2HB   PHE  22          2HB       PHE  22  -1.036  -6.828  -1.967
  181    HD1  PHE  22           HD1      PHE  22  -4.707  -6.283  -1.345
  182    HD2  PHE  22           HD2      PHE  22  -0.635  -5.215  -0.486
  183    HE1  PHE  22           HE1      PHE  22  -5.493  -4.297  -0.076
  184    HE2  PHE  22           HE2      PHE  22  -1.420  -3.277   0.861
  185    HZ   PHE  22           HZ       PHE  22  -3.857  -2.851   1.111
  186    H    VAL  23           H        VAL  23  -1.027  -5.070  -3.428
  187    HA   VAL  23           HA       VAL  23  -2.764  -2.927  -3.676
  188    HB   VAL  23           HB       VAL  23  -0.985  -1.682  -4.506
  189   1HG1  VAL  23          1HG1      VAL  23  -0.404  -2.372  -2.301
  190   2HG1  VAL  23          2HG1      VAL  23   0.484  -3.781  -2.947
  191   3HG1  VAL  23          3HG1      VAL  23   1.014  -2.120  -3.321
  192   1HG2  VAL  23          1HG2      VAL  23  -0.783  -2.821  -6.503
  193   2HG2  VAL  23          2HG2      VAL  23   0.823  -2.443  -5.844
  194   3HG2  VAL  23          3HG2      VAL  23   0.147  -4.120  -5.751
  195    H    GLN  24           H        GLN  24  -1.633  -5.189  -6.173
  196    HA   GLN  24           HA       GLN  24  -2.406  -3.901  -8.507
  197   1HB   GLN  24          1HB       GLN  24  -0.918  -5.806  -8.393
  198   2HB   GLN  24          2HB       GLN  24  -2.190  -6.836  -7.721
  199   1HG   GLN  24          1HG       GLN  24  -2.890  -5.556 -10.278
  200   2HG   GLN  24          2HG       GLN  24  -1.513  -6.668 -10.377
  201   1HE2  GLN  24          2HE2      GLN  24  -3.339  -7.905  -7.811
  202   2HE2  GLN  24          1HE2      GLN  24  -4.270  -9.040  -8.761
  203    H    GLU  25           H        GLU  25  -4.227  -6.313  -6.555
  204    HA   GLU  25           HA       GLU  25  -6.573  -5.994  -8.306
  205   1HB   GLU  25          1HB       GLU  25  -7.634  -7.401  -6.377
  206   2HB   GLU  25          2HB       GLU  25  -6.372  -8.181  -7.353
  207   1HG   GLU  25          1HG       GLU  25  -4.680  -7.711  -5.654
  208   2HG   GLU  25          2HG       GLU  25  -5.869  -6.839  -4.669
  209    H    ALA  26           H        ALA  26  -5.563  -4.818  -5.083
  210    HA   ALA  26           HA       ALA  26  -7.881  -3.351  -4.441
  211   1HB   ALA  26          1HB       ALA  26  -5.857  -3.585  -3.008
  212   2HB   ALA  26          2HB       ALA  26  -4.956  -2.553  -4.146
  213   3HB   ALA  26          3HB       ALA  26  -6.323  -1.879  -3.225
  214    H    ASN  27           H        ASN  27  -5.172  -2.604  -6.594
  215    HA   ASN  27           HA       ASN  27  -5.906   0.004  -7.500
  216   1HB   ASN  27          1HB       ASN  27  -4.055  -2.237  -8.111
  217   2HB   ASN  27          2HB       ASN  27  -4.537  -1.321  -9.530
  218   1HD2  ASN  27          2HD2      ASN  27  -2.353  -1.438  -7.032
  219   2HD2  ASN  27          1HD2      ASN  27  -1.740   0.206  -6.979
  220    H    ARG  28           H        ARG  28  -6.614  -3.251  -8.481
  221    HA   ARG  28           HA       ARG  28  -7.421  -2.924 -11.234
  222   1HB   ARG  28          1HB       ARG  28  -7.670  -4.839  -8.912
  223   2HB   ARG  28          2HB       ARG  28  -8.606  -5.173 -10.341
  224   1HG   ARG  28          1HG       ARG  28  -6.529  -5.062 -11.734
  225   2HG   ARG  28          2HG       ARG  28  -5.603  -4.703 -10.269
  226   1HD   ARG  28          1HD       ARG  28  -5.443  -7.093 -10.958
  227   2HD   ARG  28          2HD       ARG  28  -6.076  -6.878  -9.319
  228    HE   ARG  28           HE       ARG  28  -8.384  -7.059 -10.592
  229   1HH1  ARG  28          2HH1      ARG  28  -5.397  -8.842 -11.261
  230   2HH1  ARG  28          1HH1      ARG  28  -6.210 -10.269 -11.835
  231   1HH2  ARG  28          1HH2      ARG  28  -9.462  -8.925 -11.365
  232   2HH2  ARG  28          2HH2      ARG  28  -8.562 -10.317 -11.900
  233    H    PHE  29           H        PHE  29  -8.891  -3.169  -8.105
  234    HA   PHE  29           HA       PHE  29 -11.565  -2.389  -8.615
  235   1HB   PHE  29          1HB       PHE  29  -9.556  -2.411  -6.359
  236   2HB   PHE  29          2HB       PHE  29 -11.169  -1.813  -6.096
  237    HD1  PHE  29           HD1      PHE  29  -9.508  -4.500  -5.205
  238    HD2  PHE  29           HD2      PHE  29 -12.615  -3.685  -8.054
  239    HE1  PHE  29           HE1      PHE  29 -10.232  -6.871  -5.088
  240    HE2  PHE  29           HE2      PHE  29 -13.292  -6.071  -8.008
  241    HZ   PHE  29           HZ       PHE  29 -12.152  -7.652  -6.472
  242    H    THR  30           H        THR  30 -12.333  -0.493  -9.164
  243    HA   THR  30           HA       THR  30 -10.599   1.799  -9.579
  244    HB   THR  30           HB       THR  30 -12.915   2.690 -10.388
  245    HG1  THR  30           HG1      THR  30 -14.241   0.711 -10.836
  246   1HG2  THR  30          1HG2      THR  30 -11.697   0.107 -11.464
  247   2HG2  THR  30          2HG2      THR  30 -12.720   1.223 -12.405
  248   3HG2  THR  30          3HG2      THR  30 -11.114   1.749 -11.829
  249    H    SER  31           H        SER  31 -10.376   1.460  -7.012
  250    HA   SER  31           HA       SER  31 -12.088   3.463  -5.661
  251   1HB   SER  31          1HB       SER  31 -11.032   0.838  -4.545
  252   2HB   SER  31          2HB       SER  31 -12.246   1.901  -3.797
  253    HG   SER  31           HG       SER  31 -12.975  -0.089  -4.985
  254    H    ASP  32           H        ASP  32 -11.166   4.595  -3.950
  255    HA   ASP  32           HA       ASP  32  -8.303   4.806  -3.646
  256   1HB   ASP  32          1HB       ASP  32 -10.743   6.058  -2.648
  257   2HB   ASP  32          2HB       ASP  32  -9.718   5.542  -1.297
  258    H    VAL  33           H        VAL  33  -7.884   2.458  -3.457
  259    HA   VAL  33           HA       VAL  33  -9.045   1.083  -1.174
  260    HB   VAL  33           HB       VAL  33  -7.780  -0.846  -1.892
  261   1HG1  VAL  33          1HG2      VAL  33  -8.895   0.875  -4.145
  262   2HG1  VAL  33          2HG2      VAL  33  -8.689  -0.894  -4.233
  263   3HG1  VAL  33          3HG2      VAL  33  -9.842  -0.177  -3.068
  264   1HG2  VAL  33          1HG1      VAL  33  -6.426   1.096  -3.815
  265   2HG2  VAL  33          2HG1      VAL  33  -5.661   0.324  -2.404
  266   3HG2  VAL  33          3HG1      VAL  33  -6.191  -0.668  -3.789
  267    H    PHE  34           H        PHE  34  -7.990   0.285   0.620
  268    HA   PHE  34           HA       PHE  34  -5.532   1.764   1.363
  269   1HB   PHE  34          1HB       PHE  34  -8.158   2.010   2.868
  270   2HB   PHE  34          2HB       PHE  34  -6.592   2.616   3.408
  271    HD1  PHE  34           HD1      PHE  34  -5.384   3.956   1.248
  272    HD2  PHE  34           HD2      PHE  34  -9.578   3.737   2.170
  273    HE1  PHE  34           HE1      PHE  34  -5.748   6.099   0.046
  274    HE2  PHE  34           HE2      PHE  34  -9.961   5.869   0.974
  275    HZ   PHE  34           HZ       PHE  34  -8.050   7.070  -0.079
  276    H    LEU  35           H        LEU  35  -4.825   1.298   3.530
  277    HA   LEU  35           HA       LEU  35  -5.706  -1.277   4.667
  278   1HB   LEU  35          1HB       LEU  35  -3.682  -1.482   3.044
  279   2HB   LEU  35          2HB       LEU  35  -2.765  -0.574   4.273
  280    HG   LEU  35           HG       LEU  35  -3.370  -2.313   5.954
  281   1HD1  LEU  35          1HD2      LEU  35  -4.731  -3.617   3.556
  282   2HD1  LEU  35          2HD2      LEU  35  -4.562  -4.345   5.170
  283   3HD1  LEU  35          3HD2      LEU  35  -5.565  -2.892   4.950
  284   1HD2  LEU  35          1HD1      LEU  35  -1.320  -2.623   4.587
  285   2HD2  LEU  35          2HD1      LEU  35  -2.076  -4.185   4.984
  286   3HD2  LEU  35          3HD1      LEU  35  -2.276  -3.488   3.360
  287    H    GLU  36           H        GLU  36  -6.264  -0.694   6.691
  288    HA   GLU  36           HA       GLU  36  -4.937   1.674   7.933
  289   1HB   GLU  36          1HB       GLU  36  -7.368   0.254   8.995
  290   2HB   GLU  36          2HB       GLU  36  -6.894   1.948   9.214
  291   1HG   GLU  36          1HG       GLU  36  -7.497   2.438   6.895
  292   2HG   GLU  36          2HG       GLU  36  -7.844   0.734   6.594
  293    H    LYS  37           H        LYS  37  -3.061   0.714   8.978
  294    HA   LYS  37           HA       LYS  37  -2.991  -1.822  10.283
  295   1HB   LYS  37          1HB       LYS  37  -1.435   0.772  10.288
  296   2HB   LYS  37          2HB       LYS  37  -0.985  -0.576  11.336
  297   1HG   LYS  37          1HG       LYS  37  -0.669  -2.053   9.421
  298   2HG   LYS  37          2HG       LYS  37  -1.261  -0.804   8.305
  299   1HD   LYS  37          1HD       LYS  37   1.262  -0.930   8.411
  300   2HD   LYS  37          2HD       LYS  37   0.622   0.658   8.908
  301   1HE   LYS  37          1HE       LYS  37   0.733  -0.068  11.293
  302   2HE   LYS  37          2HE       LYS  37   1.450  -1.609  10.775
  303   1HZ   LYS  37          1HZ       LYS  37   2.632   1.033  10.273
  304   2HZ   LYS  37          2HZ       LYS  37   3.092  -0.010  11.467
  305   3HZ   LYS  37          3HZ       LYS  37   3.278  -0.441   9.890
  306    H    ASP  38           H        ASP  38  -4.746  -2.042  11.717
  307    HA   ASP  38           HA       ASP  38  -6.091  -1.632  13.522
  308   1HB   ASP  38          1HB       ASP  38  -3.459  -0.538  14.571
  309   2HB   ASP  38          2HB       ASP  38  -4.922  -0.746  15.556
  310    H    GLY  39           H        GLY  39  -5.962   0.353  11.351
  311   1HA   GLY  39          1HA       GLY  39  -7.476   2.342  11.467
  312   2HA   GLY  39          2HA       GLY  39  -6.627   2.764  12.971
  313    H    LYS  40           H        LYS  40  -3.940   1.906  11.605
  314    HA   LYS  40           HA       LYS  40  -3.296   4.537  10.602
  315   1HB   LYS  40          1HB       LYS  40  -1.661   2.006  10.359
  316   2HB   LYS  40          2HB       LYS  40  -1.070   3.673  10.364
  317   1HG   LYS  40          1HG       LYS  40  -2.129   2.038  12.697
  318   2HG   LYS  40          2HG       LYS  40  -0.486   2.630  12.432
  319   1HD   LYS  40          1HD       LYS  40  -1.224   4.176  13.977
  320   2HD   LYS  40          2HD       LYS  40  -1.647   5.022  12.473
  321   1HE   LYS  40          1HE       LYS  40  -3.530   5.016  14.126
  322   2HE   LYS  40          2HE       LYS  40  -3.948   4.133  12.642
  323   1HZ   LYS  40          1HZ       LYS  40  -3.386   2.093  13.782
  324   2HZ   LYS  40          2HZ       LYS  40  -3.061   2.921  15.171
  325   3HZ   LYS  40          3HZ       LYS  40  -4.594   2.881  14.560
  326    H    LYS  41           H        LYS  41  -4.992   4.449   8.917
  327    HA   LYS  41           HA       LYS  41  -4.676   2.595   6.727
  328   1HB   LYS  41          1HB       LYS  41  -6.851   3.167   7.185
  329   2HB   LYS  41          2HB       LYS  41  -6.470   4.861   7.469
  330   1HG   LYS  41          1HG       LYS  41  -6.165   3.731   4.684
  331   2HG   LYS  41          2HG       LYS  41  -7.771   4.203   5.287
  332   1HD   LYS  41          1HD       LYS  41  -6.992   6.457   5.793
  333   2HD   LYS  41          2HD       LYS  41  -5.325   6.025   5.354
  334   1HE   LYS  41          1HE       LYS  41  -6.072   5.528   3.031
  335   2HE   LYS  41          2HE       LYS  41  -7.721   5.983   3.460
  336   1HZ   LYS  41          1HZ       LYS  41  -5.378   7.751   3.562
  337   2HZ   LYS  41          2HZ       LYS  41  -6.556   7.757   2.409
  338   3HZ   LYS  41          3HZ       LYS  41  -6.920   8.182   3.959
  339    H    VAL  42           H        VAL  42  -4.066   2.759   4.814
  340    HA   VAL  42           HA       VAL  42  -2.962   5.239   3.616
  341    HB   VAL  42           HB       VAL  42  -1.104   4.106   4.813
  342   1HG1  VAL  42          1HG2      VAL  42  -1.987   1.728   3.117
  343   2HG1  VAL  42          2HG2      VAL  42  -0.507   1.756   4.122
  344   3HG1  VAL  42          3HG2      VAL  42  -2.117   1.861   4.882
  345   1HG2  VAL  42          1HG1      VAL  42  -0.537   5.176   2.713
  346   2HG2  VAL  42          2HG1      VAL  42   0.449   3.717   2.996
  347   3HG2  VAL  42          3HG1      VAL  42  -0.906   3.660   1.843
  348    H    ASN  43           H        ASN  43  -2.263   4.800   1.352
  349    HA   ASN  43           HA       ASN  43  -4.405   3.548  -0.145
  350   1HB   ASN  43          1HB       ASN  43  -1.614   4.507  -0.918
  351   2HB   ASN  43          2HB       ASN  43  -2.827   3.940  -2.076
  352   1HD2  ASN  43          2HD2      ASN  43  -2.349   6.007  -3.041
  353   2HD2  ASN  43          1HD2      ASN  43  -3.207   7.444  -2.445
  354    H    ALA  44           H        ALA  44  -4.661   1.567   0.183
  355    HA   ALA  44           HA       ALA  44  -2.883  -0.509   0.676
  356   1HB   ALA  44          1HB       ALA  44  -5.472  -0.548  -0.941
  357   2HB   ALA  44          2HB       ALA  44  -4.691  -1.989  -0.260
  358   3HB   ALA  44          3HB       ALA  44  -5.349  -0.736   0.822
  359    H    LYS  45           H        LYS  45  -3.936   0.829  -2.394
  360    HA   LYS  45           HA       LYS  45  -2.445  -1.161  -3.975
  361   1HB   LYS  45          1HB       LYS  45  -3.456   0.053  -5.876
  362   2HB   LYS  45          2HB       LYS  45  -4.688  -0.472  -4.708
  363   1HG   LYS  45          1HG       LYS  45  -4.907   1.764  -3.816
  364   2HG   LYS  45          2HG       LYS  45  -3.407   2.282  -4.612
  365   1HD   LYS  45          1HD       LYS  45  -5.228   3.173  -5.876
  366   2HD   LYS  45          2HD       LYS  45  -4.471   1.887  -6.842
  367   1HE   LYS  45          1HE       LYS  45  -6.258   0.299  -6.008
  368   2HE   LYS  45          2HE       LYS  45  -7.069   1.676  -5.232
  369   1HZ   LYS  45          1HZ       LYS  45  -6.508   1.488  -8.106
  370   2HZ   LYS  45          2HZ       LYS  45  -7.951   1.152  -7.387
  371   3HZ   LYS  45          3HZ       LYS  45  -7.342   2.683  -7.328
  372    H    SER  46           H        SER  46  -1.609   1.713  -2.416
  373    HA   SER  46           HA       SER  46   0.161   2.643  -4.605
  374   1HB   SER  46          1HB       SER  46  -0.803   3.859  -1.995
  375   2HB   SER  46          2HB       SER  46   0.429   4.587  -3.025
  376    HG   SER  46           HG       SER  46  -1.288   4.394  -4.749
  377    H    ILE  47           H        ILE  47   2.178   3.451  -4.081
  378    HA   ILE  47           HA       ILE  47   4.171   2.064  -2.914
  379    HB   ILE  47           HB       ILE  47   4.662   3.959  -4.202
  380   1HG1  ILE  47          1HG1      ILE  47   6.180   3.612  -2.120
  381   2HG1  ILE  47          2HG1      ILE  47   6.312   5.129  -3.035
  382   1HG2  ILE  47          1HG2      ILE  47   2.598   5.242  -3.782
  383   2HG2  ILE  47          2HG2      ILE  47   3.241   5.727  -2.193
  384   3HG2  ILE  47          3HG2      ILE  47   4.052   6.261  -3.681
  385   1HD1  ILE  47          1HD1      ILE  47   4.799   6.257  -1.425
  386   2HD1  ILE  47          2HD1      ILE  47   4.727   4.774  -0.462
  387   3HD1  ILE  47          3HD1      ILE  47   6.268   5.639  -0.630
  388    H    MET  48           H        MET  48   2.480   4.709  -1.164
  389    HA   MET  48           HA       MET  48   3.829   4.203   1.284
  390   1HB   MET  48          1HB       MET  48   2.767   6.346   0.702
  391   2HB   MET  48          2HB       MET  48   1.174   5.568   0.741
  392   1HG   MET  48          1HG       MET  48   1.694   4.900   3.139
  393   2HG   MET  48          2HG       MET  48   3.118   5.946   3.055
  394   1HE   MET  48          1HE       MET  48   2.211   7.068   5.264
  395   2HE   MET  48          2HE       MET  48   0.598   7.805   5.423
  396   3HE   MET  48          3HE       MET  48   0.752   6.042   5.234
  397    H    GLY  49           H        GLY  49   1.119   2.521  -0.193
  398   1HA   GLY  49          1HA       GLY  49   0.243   1.421   2.370
  399   2HA   GLY  49          2HA       GLY  49  -0.319   0.931   0.741
  400    H    LEU  50           H        LEU  50   1.756   0.159  -0.682
  401    HA   LEU  50           HA       LEU  50   2.682  -2.320   0.191
  402   1HB   LEU  50          1HB       LEU  50   3.478  -0.291  -1.814
  403   2HB   LEU  50          2HB       LEU  50   4.790  -1.367  -1.287
  404    HG   LEU  50           HG       LEU  50   2.098  -2.481  -2.149
  405   1HD1  LEU  50          1HD1      LEU  50   2.923  -1.030  -3.971
  406   2HD1  LEU  50          2HD1      LEU  50   4.496  -1.862  -3.922
  407   3HD1  LEU  50          3HD1      LEU  50   3.035  -2.750  -4.416
  408   1HD2  LEU  50          1HD2      LEU  50   3.724  -3.997  -0.998
  409   2HD2  LEU  50          2HD2      LEU  50   3.492  -4.463  -2.699
  410   3HD2  LEU  50          3HD2      LEU  50   4.954  -3.581  -2.213
  411    H    MET  51           H        MET  51   4.805   0.556   0.016
  412    HA   MET  51           HA       MET  51   6.825  -0.816   1.461
  413   1HB   MET  51          1HB       MET  51   7.312   0.825  -0.310
  414   2HB   MET  51          2HB       MET  51   6.487   2.090   0.626
  415   1HG   MET  51          1HG       MET  51   8.173   1.722   2.463
  416   2HG   MET  51          2HG       MET  51   9.070   0.671   1.356
  417   1HE   MET  51          1HE       MET  51   7.016   3.739   0.231
  418   2HE   MET  51          2HE       MET  51   7.542   4.276   1.843
  419   3HE   MET  51          3HE       MET  51   8.166   5.092   0.388
  420    H    SER  52           H        SER  52   4.561   1.854   2.309
  421    HA   SER  52           HA       SER  52   5.871   2.173   4.872
  422   1HB   SER  52          1HB       SER  52   3.329   3.476   3.887
  423   2HB   SER  52          2HB       SER  52   4.382   4.034   5.210
  424    HG   SER  52           HG       SER  52   6.056   4.206   3.557
  425    H    LEU  53           H        LEU  53   2.314   1.797   4.371
  426    HA   LEU  53           HA       LEU  53   2.181   0.874   7.143
  427   1HB   LEU  53          1HB       LEU  53   0.041   1.391   5.096
  428   2HB   LEU  53          2HB       LEU  53  -0.231   0.827   6.753
  429    HG   LEU  53           HG       LEU  53  -0.451   3.142   6.904
  430   1HD1  LEU  53          1HD1      LEU  53   0.997   2.218   8.662
  431   2HD1  LEU  53          2HD1      LEU  53   2.428   2.520   7.644
  432   3HD1  LEU  53          3HD1      LEU  53   1.468   3.887   8.263
  433   1HD2  LEU  53          1HD2      LEU  53   0.522   3.663   4.668
  434   2HD2  LEU  53          2HD2      LEU  53   1.135   4.762   5.939
  435   3HD2  LEU  53          3HD2      LEU  53   2.147   3.421   5.347
  436    H    ALA  54           H        ALA  54   1.112  -0.445   4.030
  437    HA   ALA  54           HA       ALA  54   0.127  -2.944   4.977
  438   1HB   ALA  54          1HB       ALA  54  -0.623  -1.857   2.892
  439   2HB   ALA  54          2HB       ALA  54   1.011  -2.040   2.215
  440   3HB   ALA  54          3HB       ALA  54   0.034  -3.478   2.572
  441    H    VAL  55           H        VAL  55   3.404  -1.842   4.400
  442    HA   VAL  55           HA       VAL  55   4.513  -4.429   3.943
  443    HB   VAL  55           HB       VAL  55   5.585  -2.153   3.558
  444   1HG1  VAL  55          1HG1      VAL  55   5.121  -1.221   5.827
  445   2HG1  VAL  55          2HG1      VAL  55   6.197  -2.451   6.535
  446   3HG1  VAL  55          3HG1      VAL  55   6.854  -1.208   5.441
  447   1HG2  VAL  55          1HG2      VAL  55   6.792  -4.281   3.354
  448   2HG2  VAL  55          2HG2      VAL  55   7.845  -3.026   4.054
  449   3HG2  VAL  55          3HG2      VAL  55   7.122  -4.274   5.101
  450    H    SER  56           H        SER  56   2.939  -3.233   6.749
  451    HA   SER  56           HA       SER  56   4.707  -4.588   8.582
  452   1HB   SER  56          1HB       SER  56   1.897  -3.539   9.085
  453   2HB   SER  56          2HB       SER  56   3.153  -3.827  10.296
  454    HG   SER  56           HG       SER  56   3.146  -1.895   8.191
  455    H    THR  57           H        THR  57   4.526  -6.659   7.199
  456    HA   THR  57           HA       THR  57   2.490  -8.413   7.185
  457    HB   THR  57           HB       THR  57   5.163  -9.390   8.154
  458    HG1  THR  57           HG1      THR  57   5.862  -9.056   5.917
  459   1HG2  THR  57          1HG2      THR  57   4.682 -11.026   6.319
  460   2HG2  THR  57          2HG2      THR  57   3.355 -10.948   7.508
  461   3HG2  THR  57          3HG2      THR  57   3.193 -10.126   5.940
  462    H    GLY  58           H        GLY  58   1.085  -9.102   8.622
  463   1HA   GLY  58          1HA       GLY  58   0.536 -10.430  10.551
  464   2HA   GLY  58          2HA       GLY  58   1.977  -9.802  11.367
  465    H    THR  59           H        THR  59   0.629  -7.088   9.959
  466    HA   THR  59           HA       THR  59  -0.521  -6.363  12.584
  467    HB   THR  59           HB       THR  59  -0.270  -4.644  10.094
  468    HG1  THR  59           HG1      THR  59   1.749  -5.485  10.749
  469   1HG2  THR  59          1HG2      THR  59  -0.265  -2.787  11.722
  470   2HG2  THR  59          2HG2      THR  59  -1.744  -3.764  11.884
  471   3HG2  THR  59          3HG2      THR  59  -0.419  -3.950  13.056
  472    H    GLU  60           H        GLU  60  -2.762  -6.154  12.973
  473    HA   GLU  60           HA       GLU  60  -4.516  -7.016  10.802
  474   1HB   GLU  60          1HB       GLU  60  -5.437  -5.778  13.404
  475   2HB   GLU  60          2HB       GLU  60  -6.291  -6.912  12.315
  476   1HG   GLU  60          1HG       GLU  60  -3.792  -7.635  13.891
  477   2HG   GLU  60          2HG       GLU  60  -5.453  -8.016  14.392
  478    H    VAL  61           H        VAL  61  -4.764  -5.701   9.163
  479    HA   VAL  61           HA       VAL  61  -5.182  -2.807   9.719
  480    HB   VAL  61           HB       VAL  61  -3.875  -2.321   7.688
  481   1HG1  VAL  61          1HG1      VAL  61  -2.666  -2.610   9.888
  482   2HG1  VAL  61          2HG1      VAL  61  -2.439  -4.326   9.488
  483   3HG1  VAL  61          3HG1      VAL  61  -1.662  -3.073   8.491
  484   1HG2  VAL  61          1HG2      VAL  61  -4.377  -4.453   6.483
  485   2HG2  VAL  61          2HG2      VAL  61  -2.625  -4.116   6.580
  486   3HG2  VAL  61          3HG2      VAL  61  -3.358  -5.324   7.668
  487    H    THR  62           H        THR  62  -6.912  -1.892   8.779
  488    HA   THR  62           HA       THR  62  -8.820  -3.646   7.514
  489    HB   THR  62           HB       THR  62  -9.075  -0.648   7.635
  490    HG1  THR  62           HG1      THR  62  -9.464  -0.727   9.742
  491   1HG2  THR  62          1HG2      THR  62 -11.445  -1.302   8.235
  492   2HG2  THR  62          2HG2      THR  62 -10.953  -1.924   6.651
  493   3HG2  THR  62          3HG2      THR  62 -10.967  -3.001   8.067
  494    H    LEU  63           H        LEU  63  -8.922  -4.147   5.355
  495    HA   LEU  63           HA       LEU  63  -7.554  -2.426   3.440
  496   1HB   LEU  63          1HB       LEU  63  -8.949  -5.124   3.398
  497   2HB   LEU  63          2HB       LEU  63  -8.570  -4.218   1.920
  498    HG   LEU  63           HG       LEU  63  -6.236  -3.842   3.129
  499   1HD1  LEU  63          1HD1      LEU  63  -7.236  -6.493   4.259
  500   2HD1  LEU  63          2HD1      LEU  63  -5.570  -5.868   4.395
  501   3HD1  LEU  63          3HD1      LEU  63  -6.912  -5.012   5.193
  502   1HD2  LEU  63          1HD2      LEU  63  -6.692  -4.899   0.940
  503   2HD2  LEU  63          2HD2      LEU  63  -5.357  -5.676   1.820
  504   3HD2  LEU  63          3HD2      LEU  63  -6.961  -6.450   1.771
  505    H    ILE  64           H        ILE  64  -8.461  -0.759   2.746
  506    HA   ILE  64           HA       ILE  64 -11.417  -0.472   2.680
  507    HB   ILE  64           HB       ILE  64  -9.342   1.665   2.082
  508   1HG1  ILE  64          1HG1      ILE  64 -10.404   0.908   4.817
  509   2HG1  ILE  64          2HG1      ILE  64  -8.707   0.882   4.289
  510   1HG2  ILE  64          1HG2      ILE  64 -12.190   1.759   3.143
  511   2HG2  ILE  64          2HG2      ILE  64 -11.149   3.176   2.863
  512   3HG2  ILE  64          3HG2      ILE  64 -11.666   2.164   1.492
  513   1HD1  ILE  64          1HD1      ILE  64 -10.542   3.315   4.442
  514   2HD1  ILE  64          2HD1      ILE  64  -9.249   2.920   5.599
  515   3HD1  ILE  64          3HD1      ILE  64  -8.842   3.353   3.911
  516    H    ALA  65           H        ALA  65 -12.337   0.499   0.816
  517    HA   ALA  65           HA       ALA  65 -10.759   1.052  -1.515
  518   1HB   ALA  65          1HB       ALA  65 -12.965  -1.037  -1.671
  519   2HB   ALA  65          2HB       ALA  65 -12.160  -0.289  -3.065
  520   3HB   ALA  65          3HB       ALA  65 -11.242  -1.351  -1.973
  521    H    GLN  66           H        GLN  66 -11.391   2.999  -1.750
  522    HA   GLN  66           HA       GLN  66 -14.288   3.479  -1.429
  523   1HB   GLN  66          1HB       GLN  66 -13.007   4.528   0.344
  524   2HB   GLN  66          2HB       GLN  66 -11.828   5.180  -0.777
  525   1HG   GLN  66          1HG       GLN  66 -14.604   5.973  -1.362
  526   2HG   GLN  66          2HG       GLN  66 -14.049   6.467   0.256
  527   1HE2  GLN  66          2HE2      GLN  66 -11.519   7.180   0.087
  528   2HE2  GLN  66          1HE2      GLN  66 -11.195   8.373  -1.164
  529    H    GLY  67           H        GLY  67 -14.301   2.600  -3.473
  530   1HA   GLY  67          1HA       GLY  67 -13.907   4.598  -5.641
  531   2HA   GLY  67          2HA       GLY  67 -13.235   2.981  -5.784
  532    H    GLU  68           H        GLU  68 -14.512   2.716  -7.558
  533    HA   GLU  68           HA       GLU  68 -17.374   2.372  -7.440
  534   1HB   GLU  68          1HB       GLU  68 -15.099   1.421  -9.212
  535   2HB   GLU  68          2HB       GLU  68 -16.803   1.107  -9.611
  536   1HG   GLU  68          1HG       GLU  68 -15.513   3.846  -9.174
  537   2HG   GLU  68          2HG       GLU  68 -15.941   3.163 -10.757
  538    H    ASP  69           H        ASP  69 -14.494   0.151  -7.146
  539    HA   ASP  69           HA       ASP  69 -16.387  -2.031  -6.317
  540   1HB   ASP  69          1HB       ASP  69 -13.428  -2.271  -6.649
  541   2HB   ASP  69          2HB       ASP  69 -14.654  -3.534  -6.657
  542    H    GLU  70           H        GLU  70 -16.515   0.043  -4.500
  543    HA   GLU  70           HA       GLU  70 -14.170   0.143  -2.885
  544   1HB   GLU  70          1HB       GLU  70 -15.417   1.514  -1.462
  545   2HB   GLU  70          2HB       GLU  70 -15.835   1.972  -3.113
  546   1HG   GLU  70          1HG       GLU  70 -17.606   0.324  -1.278
  547   2HG   GLU  70          2HG       GLU  70 -17.735   2.069  -1.559
  548    H    GLN  71           H        GLN  71 -17.425  -1.203  -2.286
  549    HA   GLN  71           HA       GLN  71 -16.790  -2.687   0.000
  550   1HB   GLN  71          1HB       GLN  71 -19.070  -2.201  -0.885
  551   2HB   GLN  71          2HB       GLN  71 -18.799  -3.380  -2.189
  552   1HG   GLN  71          1HG       GLN  71 -20.087  -4.324  -0.262
  553   2HG   GLN  71          2HG       GLN  71 -18.551  -5.181  -0.524
  554   1HE2  GLN  71          2HE2      GLN  71 -16.749  -4.745   0.874
  555   2HE2  GLN  71          1HE2      GLN  71 -17.005  -3.972   2.456
  556    H    GLU  72           H        GLU  72 -16.554  -3.551  -3.436
  557    HA   GLU  72           HA       GLU  72 -15.971  -6.316  -3.089
  558   1HB   GLU  72          1HB       GLU  72 -16.807  -5.445  -5.220
  559   2HB   GLU  72          2HB       GLU  72 -15.517  -4.218  -5.263
  560   1HG   GLU  72          1HG       GLU  72 -15.002  -5.946  -6.829
  561   2HG   GLU  72          2HG       GLU  72 -13.817  -5.949  -5.516
  562    H    ALA  73           H        ALA  73 -13.906  -3.436  -3.803
  563    HA   ALA  73           HA       ALA  73 -11.481  -4.859  -4.020
  564   1HB   ALA  73          1HB       ALA  73 -12.257  -2.039  -3.247
  565   2HB   ALA  73          2HB       ALA  73 -10.580  -2.507  -3.677
  566   3HB   ALA  73          3HB       ALA  73 -11.921  -2.623  -4.868
  567    H    LEU  74           H        LEU  74 -12.849  -2.932  -1.327
  568    HA   LEU  74           HA       LEU  74 -10.780  -3.341   0.510
  569   1HB   LEU  74          1HB       LEU  74 -12.427  -2.567   2.134
  570   2HB   LEU  74          2HB       LEU  74 -12.632  -1.729   0.569
  571    HG   LEU  74           HG       LEU  74 -14.313  -3.655   0.053
  572   1HD1  LEU  74          1HD1      LEU  74 -13.805  -4.859   2.174
  573   2HD1  LEU  74          2HD1      LEU  74 -14.483  -3.470   3.082
  574   3HD1  LEU  74          3HD1      LEU  74 -15.518  -4.429   1.993
  575   1HD2  LEU  74          1HD2      LEU  74 -14.859  -1.287   0.130
  576   2HD2  LEU  74          2HD2      LEU  74 -16.140  -2.253   0.878
  577   3HD2  LEU  74          3HD2      LEU  74 -14.995  -1.342   1.900
  578    H    GLU  75           H        GLU  75 -13.729  -5.398  -0.003
  579    HA   GLU  75           HA       GLU  75 -12.936  -7.150   2.122
  580   1HB   GLU  75          1HB       GLU  75 -14.803  -8.559   1.364
  581   2HB   GLU  75          2HB       GLU  75 -15.275  -6.858   1.562
  582   1HG   GLU  75          1HG       GLU  75 -15.095  -6.505  -0.863
  583   2HG   GLU  75          2HG       GLU  75 -14.563  -8.181  -1.088
  584    H    LYS  76           H        LYS  76 -12.560  -7.488  -1.507
  585    HA   LYS  76           HA       LYS  76 -11.669 -10.212  -1.006
  586   1HB   LYS  76          1HB       LYS  76 -11.738 -10.561  -3.194
  587   2HB   LYS  76          2HB       LYS  76 -12.793  -9.135  -3.136
  588   1HG   LYS  76          1HG       LYS  76 -11.110  -7.742  -4.056
  589   2HG   LYS  76          2HG       LYS  76  -9.825  -8.968  -3.747
  590   1HD   LYS  76          1HD       LYS  76 -11.240 -10.557  -5.204
  591   2HD   LYS  76          2HD       LYS  76 -12.146  -9.129  -5.713
  592   1HE   LYS  76          1HE       LYS  76 -10.415  -9.550  -7.370
  593   2HE   LYS  76          2HE       LYS  76  -9.873  -8.135  -6.450
  594   1HZ   LYS  76          1HZ       LYS  76  -9.034 -10.920  -6.003
  595   2HZ   LYS  76          2HZ       LYS  76  -8.149  -9.761  -6.767
  596   3HZ   LYS  76          3HZ       LYS  76  -8.492  -9.610  -5.161
  597    H    LEU  77           H        LEU  77 -10.232  -7.037  -1.455
  598    HA   LEU  77           HA       LEU  77  -7.498  -7.840  -1.517
  599   1HB   LEU  77          1HB       LEU  77  -8.977  -5.343  -0.657
  600   2HB   LEU  77          2HB       LEU  77  -7.228  -5.541  -0.356
  601    HG   LEU  77           HG       LEU  77  -7.478  -4.428  -2.528
  602   1HD1  LEU  77          1HD2      LEU  77  -5.743  -6.191  -2.135
  603   2HD1  LEU  77          2HD2      LEU  77  -6.915  -7.393  -2.764
  604   3HD1  LEU  77          3HD2      LEU  77  -6.298  -6.118  -3.848
  605   1HD2  LEU  77          1HD1      LEU  77  -8.951  -6.973  -3.329
  606   2HD2  LEU  77          2HD1      LEU  77  -9.708  -5.361  -3.225
  607   3HD2  LEU  77          3HD1      LEU  77  -8.428  -5.680  -4.436
  608    H    ALA  78           H        ALA  78  -9.598  -6.891   1.322
  609    HA   ALA  78           HA       ALA  78  -7.622  -7.508   3.239
  610   1HB   ALA  78          1HB       ALA  78  -9.667  -6.224   3.733
  611   2HB   ALA  78          2HB       ALA  78 -10.642  -7.696   3.501
  612   3HB   ALA  78          3HB       ALA  78  -9.474  -7.594   4.839
  613    H    ALA  79           H        ALA  79  -9.923  -9.657   1.537
  614    HA   ALA  79           HA       ALA  79  -9.450 -11.978   3.142
  615   1HB   ALA  79          1HB       ALA  79 -11.262 -11.765   1.442
  616   2HB   ALA  79          2HB       ALA  79 -10.024 -11.705   0.160
  617   3HB   ALA  79          3HB       ALA  79 -10.232 -13.184   1.127
  618    H    TYR  80           H        TYR  80  -7.961 -10.773   0.124
  619    HA   TYR  80           HA       TYR  80  -6.085 -12.839  -0.260
  620   1HB   TYR  80          1HB       TYR  80  -6.870 -11.142  -1.885
  621   2HB   TYR  80          2HB       TYR  80  -5.978  -9.900  -1.002
  622    HD1  TYR  80           HD1      TYR  80  -5.155 -13.356  -2.259
  623    HD2  TYR  80           HD2      TYR  80  -3.963  -9.237  -1.893
  624    HE1  TYR  80           HE1      TYR  80  -2.922 -13.919  -3.190
  625    HE2  TYR  80           HE2      TYR  80  -1.712  -9.814  -2.813
  626    HH   TYR  80           HH       TYR  80  -0.814 -13.173  -3.556
  627    H    VAL  81           H        VAL  81  -5.582  -9.610   1.162
  628    HA   VAL  81           HA       VAL  81  -2.855  -9.690   1.639
  629    HB   VAL  81           HB       VAL  81  -3.280  -7.948   3.323
  630   1HG1  VAL  81          1HG2      VAL  81  -3.385  -7.501   0.886
  631   2HG1  VAL  81          2HG2      VAL  81  -5.125  -7.882   0.912
  632   3HG1  VAL  81          3HG2      VAL  81  -4.516  -6.458   1.795
  633   1HG2  VAL  81          1HG1      VAL  81  -6.186  -8.811   2.938
  634   2HG2  VAL  81          2HG1      VAL  81  -5.222  -9.037   4.404
  635   3HG2  VAL  81          3HG1      VAL  81  -5.656  -7.394   3.883
  636    H    GLN  82           H        GLN  82  -5.413 -11.033   3.762
  637    HA   GLN  82           HA       GLN  82  -3.358 -11.689   5.771
  638   1HB   GLN  82          1HB       GLN  82  -5.344 -12.352   7.081
  639   2HB   GLN  82          2HB       GLN  82  -5.638 -10.767   6.318
  640   1HG   GLN  82          1HG       GLN  82  -6.837 -11.940   4.452
  641   2HG   GLN  82          2HG       GLN  82  -6.374 -13.466   5.183
  642   1HE2  GLN  82          2HE2      GLN  82  -8.639 -10.998   5.097
  643   2HE2  GLN  82          1HE2      GLN  82  -9.739 -11.588   6.358
  644    H    GLU  83           H        GLU  83  -4.385 -13.068   2.923
  645    HA   GLU  83           HA       GLU  83  -5.174 -15.689   3.783
  646   1HB   GLU  83          1HB       GLU  83  -6.241 -14.317   2.071
  647   2HB   GLU  83          2HB       GLU  83  -4.761 -14.325   1.104
  648   1HG   GLU  83          1HG       GLU  83  -4.948 -16.794   0.833
  649   2HG   GLU  83          2HG       GLU  83  -6.496 -16.746   1.710
  650    H    GLU  84           H        GLU  84  -2.606 -14.772   1.358
  651    HA   GLU  84           HA       GLU  84  -1.783 -17.596   1.542
  652   1HB   GLU  84          1HB       GLU  84  -0.370 -17.084  -0.378
  653   2HB   GLU  84          2HB       GLU  84  -2.084 -16.672  -0.697
  654   1HG   GLU  84          1HG       GLU  84  -1.636 -14.316  -0.322
  655   2HG   GLU  84          2HG       GLU  84  -0.093 -14.751   0.458
  656    H    VAL  85           H        VAL  85  -1.223 -16.846   3.722
  657    HA   VAL  85           HA       VAL  85   0.408 -15.743   5.175
  658    HB   VAL  85           HB       VAL  85  -0.225 -18.019   5.832
  659   1HG1  VAL  85          1HG1      VAL  85   1.965 -19.211   3.989
  660   2HG1  VAL  85          2HG1      VAL  85   0.996 -20.120   5.176
  661   3HG1  VAL  85          3HG1      VAL  85   0.207 -19.397   3.786
  662   1HG2  VAL  85          1HG2      VAL  85   1.720 -17.084   7.163
  663   2HG2  VAL  85          2HG2      VAL  85   1.745 -18.850   7.098
  664   3HG2  VAL  85          3HG2      VAL  85   2.863 -17.910   6.077
  Start of MODEL   12
    1   1H    VAL   2          1H        VAL   2 -16.395   6.320  -2.041
    2   2H    VAL   2          2H        VAL   2 -16.847   5.003  -2.984
    3   3H    VAL   2          3H        VAL   2 -17.868   6.332  -2.851
    4    HA   VAL   2           HA       VAL   2 -18.196   5.918  -0.533
    5    HB   VAL   2           HB       VAL   2 -18.616   3.412  -2.206
    6   1HG1  VAL   2          1HG2      VAL   2 -20.240   4.663   0.053
    7   2HG1  VAL   2          2HG2      VAL   2 -20.670   3.192  -0.852
    8   3HG1  VAL   2          3HG2      VAL   2 -19.225   3.203   0.187
    9   1HG2  VAL   2          1HG1      VAL   2 -19.349   5.423  -3.456
   10   2HG2  VAL   2          2HG1      VAL   2 -20.735   4.440  -2.933
   11   3HG2  VAL   2          3HG1      VAL   2 -20.324   5.932  -2.053
   12    H    GLN   3           H        GLN   3 -17.122   5.253   1.319
   13    HA   GLN   3           HA       GLN   3 -14.890   3.395   0.790
   14   1HB   GLN   3          1HB       GLN   3 -14.316   5.672   1.556
   15   2HB   GLN   3          2HB       GLN   3 -15.220   5.386   3.064
   16   1HG   GLN   3          1HG       GLN   3 -13.747   3.446   3.561
   17   2HG   GLN   3          2HG       GLN   3 -12.885   3.717   2.030
   18   1HE2  GLN   3          2HE2      GLN   3 -13.773   5.514   5.045
   19   2HE2  GLN   3          1HE2      GLN   3 -12.235   6.356   5.128
   20    H    GLN   4           H        GLN   4 -14.839   1.441   1.553
   21    HA   GLN   4           HA       GLN   4 -16.031   0.841   4.174
   22   1HB   GLN   4          1HB       GLN   4 -17.654  -0.051   2.626
   23   2HB   GLN   4          2HB       GLN   4 -16.372  -0.726   1.597
   24   1HG   GLN   4          1HG       GLN   4 -17.427  -2.508   2.836
   25   2HG   GLN   4          2HG       GLN   4 -15.755  -2.299   3.395
   26   1HE2  GLN   4          2HE2      GLN   4 -18.755  -3.007   4.437
   27   2HE2  GLN   4          1HE2      GLN   4 -18.710  -2.297   6.054
   28    H    LYS   5           H        LYS   5 -14.827  -0.956   5.168
   29    HA   LYS   5           HA       LYS   5 -12.320  -1.812   3.912
   30   1HB   LYS   5          1HB       LYS   5 -11.062  -0.876   5.925
   31   2HB   LYS   5          2HB       LYS   5 -11.645   0.298   4.726
   32   1HG   LYS   5          1HG       LYS   5 -13.730   0.561   6.185
   33   2HG   LYS   5          2HG       LYS   5 -12.828  -0.287   7.458
   34   1HD   LYS   5          1HD       LYS   5 -11.011   1.428   7.262
   35   2HD   LYS   5          2HD       LYS   5 -11.928   2.230   5.972
   36   1HE   LYS   5          1HE       LYS   5 -12.284   3.420   8.059
   37   2HE   LYS   5          2HE       LYS   5 -13.798   2.613   7.607
   38   1HZ   LYS   5          1HZ       LYS   5 -11.816   1.622   9.541
   39   2HZ   LYS   5          2HZ       LYS   5 -13.261   2.325   9.918
   40   3HZ   LYS   5          3HZ       LYS   5 -13.230   0.864   9.153
   41    H    VAL   6           H        VAL   6 -11.721  -3.768   4.649
   42    HA   VAL   6           HA       VAL   6 -13.074  -4.707   7.139
   43    HB   VAL   6           HB       VAL   6 -12.963  -7.006   6.189
   44   1HG1  VAL   6          1HG1      VAL   6 -15.017  -5.615   6.112
   45   2HG1  VAL   6          2HG1      VAL   6 -14.524  -5.004   4.513
   46   3HG1  VAL   6          3HG1      VAL   6 -14.910  -6.731   4.728
   47   1HG2  VAL   6          1HG2      VAL   6 -11.196  -6.610   4.492
   48   2HG2  VAL   6          2HG2      VAL   6 -12.663  -7.317   3.777
   49   3HG2  VAL   6          3HG2      VAL   6 -12.317  -5.581   3.572
   50    H    GLU   7           H        GLU   7 -11.570  -4.922   8.754
   51    HA   GLU   7           HA       GLU   7  -8.771  -4.891   7.843
   52   1HB   GLU   7          1HB       GLU   7  -8.210  -4.517  10.225
   53   2HB   GLU   7          2HB       GLU   7  -9.407  -3.342   9.653
   54   1HG   GLU   7          1HG       GLU   7 -10.221  -3.970  11.748
   55   2HG   GLU   7          2HG       GLU   7 -11.156  -5.023  10.662
   56    H    VAL   8           H        VAL   8  -7.185  -6.276   8.355
   57    HA   VAL   8           HA       VAL   8  -7.961  -8.940   9.363
   58    HB   VAL   8           HB       VAL   8  -7.158 -10.062   7.379
   59   1HG1  VAL   8          1HG2      VAL   8  -8.670  -7.569   6.472
   60   2HG1  VAL   8          2HG2      VAL   8  -8.345  -8.986   5.438
   61   3HG1  VAL   8          3HG2      VAL   8  -9.386  -9.161   6.876
   62   1HG2  VAL   8          1HG1      VAL   8  -5.186  -8.636   7.039
   63   2HG2  VAL   8          2HG1      VAL   8  -6.094  -8.870   5.525
   64   3HG2  VAL   8          3HG1      VAL   8  -6.247  -7.333   6.424
   65    H    ARG   9           H        ARG   9  -5.695 -10.284   9.475
   66    HA   ARG   9           HA       ARG   9  -3.723  -8.282  10.428
   67   1HB   ARG   9          1HB       ARG   9  -3.940 -10.177  11.938
   68   2HB   ARG   9          2HB       ARG   9  -3.754 -11.308  10.559
   69   1HG   ARG   9          1HG       ARG   9  -1.477  -9.922  10.257
   70   2HG   ARG   9          2HG       ARG   9  -1.669  -9.756  12.017
   71   1HD   ARG   9          1HD       ARG   9  -0.417 -11.850  11.260
   72   2HD   ARG   9          2HD       ARG   9  -1.869 -12.218  12.198
   73    HE   ARG   9           HE       ARG   9  -1.516 -12.540   9.256
   74   1HH1  ARG   9          1HH2      ARG   9  -3.495 -12.953  12.143
   75   2HH1  ARG   9          2HH2      ARG   9  -4.677 -13.973  11.376
   76   1HH2  ARG   9          2HH1      ARG   9  -3.150 -13.893   8.176
   77   2HH2  ARG   9          1HH1      ARG   9  -4.442 -14.522   9.128
   78    H    LEU  10           H        LEU  10  -2.178  -7.664   9.198
   79    HA   LEU  10           HA       LEU  10  -1.984  -8.370   6.448
   80   1HB   LEU  10          1HB       LEU  10  -1.531  -6.172   7.508
   81   2HB   LEU  10          2HB       LEU  10  -0.122  -6.869   8.335
   82    HG   LEU  10           HG       LEU  10   0.973  -7.292   6.217
   83   1HD1  LEU  10          1HD1      LEU  10  -1.545  -6.114   4.948
   84   2HD1  LEU  10          2HD1      LEU  10  -0.046  -6.538   4.089
   85   3HD1  LEU  10          3HD1      LEU  10  -1.029  -7.815   4.843
   86   1HD2  LEU  10          1HD2      LEU  10   1.101  -5.076   7.344
   87   2HD2  LEU  10          2HD2      LEU  10   1.290  -4.950   5.577
   88   3HD2  LEU  10          3HD2      LEU  10  -0.260  -4.503   6.339
   89    H    LYS  11           H        LYS  11  -1.791 -10.755   6.888
   90    HA   LYS  11           HA       LYS  11   0.501 -11.944   8.118
   91   1HB   LYS  11          1HB       LYS  11  -1.392 -13.371   7.729
   92   2HB   LYS  11          2HB       LYS  11  -1.581 -12.782   6.068
   93   1HG   LYS  11          1HG       LYS  11   0.849 -13.858   5.758
   94   2HG   LYS  11          2HG       LYS  11   0.056 -15.011   6.902
   95   1HD   LYS  11          1HD       LYS  11  -0.761 -15.447   4.606
   96   2HD   LYS  11          2HD       LYS  11  -2.053 -14.714   5.599
   97   1HE   LYS  11          1HE       LYS  11  -1.543 -12.488   4.724
   98   2HE   LYS  11          2HE       LYS  11  -0.254 -13.180   3.669
   99   1HZ   LYS  11          1HZ       LYS  11  -1.919 -14.466   2.612
  100   2HZ   LYS  11          2HZ       LYS  11  -3.105 -13.662   3.440
  101   3HZ   LYS  11          3HZ       LYS  11  -2.134 -12.846   2.406
  102    H    THR  12           H        THR  12  -0.272 -11.092   4.771
  103    HA   THR  12           HA       THR  12   2.109 -11.889   3.494
  104    HB   THR  12           HB       THR  12   0.544  -9.318   2.957
  105    HG1  THR  12           HG1      THR  12  -0.913 -11.010   3.031
  106   1HG2  THR  12          1HG2      THR  12   1.195  -9.690   0.615
  107   2HG2  THR  12          2HG2      THR  12   2.606  -9.493   1.682
  108   3HG2  THR  12          3HG2      THR  12   2.139 -11.111   1.112
  109    H    GLY  13           H        GLY  13   1.360  -9.043   5.534
  110   1HA   GLY  13          1HA       GLY  13   2.737  -7.213   6.190
  111   2HA   GLY  13          2HA       GLY  13   4.126  -8.037   5.431
  112    H    LEU  14           H        LEU  14   3.870  -8.234   3.020
  113    HA   LEU  14           HA       LEU  14   3.081  -7.405   0.910
  114   1HB   LEU  14          1HB       LEU  14   2.206  -5.167   2.685
  115   2HB   LEU  14          2HB       LEU  14   2.687  -4.721   1.077
  116    HG   LEU  14           HG       LEU  14   0.961  -6.183   0.110
  117   1HD1  LEU  14          1HD2      LEU  14   0.362  -6.978   2.988
  118   2HD1  LEU  14          2HD2      LEU  14  -0.604  -7.434   1.563
  119   3HD1  LEU  14          3HD2      LEU  14   1.061  -8.039   1.742
  120   1HD2  LEU  14          1HD1      LEU  14   0.357  -3.913   0.937
  121   2HD2  LEU  14          2HD1      LEU  14  -1.016  -5.042   1.068
  122   3HD2  LEU  14          3HD1      LEU  14  -0.065  -4.618   2.514
  123    H    GLN  15           H        GLN  15   5.258  -8.062   0.878
  124    HA   GLN  15           HA       GLN  15   7.270  -6.019   1.630
  125   1HB   GLN  15          1HB       GLN  15   7.822  -8.832   0.650
  126   2HB   GLN  15          2HB       GLN  15   8.861  -7.770   1.631
  127   1HG   GLN  15          1HG       GLN  15   6.320  -9.212   2.455
  128   2HG   GLN  15          2HG       GLN  15   7.961  -9.514   3.064
  129   1HE2  GLN  15          2HE2      GLN  15   5.387  -8.801   4.463
  130   2HE2  GLN  15          1HE2      GLN  15   5.757  -7.310   5.348
  131    H    ALA  16           H        ALA  16   6.175  -8.176  -1.054
  132    HA   ALA  16           HA       ALA  16   6.784  -5.994  -2.860
  133   1HB   ALA  16          1HB       ALA  16   9.044  -6.854  -2.548
  134   2HB   ALA  16          2HB       ALA  16   8.513  -8.467  -3.092
  135   3HB   ALA  16          3HB       ALA  16   8.488  -7.095  -4.223
  136    H    ARG  17           H        ARG  17   7.234  -8.975  -4.371
  137    HA   ARG  17           HA       ARG  17   5.561  -8.680  -6.441
  138   1HB   ARG  17          1HB       ARG  17   6.269 -11.231  -4.975
  139   2HB   ARG  17          2HB       ARG  17   5.676 -11.155  -6.650
  140   1HG   ARG  17          1HG       ARG  17   7.733 -10.708  -7.402
  141   2HG   ARG  17          2HG       ARG  17   7.878  -9.299  -6.335
  142   1HD   ARG  17          1HD       ARG  17   8.367 -12.163  -5.385
  143   2HD   ARG  17          2HD       ARG  17   9.638 -11.136  -6.055
  144    HE   ARG  17           HE       ARG  17   9.591  -9.754  -4.178
  145   1HH1  ARG  17          1HH2      ARG  17   7.261 -12.463  -3.844
  146   2HH1  ARG  17          2HH2      ARG  17   6.866 -11.962  -2.186
  147   1HH2  ARG  17          2HH1      ARG  17   9.111  -9.411  -1.861
  148   2HH2  ARG  17          1HH1      ARG  17   7.809 -10.394  -1.183
  149    HA   PRO  18           HA       PRO  18   1.885 -11.193  -4.802
  150   1HB   PRO  18          1HB       PRO  18   1.788 -12.112  -2.248
  151   2HB   PRO  18          2HB       PRO  18   2.913 -12.890  -3.416
  152   1HG   PRO  18          1HG       PRO  18   3.564 -10.549  -1.565
  153   2HG   PRO  18          2HG       PRO  18   4.438 -12.090  -1.556
  154   1HD   PRO  18          1HD       PRO  18   5.398 -10.130  -2.994
  155   2HD   PRO  18          2HD       PRO  18   5.282 -11.742  -3.752
  156    H    ALA  19           H        ALA  19   3.319  -8.970  -2.474
  157    HA   ALA  19           HA       ALA  19   0.843  -8.059  -1.321
  158   1HB   ALA  19          1HB       ALA  19   3.047  -8.126  -0.282
  159   2HB   ALA  19          2HB       ALA  19   3.662  -7.030  -1.552
  160   3HB   ALA  19          3HB       ALA  19   2.428  -6.438  -0.376
  161    H    ALA  20           H        ALA  20   2.982  -7.070  -3.964
  162    HA   ALA  20           HA       ALA  20   1.492  -4.581  -4.577
  163   1HB   ALA  20          1HB       ALA  20   3.557  -6.209  -6.158
  164   2HB   ALA  20          2HB       ALA  20   2.925  -4.606  -6.610
  165   3HB   ALA  20          3HB       ALA  20   3.912  -4.788  -5.142
  166    H    LEU  21           H        LEU  21   1.546  -8.051  -5.436
  167    HA   LEU  21           HA       LEU  21  -0.451  -8.014  -7.450
  168   1HB   LEU  21          1HB       LEU  21   0.867  -9.972  -6.383
  169   2HB   LEU  21          2HB       LEU  21  -0.367  -9.970  -5.124
  170    HG   LEU  21           HG       LEU  21  -0.984 -10.280  -8.094
  171   1HD1  LEU  21          1HD1      LEU  21  -0.749 -12.344  -5.862
  172   2HD1  LEU  21          2HD1      LEU  21  -1.299 -12.674  -7.524
  173   3HD1  LEU  21          3HD1      LEU  21   0.375 -12.148  -7.228
  174   1HD2  LEU  21          1HD2      LEU  21  -2.639 -10.734  -5.570
  175   2HD2  LEU  21          2HD2      LEU  21  -2.876  -9.421  -6.749
  176   3HD2  LEU  21          3HD2      LEU  21  -3.168 -11.110  -7.226
  177    H    PHE  22           H        PHE  22  -0.650  -8.142  -3.889
  178    HA   PHE  22           HA       PHE  22  -3.434  -7.797  -3.521
  179   1HB   PHE  22          1HB       PHE  22  -2.125  -8.206  -1.573
  180   2HB   PHE  22          2HB       PHE  22  -0.982  -6.925  -2.015
  181    HD1  PHE  22           HD1      PHE  22  -1.031  -4.852  -1.167
  182    HD2  PHE  22           HD2      PHE  22  -4.593  -7.269  -0.957
  183    HE1  PHE  22           HE1      PHE  22  -2.250  -2.962  -0.115
  184    HE2  PHE  22           HE2      PHE  22  -5.730  -5.462   0.309
  185    HZ   PHE  22           HZ       PHE  22  -4.573  -3.303   0.711
  186    H    VAL  23           H        VAL  23  -1.003  -5.088  -3.467
  187    HA   VAL  23           HA       VAL  23  -2.823  -3.044  -3.421
  188    HB   VAL  23           HB       VAL  23  -1.179  -1.599  -4.157
  189   1HG1  VAL  23          1HG1      VAL  23  -0.527  -2.382  -2.007
  190   2HG1  VAL  23          2HG1      VAL  23   0.484  -3.657  -2.746
  191   3HG1  VAL  23          3HG1      VAL  23   0.849  -1.941  -3.005
  192   1HG2  VAL  23          1HG2      VAL  23  -0.880  -2.557  -6.239
  193   2HG2  VAL  23          2HG2      VAL  23   0.682  -2.076  -5.544
  194   3HG2  VAL  23          3HG2      VAL  23   0.176  -3.814  -5.589
  195    H    GLN  24           H        GLN  24  -1.644  -4.781  -6.323
  196    HA   GLN  24           HA       GLN  24  -3.012  -3.027  -8.138
  197   1HB   GLN  24          1HB       GLN  24  -2.226  -4.444  -9.895
  198   2HB   GLN  24          2HB       GLN  24  -0.939  -4.115  -8.724
  199   1HG   GLN  24          1HG       GLN  24  -0.615  -6.344  -9.148
  200   2HG   GLN  24          2HG       GLN  24  -1.629  -6.417  -7.693
  201   1HE2  GLN  24          2HE2      GLN  24  -3.371  -7.684  -7.830
  202   2HE2  GLN  24          1HE2      GLN  24  -4.151  -8.286  -9.289
  203    H    GLU  25           H        GLU  25  -4.053  -5.832  -6.319
  204    HA   GLU  25           HA       GLU  25  -6.347  -6.387  -8.038
  205   1HB   GLU  25          1HB       GLU  25  -5.683  -6.936  -5.097
  206   2HB   GLU  25          2HB       GLU  25  -7.187  -7.497  -5.874
  207   1HG   GLU  25          1HG       GLU  25  -4.426  -8.226  -6.870
  208   2HG   GLU  25          2HG       GLU  25  -5.337  -9.209  -5.705
  209    H    ALA  26           H        ALA  26  -5.719  -4.865  -4.917
  210    HA   ALA  26           HA       ALA  26  -8.080  -3.419  -4.404
  211   1HB   ALA  26          1HB       ALA  26  -5.174  -2.570  -4.145
  212   2HB   ALA  26          2HB       ALA  26  -6.539  -1.825  -3.275
  213   3HB   ALA  26          3HB       ALA  26  -6.073  -3.515  -2.923
  214    H    ASN  27           H        ASN  27  -5.256  -2.587  -6.331
  215    HA   ASN  27           HA       ASN  27  -5.873  -0.114  -7.405
  216   1HB   ASN  27          1HB       ASN  27  -4.032  -2.292  -7.684
  217   2HB   ASN  27          2HB       ASN  27  -4.565  -1.868  -9.312
  218   1HD2  ASN  27          2HD2      ASN  27  -2.786  -0.916  -6.494
  219   2HD2  ASN  27          1HD2      ASN  27  -2.015   0.529  -7.157
  220    H    ARG  28           H        ARG  28  -6.835  -3.347  -8.505
  221    HA   ARG  28           HA       ARG  28  -7.624  -2.542 -11.229
  222   1HB   ARG  28          1HB       ARG  28  -8.357  -4.922  -9.462
  223   2HB   ARG  28          2HB       ARG  28  -8.875  -4.735 -11.153
  224   1HG   ARG  28          1HG       ARG  28  -6.487  -4.686 -11.870
  225   2HG   ARG  28          2HG       ARG  28  -6.000  -4.878 -10.173
  226   1HD   ARG  28          1HD       ARG  28  -7.293  -7.035 -10.101
  227   2HD   ARG  28          2HD       ARG  28  -7.584  -6.857 -11.849
  228    HE   ARG  28           HE       ARG  28  -4.771  -6.661 -11.165
  229   1HH1  ARG  28          1HH2      ARG  28  -7.395  -8.970 -11.660
  230   2HH1  ARG  28          2HH2      ARG  28  -6.345 -10.276 -12.141
  231   1HH2  ARG  28          2HH1      ARG  28  -3.403  -8.322 -11.718
  232   2HH2  ARG  28          1HH1      ARG  28  -3.994  -9.911 -12.159
  233    H    PHE  29           H        PHE  29  -9.042  -3.217  -8.131
  234    HA   PHE  29           HA       PHE  29 -11.714  -2.413  -8.490
  235   1HB   PHE  29          1HB       PHE  29  -9.650  -2.481  -6.296
  236   2HB   PHE  29          2HB       PHE  29 -11.260  -1.904  -5.961
  237    HD1  PHE  29           HD1      PHE  29 -12.772  -3.652  -7.934
  238    HD2  PHE  29           HD2      PHE  29  -9.627  -4.637  -5.170
  239    HE1  PHE  29           HE1      PHE  29 -13.621  -5.980  -7.815
  240    HE2  PHE  29           HE2      PHE  29 -10.553  -6.939  -4.959
  241    HZ   PHE  29           HZ       PHE  29 -12.531  -7.614  -6.330
  242    H    THR  30           H        THR  30 -12.514  -0.568  -9.060
  243    HA   THR  30           HA       THR  30 -10.874   1.819  -9.354
  244    HB   THR  30           HB       THR  30 -13.779   1.108  -9.868
  245    HG1  THR  30           HG1      THR  30 -11.864   0.204 -11.092
  246   1HG2  THR  30          1HG2      THR  30 -12.257   3.578 -10.742
  247   2HG2  THR  30          2HG2      THR  30 -13.926   3.127 -11.218
  248   3HG2  THR  30          3HG2      THR  30 -13.552   3.509  -9.514
  249    H    SER  31           H        SER  31 -10.653   1.416  -6.796
  250    HA   SER  31           HA       SER  31 -12.471   3.253  -5.369
  251   1HB   SER  31          1HB       SER  31 -11.201   0.675  -4.351
  252   2HB   SER  31          2HB       SER  31 -12.505   1.612  -3.583
  253    HG   SER  31           HG       SER  31 -12.628   0.138  -6.016
  254    H    ASP  32           H        ASP  32 -11.518   4.519  -3.795
  255    HA   ASP  32           HA       ASP  32  -8.612   4.839  -3.880
  256   1HB   ASP  32          1HB       ASP  32 -10.804   5.904  -2.080
  257   2HB   ASP  32          2HB       ASP  32  -9.104   6.417  -1.966
  258    H    VAL  33           H        VAL  33  -7.924   2.754  -3.403
  259    HA   VAL  33           HA       VAL  33  -8.950   1.319  -1.136
  260    HB   VAL  33           HB       VAL  33  -6.653   0.820  -3.055
  261   1HG1  VAL  33          1HG1      VAL  33  -6.375  -0.326  -0.895
  262   2HG1  VAL  33          2HG1      VAL  33  -8.014  -1.005  -1.026
  263   3HG1  VAL  33          3HG1      VAL  33  -6.747  -1.492  -2.191
  264   1HG2  VAL  33          1HG2      VAL  33  -8.948   1.024  -3.981
  265   2HG2  VAL  33          2HG2      VAL  33  -8.399  -0.670  -4.071
  266   3HG2  VAL  33          3HG2      VAL  33  -9.539  -0.154  -2.794
  267    H    PHE  34           H        PHE  34  -8.142   0.944   0.777
  268    HA   PHE  34           HA       PHE  34  -5.638   2.303   1.504
  269   1HB   PHE  34          1HB       PHE  34  -8.263   2.689   2.989
  270   2HB   PHE  34          2HB       PHE  34  -6.673   3.254   3.525
  271    HD1  PHE  34           HD1      PHE  34  -5.346   4.501   1.484
  272    HD2  PHE  34           HD2      PHE  34  -9.606   4.430   2.104
  273    HE1  PHE  34           HE1      PHE  34  -5.585   6.581   0.113
  274    HE2  PHE  34           HE2      PHE  34  -9.845   6.448   0.681
  275    HZ   PHE  34           HZ       PHE  34  -7.841   7.534  -0.297
  276    H    LEU  35           H        LEU  35  -4.849   1.672   3.645
  277    HA   LEU  35           HA       LEU  35  -5.941  -0.884   4.641
  278   1HB   LEU  35          1HB       LEU  35  -4.062  -1.299   2.967
  279   2HB   LEU  35          2HB       LEU  35  -2.968  -0.480   4.107
  280    HG   LEU  35           HG       LEU  35  -3.536  -2.120   5.848
  281   1HD1  LEU  35          1HD1      LEU  35  -5.402  -3.298   3.741
  282   2HD1  LEU  35          2HD1      LEU  35  -5.077  -3.998   5.342
  283   3HD1  LEU  35          3HD1      LEU  35  -5.917  -2.435   5.207
  284   1HD2  LEU  35          1HD2      LEU  35  -1.775  -2.749   4.202
  285   2HD2  LEU  35          2HD2      LEU  35  -2.670  -4.180   4.770
  286   3HD2  LEU  35          3HD2      LEU  35  -3.020  -3.488   3.168
  287    H    GLU  36           H        GLU  36  -6.213  -0.610   6.771
  288    HA   GLU  36           HA       GLU  36  -4.799   1.725   8.017
  289   1HB   GLU  36          1HB       GLU  36  -7.334   0.379   8.975
  290   2HB   GLU  36          2HB       GLU  36  -6.717   1.989   9.411
  291   1HG   GLU  36          1HG       GLU  36  -7.155   2.791   7.147
  292   2HG   GLU  36          2HG       GLU  36  -7.725   1.209   6.643
  293    H    LYS  37           H        LYS  37  -2.979   0.711   9.005
  294    HA   LYS  37           HA       LYS  37  -2.945  -1.896  10.204
  295   1HB   LYS  37          1HB       LYS  37  -1.232   0.594  10.513
  296   2HB   LYS  37          2HB       LYS  37  -0.885  -0.946  11.315
  297   1HG   LYS  37          1HG       LYS  37  -0.787  -2.080   9.112
  298   2HG   LYS  37          2HG       LYS  37  -1.030  -0.509   8.305
  299   1HD   LYS  37          1HD       LYS  37   1.423  -1.238   8.575
  300   2HD   LYS  37          2HD       LYS  37   1.018   0.360   9.256
  301   1HE   LYS  37          1HE       LYS  37   0.632  -0.738  11.483
  302   2HE   LYS  37          2HE       LYS  37   1.252  -2.260  10.815
  303   1HZ   LYS  37          1HZ       LYS  37   2.719   0.291  10.974
  304   2HZ   LYS  37          2HZ       LYS  37   2.928  -1.007  11.970
  305   3HZ   LYS  37          3HZ       LYS  37   3.315  -1.124  10.372
  306    H    ASP  38           H        ASP  38  -4.904  -1.917  11.528
  307    HA   ASP  38           HA       ASP  38  -6.112  -1.594  13.429
  308   1HB   ASP  38          1HB       ASP  38  -3.321  -1.117  14.515
  309   2HB   ASP  38          2HB       ASP  38  -4.782  -1.231  15.521
  310    H    GLY  39           H        GLY  39  -5.692   0.635  11.584
  311   1HA   GLY  39          1HA       GLY  39  -6.901   2.803  12.147
  312   2HA   GLY  39          2HA       GLY  39  -5.770   2.891  13.520
  313    H    LYS  40           H        LYS  40  -3.498   1.780  11.785
  314    HA   LYS  40           HA       LYS  40  -2.576   4.353  10.834
  315   1HB   LYS  40          1HB       LYS  40  -1.309   1.634  10.435
  316   2HB   LYS  40          2HB       LYS  40  -0.494   3.209  10.489
  317   1HG   LYS  40          1HG       LYS  40  -1.844   1.721  12.793
  318   2HG   LYS  40          2HG       LYS  40  -0.111   2.009  12.591
  319   1HD   LYS  40          1HD       LYS  40  -2.258   4.128  13.043
  320   2HD   LYS  40          2HD       LYS  40  -1.038   3.604  14.217
  321   1HE   LYS  40          1HE       LYS  40  -0.537   5.023  11.562
  322   2HE   LYS  40          2HE       LYS  40  -0.345   5.714  13.185
  323   1HZ   LYS  40          1HZ       LYS  40   1.388   4.113  13.585
  324   2HZ   LYS  40          2HZ       LYS  40   1.208   3.483  12.071
  325   3HZ   LYS  40          3HZ       LYS  40   1.741   5.030  12.262
  326    H    LYS  41           H        LYS  41  -4.468   4.468   9.319
  327    HA   LYS  41           HA       LYS  41  -4.433   2.738   6.975
  328   1HB   LYS  41          1HB       LYS  41  -6.507   3.348   7.807
  329   2HB   LYS  41          2HB       LYS  41  -6.075   5.045   7.964
  330   1HG   LYS  41          1HG       LYS  41  -6.091   3.767   5.226
  331   2HG   LYS  41          2HG       LYS  41  -7.622   4.283   5.957
  332   1HD   LYS  41          1HD       LYS  41  -6.737   6.559   6.322
  333   2HD   LYS  41          2HD       LYS  41  -5.175   6.079   5.638
  334   1HE   LYS  41          1HE       LYS  41  -6.436   5.414   3.528
  335   2HE   LYS  41          2HE       LYS  41  -7.870   6.181   4.210
  336   1HZ   LYS  41          1HZ       LYS  41  -5.309   7.531   3.698
  337   2HZ   LYS  41          2HZ       LYS  41  -6.674   7.660   2.784
  338   3HZ   LYS  41          3HZ       LYS  41  -6.661   8.237   4.327
  339    H    VAL  42           H        VAL  42  -3.822   3.060   5.059
  340    HA   VAL  42           HA       VAL  42  -3.069   5.687   3.940
  341    HB   VAL  42           HB       VAL  42  -0.935   4.570   3.047
  342   1HG1  VAL  42          1HG1      VAL  42  -0.892   6.225   4.873
  343   2HG1  VAL  42          2HG1      VAL  42  -1.150   4.918   6.057
  344   3HG1  VAL  42          3HG1      VAL  42   0.354   4.970   5.096
  345   1HG2  VAL  42          1HG2      VAL  42  -1.699   2.243   3.548
  346   2HG2  VAL  42          2HG2      VAL  42  -0.113   2.597   4.291
  347   3HG2  VAL  42          3HG2      VAL  42  -1.594   2.606   5.284
  348    H    ASN  43           H        ASN  43  -2.241   5.227   1.568
  349    HA   ASN  43           HA       ASN  43  -4.466   3.889   0.263
  350   1HB   ASN  43          1HB       ASN  43  -3.062   4.305  -1.834
  351   2HB   ASN  43          2HB       ASN  43  -3.725   5.700  -0.973
  352   1HD2  ASN  43          2HD2      ASN  43  -0.705   3.734  -0.475
  353   2HD2  ASN  43          1HD2      ASN  43   0.319   5.151  -0.472
  354    H    ALA  44           H        ALA  44  -4.702   1.984   0.502
  355    HA   ALA  44           HA       ALA  44  -3.017  -0.114   1.187
  356   1HB   ALA  44          1HB       ALA  44  -5.467  -0.056  -0.608
  357   2HB   ALA  44          2HB       ALA  44  -4.822  -1.542   0.113
  358   3HB   ALA  44          3HB       ALA  44  -5.490  -0.254   1.151
  359    H    LYS  45           H        LYS  45  -3.491   1.332  -1.974
  360    HA   LYS  45           HA       LYS  45  -2.291  -1.013  -3.339
  361   1HB   LYS  45          1HB       LYS  45  -3.079   0.224  -5.399
  362   2HB   LYS  45          2HB       LYS  45  -4.359  -0.352  -4.312
  363   1HG   LYS  45          1HG       LYS  45  -4.620   1.902  -3.372
  364   2HG   LYS  45          2HG       LYS  45  -3.267   2.495  -4.366
  365   1HD   LYS  45          1HD       LYS  45  -5.488   3.038  -5.360
  366   2HD   LYS  45          2HD       LYS  45  -4.515   1.989  -6.416
  367   1HE   LYS  45          1HE       LYS  45  -5.740   0.018  -5.686
  368   2HE   LYS  45          2HE       LYS  45  -6.639   0.958  -4.480
  369   1HZ   LYS  45          1HZ       LYS  45  -6.816   1.419  -7.381
  370   2HZ   LYS  45          2HZ       LYS  45  -7.876   0.521  -6.502
  371   3HZ   LYS  45          3HZ       LYS  45  -7.726   2.128  -6.194
  372    H    SER  46           H        SER  46  -1.504   2.150  -2.188
  373    HA   SER  46           HA       SER  46   0.665   2.306  -4.203
  374   1HB   SER  46          1HB       SER  46  -0.268   4.536  -2.395
  375   2HB   SER  46          2HB       SER  46   0.702   4.672  -3.880
  376    HG   SER  46           HG       SER  46  -1.476   5.181  -4.325
  377    H    ILE  47           H        ILE  47   2.624   3.447  -3.396
  378    HA   ILE  47           HA       ILE  47   4.280   2.294  -1.664
  379    HB   ILE  47           HB       ILE  47   5.080   4.097  -2.931
  380   1HG1  ILE  47          1HG1      ILE  47   5.881   3.871  -0.411
  381   2HG1  ILE  47          2HG1      ILE  47   6.471   5.201  -1.418
  382   1HG2  ILE  47          1HG2      ILE  47   2.925   5.377  -3.055
  383   2HG2  ILE  47          2HG2      ILE  47   3.258   6.007  -1.425
  384   3HG2  ILE  47          3HG2      ILE  47   4.349   6.410  -2.765
  385   1HD1  ILE  47          1HD1      ILE  47   4.660   6.677  -0.503
  386   2HD1  ILE  47          2HD1      ILE  47   4.132   5.353   0.539
  387   3HD1  ILE  47          3HD1      ILE  47   5.726   6.077   0.794
  388    H    MET  48           H        MET  48   2.248   5.038  -0.521
  389    HA   MET  48           HA       MET  48   3.240   4.705   2.064
  390   1HB   MET  48          1HB       MET  48   2.073   6.732   1.249
  391   2HB   MET  48          2HB       MET  48   0.541   5.847   1.218
  392   1HG   MET  48          1HG       MET  48   0.590   7.161   3.238
  393   2HG   MET  48          2HG       MET  48   0.798   5.459   3.694
  394   1HE   MET  48          1HE       MET  48   3.682   7.370   2.029
  395   2HE   MET  48          2HE       MET  48   2.819   8.733   2.793
  396   3HE   MET  48          3HE       MET  48   4.437   8.261   3.375
  397    H    GLY  49           H        GLY  49   0.846   2.752   0.510
  398   1HA   GLY  49          1HA       GLY  49   0.207   1.450   3.065
  399   2HA   GLY  49          2HA       GLY  49  -0.420   0.983   1.445
  400    H    LEU  50           H        LEU  50   1.352   0.245  -0.148
  401    HA   LEU  50           HA       LEU  50   2.525  -2.147   0.540
  402   1HB   LEU  50          1HB       LEU  50   2.940  -0.103  -1.531
  403   2HB   LEU  50          2HB       LEU  50   4.417  -0.994  -1.104
  404    HG   LEU  50           HG       LEU  50   1.791  -2.372  -1.825
  405   1HD1  LEU  50          1HD1      LEU  50   2.714  -1.050  -3.715
  406   2HD1  LEU  50          2HD1      LEU  50   4.269  -1.893  -3.535
  407   3HD1  LEU  50          3HD1      LEU  50   2.817  -2.802  -4.016
  408   1HD2  LEU  50          1HD2      LEU  50   3.410  -3.691  -0.421
  409   2HD2  LEU  50          2HD2      LEU  50   3.217  -4.374  -2.053
  410   3HD2  LEU  50          3HD2      LEU  50   4.660  -3.419  -1.654
  411    H    MET  51           H        MET  51   4.203   1.003   0.509
  412    HA   MET  51           HA       MET  51   6.690  -0.272   1.181
  413   1HB   MET  51          1HB       MET  51   7.466   1.550   0.023
  414   2HB   MET  51          2HB       MET  51   5.794   2.106  -0.088
  415   1HG   MET  51          1HG       MET  51   6.993   3.913   0.789
  416   2HG   MET  51          2HG       MET  51   6.091   3.228   2.148
  417   1HE   MET  51          1HE       MET  51   7.151   4.197   3.979
  418   2HE   MET  51          2HE       MET  51   8.899   4.313   4.321
  419   3HE   MET  51          3HE       MET  51   8.184   5.260   2.989
  420    H    SER  52           H        SER  52   4.444   2.150   2.524
  421    HA   SER  52           HA       SER  52   5.852   2.207   5.052
  422   1HB   SER  52          1HB       SER  52   3.291   3.599   4.240
  423   2HB   SER  52          2HB       SER  52   4.340   4.008   5.618
  424    HG   SER  52           HG       SER  52   4.820   5.281   3.751
  425    H    LEU  53           H        LEU  53   2.274   1.872   4.755
  426    HA   LEU  53           HA       LEU  53   2.321   0.624   7.409
  427   1HB   LEU  53          1HB       LEU  53   0.061   1.375   5.579
  428   2HB   LEU  53          2HB       LEU  53  -0.125   0.540   7.138
  429    HG   LEU  53           HG       LEU  53  -0.378   2.846   7.569
  430   1HD1  LEU  53          1HD1      LEU  53   2.428   2.012   8.374
  431   2HD1  LEU  53          2HD1      LEU  53   1.510   3.359   9.087
  432   3HD1  LEU  53          3HD1      LEU  53   0.919   1.693   9.267
  433   1HD2  LEU  53          1HD2      LEU  53   0.758   3.566   5.436
  434   2HD2  LEU  53          2HD2      LEU  53   1.190   4.567   6.859
  435   3HD2  LEU  53          3HD2      LEU  53   2.318   3.331   6.247
  436    H    ALA  54           H        ALA  54   1.064  -0.252   4.256
  437    HA   ALA  54           HA       ALA  54   0.334  -3.006   4.910
  438   1HB   ALA  54          1HB       ALA  54  -1.070  -1.632   3.397
  439   2HB   ALA  54          2HB       ALA  54   0.328  -1.446   2.301
  440   3HB   ALA  54          3HB       ALA  54  -0.386  -3.049   2.560
  441    H    VAL  55           H        VAL  55   2.372  -3.313   5.589
  442    HA   VAL  55           HA       VAL  55   3.969  -5.032   4.021
  443    HB   VAL  55           HB       VAL  55   4.956  -2.888   3.205
  444   1HG1  VAL  55          1HG2      VAL  55   4.403  -1.536   5.208
  445   2HG1  VAL  55          2HG2      VAL  55   5.654  -2.403   6.130
  446   3HG1  VAL  55          3HG2      VAL  55   6.113  -1.374   4.748
  447   1HG2  VAL  55          1HG1      VAL  55   6.777  -4.431   5.098
  448   2HG2  VAL  55          2HG1      VAL  55   6.440  -4.812   3.391
  449   3HG2  VAL  55          3HG1      VAL  55   7.323  -3.325   3.811
  450    H    SER  56           H        SER  56   3.285  -3.271   6.942
  451    HA   SER  56           HA       SER  56   4.975  -4.736   8.676
  452   1HB   SER  56          1HB       SER  56   2.334  -3.418   9.394
  453   2HB   SER  56          2HB       SER  56   3.783  -3.586  10.399
  454    HG   SER  56           HG       SER  56   3.392  -1.902   8.125
  455    H    THR  57           H        THR  57   4.603  -6.911   7.862
  456    HA   THR  57           HA       THR  57   2.419  -8.502   8.006
  457    HB   THR  57           HB       THR  57   5.147  -9.162   9.157
  458    HG1  THR  57           HG1      THR  57   4.271  -9.646   6.524
  459   1HG2  THR  57          1HG2      THR  57   4.620 -11.465   8.418
  460   2HG2  THR  57          2HG2      THR  57   3.417 -10.891   9.594
  461   3HG2  THR  57          3HG2      THR  57   3.021 -10.929   7.858
  462    H    GLY  58           H        GLY  58   0.906  -8.862   9.427
  463   1HA   GLY  58          1HA       GLY  58   0.213  -9.866  11.514
  464   2HA   GLY  58          2HA       GLY  58   1.612  -9.127  12.301
  465    H    THR  59           H        THR  59   0.389  -6.631  10.398
  466    HA   THR  59           HA       THR  59  -0.883  -5.580  12.824
  467    HB   THR  59           HB       THR  59  -0.789  -4.214  10.103
  468    HG1  THR  59           HG1      THR  59   1.336  -4.867  10.725
  469   1HG2  THR  59          1HG2      THR  59  -0.700  -3.152  12.960
  470   2HG2  THR  59          2HG2      THR  59  -0.816  -2.179  11.477
  471   3HG2  THR  59          3HG2      THR  59  -2.171  -3.229  11.965
  472    H    GLU  60           H        GLU  60  -3.161  -5.256  13.118
  473    HA   GLU  60           HA       GLU  60  -4.801  -6.711  11.142
  474   1HB   GLU  60          1HB       GLU  60  -5.796  -5.180  13.561
  475   2HB   GLU  60          2HB       GLU  60  -6.586  -6.512  12.661
  476   1HG   GLU  60          1HG       GLU  60  -3.996  -6.840  14.237
  477   2HG   GLU  60          2HG       GLU  60  -5.605  -7.215  14.874
  478    H    VAL  61           H        VAL  61  -4.448  -5.443   9.374
  479    HA   VAL  61           HA       VAL  61  -5.107  -2.555   9.519
  480    HB   VAL  61           HB       VAL  61  -4.187  -2.455   7.219
  481   1HG1  VAL  61          1HG1      VAL  61  -2.410  -3.804   9.298
  482   2HG1  VAL  61          2HG1      VAL  61  -1.816  -3.045   7.797
  483   3HG1  VAL  61          3HG1      VAL  61  -2.625  -2.052   9.027
  484   1HG2  VAL  61          1HG2      VAL  61  -4.722  -4.772   6.587
  485   2HG2  VAL  61          2HG2      VAL  61  -2.984  -4.396   6.349
  486   3HG2  VAL  61          3HG2      VAL  61  -3.506  -5.360   7.765
  487    H    THR  62           H        THR  62  -6.949  -1.752   8.853
  488    HA   THR  62           HA       THR  62  -8.985  -3.460   7.713
  489    HB   THR  62           HB       THR  62  -9.167  -0.463   7.650
  490    HG1  THR  62           HG1      THR  62  -9.383  -0.324   9.779
  491   1HG2  THR  62          1HG2      THR  62 -11.477  -1.005   8.473
  492   2HG2  THR  62          2HG2      THR  62 -11.117  -1.835   6.951
  493   3HG2  THR  62          3HG2      THR  62 -11.039  -2.728   8.485
  494    H    LEU  63           H        LEU  63  -8.920  -4.093   5.570
  495    HA   LEU  63           HA       LEU  63  -7.564  -2.371   3.652
  496   1HB   LEU  63          1HB       LEU  63  -7.541  -4.942   3.742
  497   2HB   LEU  63          2HB       LEU  63  -9.203  -4.877   3.104
  498    HG   LEU  63           HG       LEU  63  -7.386  -5.162   1.409
  499   1HD1  LEU  63          1HD2      LEU  63  -9.571  -4.202   0.764
  500   2HD1  LEU  63          2HD2      LEU  63  -8.956  -2.566   1.118
  501   3HD1  LEU  63          3HD2      LEU  63  -8.243  -3.516  -0.206
  502   1HD2  LEU  63          1HD1      LEU  63  -5.693  -3.726   2.468
  503   2HD2  LEU  63          2HD1      LEU  63  -6.043  -3.144   0.820
  504   3HD2  LEU  63          3HD1      LEU  63  -6.729  -2.297   2.224
  505    H    ILE  64           H        ILE  64  -8.570  -0.642   3.161
  506    HA   ILE  64           HA       ILE  64 -11.503  -0.439   2.879
  507    HB   ILE  64           HB       ILE  64  -9.261   1.600   2.501
  508   1HG1  ILE  64          1HG1      ILE  64 -11.011   1.106   4.932
  509   2HG1  ILE  64          2HG1      ILE  64  -9.248   0.855   4.829
  510   1HG2  ILE  64          1HG2      ILE  64 -12.265   1.892   2.867
  511   2HG2  ILE  64          2HG2      ILE  64 -11.109   3.244   2.755
  512   3HG2  ILE  64          3HG2      ILE  64 -11.360   2.160   1.360
  513   1HD1  ILE  64          1HD1      ILE  64  -9.008   3.296   4.271
  514   2HD1  ILE  64          2HD1      ILE  64 -10.766   3.471   4.500
  515   3HD1  ILE  64          3HD1      ILE  64  -9.726   3.010   5.882
  516    H    ALA  65           H        ALA  65 -12.428   0.110   0.922
  517    HA   ALA  65           HA       ALA  65 -10.654   0.697  -1.346
  518   1HB   ALA  65          1HB       ALA  65 -12.794  -1.485  -1.493
  519   2HB   ALA  65          2HB       ALA  65 -11.879  -0.849  -2.875
  520   3HB   ALA  65          3HB       ALA  65 -11.034  -1.762  -1.600
  521    H    GLN  66           H        GLN  66 -11.436   2.823  -0.967
  522    HA   GLN  66           HA       GLN  66 -14.383   2.967  -0.966
  523   1HB   GLN  66          1HB       GLN  66 -14.123   5.235  -0.210
  524   2HB   GLN  66          2HB       GLN  66 -12.973   4.220   0.693
  525   1HG   GLN  66          1HG       GLN  66 -11.107   5.108  -0.395
  526   2HG   GLN  66          2HG       GLN  66 -12.067   5.520  -1.830
  527   1HE2  GLN  66          2HE2      GLN  66 -11.526   6.553   1.589
  528   2HE2  GLN  66          1HE2      GLN  66 -11.949   8.222   1.248
  529    H    GLY  67           H        GLY  67 -14.448   2.021  -3.022
  530   1HA   GLY  67          1HA       GLY  67 -14.411   4.111  -5.169
  531   2HA   GLY  67          2HA       GLY  67 -13.537   2.607  -5.372
  532    H    GLU  68           H        GLU  68 -14.888   2.704  -7.231
  533    HA   GLU  68           HA       GLU  68 -17.591   2.082  -7.401
  534   1HB   GLU  68          1HB       GLU  68 -15.261   1.104  -9.112
  535   2HB   GLU  68          2HB       GLU  68 -16.959   1.219  -9.617
  536   1HG   GLU  68          1HG       GLU  68 -15.089   3.510  -8.898
  537   2HG   GLU  68          2HG       GLU  68 -15.814   3.167 -10.482
  538    H    ASP  69           H        ASP  69 -14.846  -0.108  -6.516
  539    HA   ASP  69           HA       ASP  69 -16.843  -2.364  -6.577
  540   1HB   ASP  69          1HB       ASP  69 -13.854  -2.578  -6.466
  541   2HB   ASP  69          2HB       ASP  69 -15.037  -3.851  -6.765
  542    H    GLU  70           H        GLU  70 -16.254  -0.073  -4.542
  543    HA   GLU  70           HA       GLU  70 -14.703  -0.255  -2.623
  544   1HB   GLU  70          1HB       GLU  70 -16.741   1.157  -2.787
  545   2HB   GLU  70          2HB       GLU  70 -17.713  -0.235  -2.276
  546   1HG   GLU  70          1HG       GLU  70 -15.910  -0.109  -0.222
  547   2HG   GLU  70          2HG       GLU  70 -16.088   1.612  -0.647
  548    H    GLN  71           H        GLN  71 -17.654  -1.823  -1.496
  549    HA   GLN  71           HA       GLN  71 -16.578  -3.297   0.493
  550   1HB   GLN  71          1HB       GLN  71 -18.966  -2.905   0.010
  551   2HB   GLN  71          2HB       GLN  71 -18.902  -4.102  -1.299
  552   1HG   GLN  71          1HG       GLN  71 -19.886  -5.008   0.785
  553   2HG   GLN  71          2HG       GLN  71 -18.402  -5.875   0.330
  554   1HE2  GLN  71          2HE2      GLN  71 -16.421  -5.350   1.430
  555   2HE2  GLN  71          1HE2      GLN  71 -16.503  -4.814   3.117
  556    H    GLU  72           H        GLU  72 -16.602  -4.249  -2.916
  557    HA   GLU  72           HA       GLU  72 -15.991  -7.056  -2.525
  558   1HB   GLU  72          1HB       GLU  72 -17.133  -6.465  -4.549
  559   2HB   GLU  72          2HB       GLU  72 -16.200  -4.954  -4.675
  560   1HG   GLU  72          1HG       GLU  72 -15.525  -6.304  -6.468
  561   2HG   GLU  72          2HG       GLU  72 -14.188  -6.246  -5.317
  562    H    ALA  73           H        ALA  73 -14.303  -4.089  -3.526
  563    HA   ALA  73           HA       ALA  73 -11.747  -5.145  -4.055
  564   1HB   ALA  73          1HB       ALA  73 -12.797  -2.434  -3.128
  565   2HB   ALA  73          2HB       ALA  73 -11.176  -2.698  -3.820
  566   3HB   ALA  73          3HB       ALA  73 -12.633  -2.972  -4.811
  567    H    LEU  74           H        LEU  74 -12.975  -3.319  -1.267
  568    HA   LEU  74           HA       LEU  74 -10.665  -3.604   0.326
  569   1HB   LEU  74          1HB       LEU  74 -12.109  -2.720   2.104
  570   2HB   LEU  74          2HB       LEU  74 -12.328  -1.900   0.538
  571    HG   LEU  74           HG       LEU  74 -14.249  -3.792   0.328
  572   1HD1  LEU  74          1HD2      LEU  74 -14.034  -2.909   3.239
  573   2HD1  LEU  74          2HD2      LEU  74 -15.422  -3.766   2.517
  574   3HD1  LEU  74          3HD2      LEU  74 -13.833  -4.576   2.624
  575   1HD2  LEU  74          1HD1      LEU  74 -14.392  -1.007   1.567
  576   2HD2  LEU  74          2HD1      LEU  74 -14.398  -1.410  -0.159
  577   3HD2  LEU  74          3HD1      LEU  74 -15.766  -1.897   0.857
  578    H    GLU  75           H        GLU  75 -13.686  -5.622   0.329
  579    HA   GLU  75           HA       GLU  75 -12.825  -7.339   2.401
  580   1HB   GLU  75          1HB       GLU  75 -14.768  -7.601   0.110
  581   2HB   GLU  75          2HB       GLU  75 -14.337  -9.023   1.093
  582   1HG   GLU  75          1HG       GLU  75 -14.965  -7.857   3.149
  583   2HG   GLU  75          2HG       GLU  75 -15.364  -6.395   2.220
  584    H    LYS  76           H        LYS  76 -12.351  -7.846  -1.225
  585    HA   LYS  76           HA       LYS  76 -11.107 -10.369  -0.515
  586   1HB   LYS  76          1HB       LYS  76 -10.374 -10.413  -2.879
  587   2HB   LYS  76          2HB       LYS  76 -12.133 -10.399  -2.620
  588   1HG   LYS  76          1HG       LYS  76 -12.236  -8.059  -3.261
  589   2HG   LYS  76          2HG       LYS  76 -10.453  -7.972  -3.400
  590   1HD   LYS  76          1HD       LYS  76 -11.735 -10.269  -4.801
  591   2HD   LYS  76          2HD       LYS  76 -12.164  -8.698  -5.463
  592   1HE   LYS  76          1HE       LYS  76 -10.193  -9.650  -6.602
  593   2HE   LYS  76          2HE       LYS  76  -9.792  -8.129  -5.807
  594   1HZ   LYS  76          1HZ       LYS  76  -9.262 -10.807  -4.713
  595   2HZ   LYS  76          2HZ       LYS  76  -8.155  -9.839  -5.458
  596   3HZ   LYS  76          3HZ       LYS  76  -8.821  -9.377  -4.017
  597    H    LEU  77           H        LEU  77  -9.895  -7.113  -1.186
  598    HA   LEU  77           HA       LEU  77  -7.147  -7.944  -1.313
  599   1HB   LEU  77          1HB       LEU  77  -8.529  -5.335  -0.715
  600   2HB   LEU  77          2HB       LEU  77  -6.764  -5.520  -0.563
  601    HG   LEU  77           HG       LEU  77  -7.132  -4.769  -2.831
  602   1HD1  LEU  77          1HD2      LEU  77  -6.861  -7.800  -2.773
  603   2HD1  LEU  77          2HD2      LEU  77  -6.474  -6.748  -4.152
  604   3HD1  LEU  77          3HD2      LEU  77  -5.501  -6.633  -2.651
  605   1HD2  LEU  77          1HD1      LEU  77  -9.523  -5.473  -3.037
  606   2HD2  LEU  77          2HD1      LEU  77  -8.514  -6.014  -4.413
  607   3HD2  LEU  77          3HD1      LEU  77  -8.963  -7.165  -3.127
  608    H    ALA  78           H        ALA  78  -9.153  -6.789   1.502
  609    HA   ALA  78           HA       ALA  78  -7.118  -7.150   3.447
  610   1HB   ALA  78          1HB       ALA  78 -10.119  -7.623   3.672
  611   2HB   ALA  78          2HB       ALA  78  -9.000  -7.397   5.029
  612   3HB   ALA  78          3HB       ALA  78  -9.311  -6.050   3.919
  613    H    ALA  79           H        ALA  79  -9.454  -9.420   1.949
  614    HA   ALA  79           HA       ALA  79  -8.957 -11.686   3.559
  615   1HB   ALA  79          1HB       ALA  79 -10.712 -11.429   1.756
  616   2HB   ALA  79          2HB       ALA  79  -9.402 -11.562   0.547
  617   3HB   ALA  79          3HB       ALA  79  -9.764 -12.935   1.623
  618    H    TYR  80           H        TYR  80  -7.514 -10.732   0.457
  619    HA   TYR  80           HA       TYR  80  -5.591 -12.734   0.189
  620   1HB   TYR  80          1HB       TYR  80  -6.530 -11.121  -1.471
  621   2HB   TYR  80          2HB       TYR  80  -5.583  -9.838  -0.718
  622    HD1  TYR  80           HD1      TYR  80  -3.671  -9.201  -1.718
  623    HD2  TYR  80           HD2      TYR  80  -4.781 -13.358  -1.853
  624    HE1  TYR  80           HE1      TYR  80  -1.444  -9.777  -2.679
  625    HE2  TYR  80           HE2      TYR  80  -2.577 -13.920  -2.833
  626    HH   TYR  80           HH       TYR  80  -0.197 -11.344  -3.571
  627    H    VAL  81           H        VAL  81  -5.305  -9.575   1.873
  628    HA   VAL  81           HA       VAL  81  -2.459  -9.878   2.161
  629    HB   VAL  81           HB       VAL  81  -2.605  -8.003   3.719
  630   1HG1  VAL  81          1HG2      VAL  81  -2.886  -7.608   1.273
  631   2HG1  VAL  81          2HG2      VAL  81  -4.637  -7.824   1.461
  632   3HG1  VAL  81          3HG2      VAL  81  -3.834  -6.437   2.233
  633   1HG2  VAL  81          1HG1      VAL  81  -4.566  -8.848   4.982
  634   2HG2  VAL  81          2HG1      VAL  81  -4.837  -7.171   4.443
  635   3HG2  VAL  81          3HG1      VAL  81  -5.601  -8.533   3.583
  636    H    GLN  82           H        GLN  82  -5.167 -11.200   4.000
  637    HA   GLN  82           HA       GLN  82  -3.297 -11.851   6.216
  638   1HB   GLN  82          1HB       GLN  82  -5.424 -12.072   7.504
  639   2HB   GLN  82          2HB       GLN  82  -5.256 -10.472   6.744
  640   1HG   GLN  82          1HG       GLN  82  -7.024 -10.916   5.287
  641   2HG   GLN  82          2HG       GLN  82  -6.579 -12.601   5.136
  642   1HE2  GLN  82          2HE2      GLN  82  -9.035 -10.878   5.981
  643   2HE2  GLN  82          1HE2      GLN  82  -9.686 -11.723   7.377
  644    H    GLU  83           H        GLU  83  -5.740 -13.430   4.128
  645    HA   GLU  83           HA       GLU  83  -6.011 -15.657   5.899
  646   1HB   GLU  83          1HB       GLU  83  -7.804 -16.268   4.428
  647   2HB   GLU  83          2HB       GLU  83  -7.771 -14.484   4.577
  648   1HG   GLU  83          1HG       GLU  83  -6.506 -14.361   2.438
  649   2HG   GLU  83          2HG       GLU  83  -6.698 -16.116   2.249
  650    H    GLU  84           H        GLU  84  -3.695 -15.228   3.480
  651    HA   GLU  84           HA       GLU  84  -3.472 -18.194   3.217
  652   1HB   GLU  84          1HB       GLU  84  -2.220 -17.727   1.079
  653   2HB   GLU  84          2HB       GLU  84  -3.967 -17.483   1.035
  654   1HG   GLU  84          1HG       GLU  84  -2.186 -15.078   1.524
  655   2HG   GLU  84          2HG       GLU  84  -2.395 -15.752  -0.103
  656    H    VAL  85           H        VAL  85  -0.826 -16.671   1.910
  657    HA   VAL  85           HA       VAL  85   0.717 -15.690   4.104
  658    HB   VAL  85           HB       VAL  85   2.449 -17.656   3.910
  659   1HG1  VAL  85          1HG1      VAL  85  -0.055 -18.253   5.639
  660   2HG1  VAL  85          2HG1      VAL  85   1.542 -19.021   5.821
  661   3HG1  VAL  85          3HG1      VAL  85   1.366 -17.305   6.141
  662   1HG2  VAL  85          1HG2      VAL  85   1.270 -19.024   2.131
  663   2HG2  VAL  85          2HG2      VAL  85   1.592 -19.966   3.591
  664   3HG2  VAL  85          3HG2      VAL  85  -0.055 -19.366   3.269
  Start of MODEL   13
    1   1H    VAL   2          1H        VAL   2 -19.254   3.967   1.092
    2   2H    VAL   2          2H        VAL   2 -18.742   5.539   0.785
    3   3H    VAL   2          3H        VAL   2 -20.228   5.011   0.203
    4    HA   VAL   2           HA       VAL   2 -19.174   3.436  -1.225
    5    HB   VAL   2           HB       VAL   2 -19.619   5.719  -2.070
    6   1HG1  VAL   2          1HG1      VAL   2 -16.743   6.279  -1.233
    7   2HG1  VAL   2          2HG1      VAL   2 -17.781   7.360  -2.192
    8   3HG1  VAL   2          3HG1      VAL   2 -18.198   6.997  -0.501
    9   1HG2  VAL   2          1HG2      VAL   2 -18.615   4.005  -3.534
   10   2HG2  VAL   2          2HG2      VAL   2 -18.013   5.625  -3.948
   11   3HG2  VAL   2          3HG2      VAL   2 -16.990   4.505  -3.019
   12    H    GLN   3           H        GLN   3 -17.052   5.216   1.000
   13    HA   GLN   3           HA       GLN   3 -14.818   3.437   0.310
   14   1HB   GLN   3          1HB       GLN   3 -14.531   5.891   1.088
   15   2HB   GLN   3          2HB       GLN   3 -14.963   5.292   2.713
   16   1HG   GLN   3          1HG       GLN   3 -13.123   3.618   2.542
   17   2HG   GLN   3          2HG       GLN   3 -12.708   4.238   0.935
   18   1HE2  GLN   3          2HE2      GLN   3 -12.768   7.020   1.244
   19   2HE2  GLN   3          1HE2      GLN   3 -11.563   7.443   2.442
   20    H    GLN   4           H        GLN   4 -14.640   1.509   1.175
   21    HA   GLN   4           HA       GLN   4 -15.963   0.889   3.776
   22   1HB   GLN   4          1HB       GLN   4 -16.066  -0.639   1.149
   23   2HB   GLN   4          2HB       GLN   4 -16.427  -1.410   2.709
   24   1HG   GLN   4          1HG       GLN   4 -17.885   1.078   1.742
   25   2HG   GLN   4          2HG       GLN   4 -18.426  -0.566   1.355
   26   1HE2  GLN   4          2HE2      GLN   4 -18.027  -2.043   3.620
   27   2HE2  GLN   4          1HE2      GLN   4 -18.945  -1.351   4.944
   28    H    LYS   5           H        LYS   5 -14.784  -0.948   4.918
   29    HA   LYS   5           HA       LYS   5 -12.365  -1.898   3.645
   30   1HB   LYS   5          1HB       LYS   5 -10.950  -1.174   5.549
   31   2HB   LYS   5          2HB       LYS   5 -11.490   0.162   4.517
   32   1HG   LYS   5          1HG       LYS   5 -13.050  -0.545   7.005
   33   2HG   LYS   5          2HG       LYS   5 -11.563   0.430   7.126
   34   1HD   LYS   5          1HD       LYS   5 -12.453   2.072   5.531
   35   2HD   LYS   5          2HD       LYS   5 -13.935   1.109   5.354
   36   1HE   LYS   5          1HE       LYS   5 -14.328   2.941   6.931
   37   2HE   LYS   5          2HE       LYS   5 -14.395   1.386   7.784
   38   1HZ   LYS   5          1HZ       LYS   5 -12.127   1.775   8.492
   39   2HZ   LYS   5          2HZ       LYS   5 -12.093   3.219   7.711
   40   3HZ   LYS   5          3HZ       LYS   5 -13.117   2.998   8.985
   41    H    VAL   6           H        VAL   6 -11.677  -3.788   4.543
   42    HA   VAL   6           HA       VAL   6 -13.178  -4.773   6.924
   43    HB   VAL   6           HB       VAL   6 -12.989  -7.079   5.833
   44   1HG1  VAL   6          1HG1      VAL   6 -15.102  -5.805   6.038
   45   2HG1  VAL   6          2HG1      VAL   6 -14.736  -4.954   4.519
   46   3HG1  VAL   6          3HG1      VAL   6 -15.045  -6.707   4.504
   47   1HG2  VAL   6          1HG2      VAL   6 -11.389  -6.390   4.029
   48   2HG2  VAL   6          2HG2      VAL   6 -12.874  -7.127   3.377
   49   3HG2  VAL   6          3HG2      VAL   6 -12.656  -5.360   3.333
   50    H    GLU   7           H        GLU   7 -11.788  -5.615   8.520
   51    HA   GLU   7           HA       GLU   7  -9.018  -4.953   7.944
   52   1HB   GLU   7          1HB       GLU   7 -10.300  -5.965  10.526
   53   2HB   GLU   7          2HB       GLU   7  -8.637  -5.372  10.360
   54   1HG   GLU   7          1HG       GLU   7  -9.504  -3.169   9.572
   55   2HG   GLU   7          2HG       GLU   7 -11.157  -3.747   9.861
   56    H    VAL   8           H        VAL   8  -7.210  -6.137   8.267
   57    HA   VAL   8           HA       VAL   8  -7.442  -9.079   8.303
   58    HB   VAL   8           HB       VAL   8  -6.945  -9.237   6.102
   59   1HG1  VAL   8          1HG2      VAL   8  -8.344  -7.208   5.874
   60   2HG1  VAL   8          2HG2      VAL   8  -6.882  -6.203   5.998
   61   3HG1  VAL   8          3HG2      VAL   8  -7.080  -7.316   4.616
   62   1HG2  VAL   8          1HG1      VAL   8  -4.693  -7.252   6.613
   63   2HG2  VAL   8          2HG1      VAL   8  -4.571  -9.031   6.639
   64   3HG2  VAL   8          3HG1      VAL   8  -4.898  -8.189   5.116
   65    H    ARG   9           H        ARG   9  -5.560 -10.031   9.248
   66    HA   ARG   9           HA       ARG   9  -3.581  -8.071  10.305
   67   1HB   ARG   9          1HB       ARG   9  -3.957 -10.018  11.756
   68   2HB   ARG   9          2HB       ARG   9  -3.757 -11.113  10.360
   69   1HG   ARG   9          1HG       ARG   9  -1.427  -9.714  10.232
   70   2HG   ARG   9          2HG       ARG   9  -1.672  -9.769  11.989
   71   1HD   ARG   9          1HD       ARG   9  -0.388 -11.739  11.005
   72   2HD   ARG   9          2HD       ARG   9  -1.868 -12.229  11.859
   73    HE   ARG   9           HE       ARG   9  -2.774 -11.967   9.310
   74   1HH1  ARG   9          2HH1      ARG   9   0.147 -13.547  10.506
   75   2HH1  ARG   9          1HH1      ARG   9  -0.013 -14.932   9.456
   76   1HH2  ARG   9          1HH2      ARG   9  -3.085 -13.891   8.053
   77   2HH2  ARG   9          2HH2      ARG   9  -1.816 -15.075   7.972
   78    H    LEU  10           H        LEU  10  -1.673  -7.630   9.198
   79    HA   LEU  10           HA       LEU  10  -1.413  -8.279   6.473
   80   1HB   LEU  10          1HB       LEU  10   0.520  -7.241   8.539
   81   2HB   LEU  10          2HB       LEU  10   1.143  -7.900   7.017
   82    HG   LEU  10           HG       LEU  10   0.900  -5.681   6.507
   83   1HD1  LEU  10          1HD1      LEU  10  -0.102  -7.124   4.824
   84   2HD1  LEU  10          2HD1      LEU  10  -1.691  -6.999   5.623
   85   3HD1  LEU  10          3HD1      LEU  10  -0.942  -5.557   4.889
   86   1HD2  LEU  10          1HD2      LEU  10  -0.326  -5.017   8.525
   87   2HD2  LEU  10          2HD2      LEU  10  -1.100  -4.332   7.076
   88   3HD2  LEU  10          3HD2      LEU  10  -1.817  -5.750   7.882
   89    H    LYS  11           H        LYS  11  -1.785 -10.449   6.115
   90    HA   LYS  11           HA       LYS  11  -0.060 -12.503   7.217
   91   1HB   LYS  11          1HB       LYS  11  -2.241 -13.105   6.582
   92   2HB   LYS  11          2HB       LYS  11  -2.133 -12.261   5.024
   93   1HG   LYS  11          1HG       LYS  11  -0.303 -14.588   5.604
   94   2HG   LYS  11          2HG       LYS  11  -1.990 -14.852   5.150
   95   1HD   LYS  11          1HD       LYS  11   0.107 -13.367   3.516
   96   2HD   LYS  11          2HD       LYS  11  -0.766 -14.854   3.063
   97   1HE   LYS  11          1HE       LYS  11  -2.915 -13.453   3.419
   98   2HE   LYS  11          2HE       LYS  11  -1.835 -12.046   3.498
   99   1HZ   LYS  11          1HZ       LYS  11  -1.108 -12.642   1.244
  100   2HZ   LYS  11          2HZ       LYS  11  -2.175 -13.904   1.234
  101   3HZ   LYS  11          3HZ       LYS  11  -2.740 -12.367   1.315
  102    H    THR  12           H        THR  12  -0.326 -10.603   4.173
  103    HA   THR  12           HA       THR  12   2.150 -11.666   3.081
  104    HB   THR  12           HB       THR  12   2.042  -9.595   1.657
  105    HG1  THR  12           HG1      THR  12   0.038  -8.418   1.834
  106   1HG2  THR  12          1HG2      THR  12  -0.532 -11.212   1.851
  107   2HG2  THR  12          2HG2      THR  12   0.027 -10.311   0.417
  108   3HG2  THR  12          3HG2      THR  12   0.948 -11.718   0.999
  109    H    GLY  13           H        GLY  13   1.085  -8.609   4.583
  110   1HA   GLY  13          1HA       GLY  13   2.192  -6.984   5.844
  111   2HA   GLY  13          2HA       GLY  13   3.559  -8.096   6.118
  112    H    LEU  14           H        LEU  14   2.007  -7.388   3.085
  113    HA   LEU  14           HA       LEU  14   2.839  -6.640   1.048
  114   1HB   LEU  14          1HB       LEU  14   2.839  -4.389   3.036
  115   2HB   LEU  14          2HB       LEU  14   3.240  -4.120   1.333
  116    HG   LEU  14           HG       LEU  14   0.851  -3.743   1.693
  117   1HD1  LEU  14          1HD2      LEU  14   1.598  -4.685  -0.466
  118   2HD1  LEU  14          2HD2      LEU  14   1.348  -6.324   0.178
  119   3HD1  LEU  14          3HD2      LEU  14  -0.040  -5.228  -0.032
  120   1HD2  LEU  14          1HD1      LEU  14   0.526  -5.289   3.615
  121   2HD2  LEU  14          2HD1      LEU  14  -0.679  -5.529   2.323
  122   3HD2  LEU  14          3HD1      LEU  14   0.679  -6.667   2.500
  123    H    GLN  15           H        GLN  15   4.740  -8.189   1.601
  124    HA   GLN  15           HA       GLN  15   7.223  -6.674   2.070
  125   1HB   GLN  15          1HB       GLN  15   6.792  -9.668   1.797
  126   2HB   GLN  15          2HB       GLN  15   8.302  -8.861   2.283
  127   1HG   GLN  15          1HG       GLN  15   7.048  -7.773   4.172
  128   2HG   GLN  15          2HG       GLN  15   5.632  -8.753   3.751
  129   1HE2  GLN  15          2HE2      GLN  15   5.435 -10.660   4.833
  130   2HE2  GLN  15          1HE2      GLN  15   6.771 -11.550   5.547
  131    H    ALA  16           H        ALA  16   6.202  -9.095  -0.492
  132    HA   ALA  16           HA       ALA  16   7.728  -7.354  -2.344
  133   1HB   ALA  16          1HB       ALA  16   9.443  -8.718  -1.271
  134   2HB   ALA  16          2HB       ALA  16   8.564 -10.202  -1.720
  135   3HB   ALA  16          3HB       ALA  16   9.264  -9.168  -2.987
  136    H    ARG  17           H        ARG  17   5.551 -10.168  -1.924
  137    HA   ARG  17           HA       ARG  17   5.219  -9.913  -4.889
  138   1HB   ARG  17          1HB       ARG  17   6.417 -12.112  -3.617
  139   2HB   ARG  17          2HB       ARG  17   4.807 -12.669  -4.147
  140   1HG   ARG  17          1HG       ARG  17   6.452 -12.939  -5.982
  141   2HG   ARG  17          2HG       ARG  17   5.259 -11.686  -6.399
  142   1HD   ARG  17          1HD       ARG  17   7.419 -10.780  -6.951
  143   2HD   ARG  17          2HD       ARG  17   6.886  -9.967  -5.461
  144    HE   ARG  17           HE       ARG  17   8.536 -12.358  -5.059
  145   1HH1  ARG  17          2HH1      ARG  17   8.382  -8.848  -5.258
  146   2HH1  ARG  17          1HH1      ARG  17  10.075  -8.590  -4.915
  147   1HH2  ARG  17          1HH2      ARG  17  10.702 -12.047  -4.362
  148   2HH2  ARG  17          2HH2      ARG  17  11.375 -10.444  -4.245
  149    HA   PRO  18           HA       PRO  18   0.989 -11.795  -3.268
  150   1HB   PRO  18          1HB       PRO  18   0.776 -11.916  -0.537
  151   2HB   PRO  18          2HB       PRO  18   1.507 -13.273  -1.465
  152   1HG   PRO  18          1HG       PRO  18   2.992 -10.862  -0.325
  153   2HG   PRO  18          2HG       PRO  18   3.382 -12.506   0.131
  154   1HD   PRO  18          1HD       PRO  18   4.775 -11.530  -1.756
  155   2HD   PRO  18          2HD       PRO  18   3.944 -13.064  -2.190
  156    H    ALA  19           H        ALA  19   2.866  -9.616  -1.188
  157    HA   ALA  19           HA       ALA  19   1.110  -7.622  -0.460
  158   1HB   ALA  19          1HB       ALA  19   3.945  -7.689  -1.506
  159   2HB   ALA  19          2HB       ALA  19   3.303  -6.397  -0.430
  160   3HB   ALA  19          3HB       ALA  19   3.469  -8.091   0.161
  161    H    ALA  20           H        ALA  20   3.038  -8.020  -3.443
  162    HA   ALA  20           HA       ALA  20   2.320  -5.493  -4.672
  163   1HB   ALA  20          1HB       ALA  20   3.339  -8.124  -5.831
  164   2HB   ALA  20          2HB       ALA  20   3.260  -6.573  -6.701
  165   3HB   ALA  20          3HB       ALA  20   4.356  -6.757  -5.309
  166    H    LEU  21           H        LEU  21   1.180  -8.834  -4.675
  167    HA   LEU  21           HA       LEU  21  -0.900  -8.547  -6.620
  168   1HB   LEU  21          1HB       LEU  21   0.081 -10.657  -5.671
  169   2HB   LEU  21          2HB       LEU  21  -0.909 -10.402  -4.220
  170    HG   LEU  21           HG       LEU  21  -2.031 -10.575  -7.052
  171   1HD1  LEU  21          1HD1      LEU  21  -1.744 -12.720  -4.906
  172   2HD1  LEU  21          2HD1      LEU  21  -2.629 -12.907  -6.440
  173   3HD1  LEU  21          3HD1      LEU  21  -0.866 -12.661  -6.452
  174   1HD2  LEU  21          1HD2      LEU  21  -3.310 -10.880  -4.297
  175   2HD2  LEU  21          2HD2      LEU  21  -3.508  -9.485  -5.383
  176   3HD2  LEU  21          3HD2      LEU  21  -4.145 -11.078  -5.855
  177    H    PHE  22           H        PHE  22  -0.847  -8.015  -3.104
  178    HA   PHE  22           HA       PHE  22  -3.533  -7.296  -2.528
  179   1HB   PHE  22          1HB       PHE  22  -1.940  -7.558  -0.827
  180   2HB   PHE  22          2HB       PHE  22  -0.788  -6.447  -1.580
  181    HD1  PHE  22           HD1      PHE  22  -1.692  -3.915  -1.826
  182    HD2  PHE  22           HD2      PHE  22  -2.742  -6.761   1.226
  183    HE1  PHE  22           HE1      PHE  22  -2.052  -2.063  -0.251
  184    HE2  PHE  22           HE2      PHE  22  -3.116  -4.903   2.821
  185    HZ   PHE  22           HZ       PHE  22  -2.779  -2.548   2.101
  186    H    VAL  23           H        VAL  23  -0.789  -5.136  -3.319
  187    HA   VAL  23           HA       VAL  23  -2.423  -2.826  -3.686
  188    HB   VAL  23           HB       VAL  23   0.364  -3.555  -4.618
  189   1HG1  VAL  23          1HG2      VAL  23  -1.050  -0.858  -4.818
  190   2HG1  VAL  23          2HG2      VAL  23   0.670  -1.163  -5.147
  191   3HG1  VAL  23          3HG2      VAL  23  -0.575  -1.884  -6.194
  192   1HG2  VAL  23          1HG1      VAL  23  -0.818  -1.680  -2.505
  193   2HG2  VAL  23          2HG1      VAL  23  -0.063  -3.260  -2.185
  194   3HG2  VAL  23          3HG1      VAL  23   0.914  -1.916  -2.813
  195    H    GLN  24           H        GLN  24  -1.486  -5.392  -5.912
  196    HA   GLN  24           HA       GLN  24  -2.232  -4.183  -8.353
  197   1HB   GLN  24          1HB       GLN  24  -0.782  -6.205  -7.952
  198   2HB   GLN  24          2HB       GLN  24  -2.250  -7.109  -7.513
  199   1HG   GLN  24          1HG       GLN  24  -3.186  -6.550  -9.789
  200   2HG   GLN  24          2HG       GLN  24  -1.616  -5.807 -10.182
  201   1HE2  GLN  24          2HE2      GLN  24  -3.227  -8.864  -9.224
  202   2HE2  GLN  24          1HE2      GLN  24  -1.978  -9.911  -9.893
  203    H    GLU  25           H        GLU  25  -4.041  -6.333  -6.098
  204    HA   GLU  25           HA       GLU  25  -6.370  -6.399  -7.836
  205   1HB   GLU  25          1HB       GLU  25  -6.112  -7.164  -4.894
  206   2HB   GLU  25          2HB       GLU  25  -7.390  -7.670  -6.023
  207   1HG   GLU  25          1HG       GLU  25  -4.436  -8.334  -6.249
  208   2HG   GLU  25          2HG       GLU  25  -5.714  -9.458  -5.730
  209    H    ALA  26           H        ALA  26  -5.479  -4.860  -4.762
  210    HA   ALA  26           HA       ALA  26  -7.755  -3.294  -4.216
  211   1HB   ALA  26          1HB       ALA  26  -4.791  -2.623  -4.144
  212   2HB   ALA  26          2HB       ALA  26  -6.040  -1.760  -3.208
  213   3HB   ALA  26          3HB       ALA  26  -5.659  -3.471  -2.832
  214    H    ASN  27           H        ASN  27  -4.899  -2.661  -6.230
  215    HA   ASN  27           HA       ASN  27  -5.501  -0.189  -7.350
  216   1HB   ASN  27          1HB       ASN  27  -3.745  -2.489  -7.799
  217   2HB   ASN  27          2HB       ASN  27  -4.457  -2.038  -9.340
  218   1HD2  ASN  27          2HD2      ASN  27  -2.446  -0.997  -6.695
  219   2HD2  ASN  27          1HD2      ASN  27  -1.677   0.387  -7.487
  220    H    ARG  28           H        ARG  28  -6.151  -3.459  -8.556
  221    HA   ARG  28           HA       ARG  28  -7.105  -2.602 -11.103
  222   1HB   ARG  28          1HB       ARG  28  -7.536  -5.170  -9.654
  223   2HB   ARG  28          2HB       ARG  28  -8.109  -4.810 -11.302
  224   1HG   ARG  28          1HG       ARG  28  -5.220  -4.648 -10.307
  225   2HG   ARG  28          2HG       ARG  28  -5.906  -5.810 -11.451
  226   1HD   ARG  28          1HD       ARG  28  -4.829  -4.356 -12.875
  227   2HD   ARG  28          2HD       ARG  28  -6.480  -3.727 -12.914
  228    HE   ARG  28           HE       ARG  28  -4.179  -2.608 -11.340
  229   1HH1  ARG  28          1HH2      ARG  28  -7.274  -2.145 -13.002
  230   2HH1  ARG  28          2HH2      ARG  28  -7.296  -0.426 -12.759
  231   1HH2  ARG  28          2HH1      ARG  28  -4.210  -0.305 -11.025
  232   2HH2  ARG  28          1HH1      ARG  28  -5.543   0.612 -11.651
  233    H    PHE  29           H        PHE  29  -8.776  -3.292  -8.036
  234    HA   PHE  29           HA       PHE  29 -11.383  -2.692  -9.237
  235   1HB   PHE  29          1HB       PHE  29 -10.480  -2.997  -6.374
  236   2HB   PHE  29          2HB       PHE  29 -12.140  -2.606  -6.854
  237    HD1  PHE  29           HD1      PHE  29 -10.292  -4.738  -9.124
  238    HD2  PHE  29           HD2      PHE  29 -12.919  -4.741  -5.725
  239    HE1  PHE  29           HE1      PHE  29 -10.901  -7.102  -9.616
  240    HE2  PHE  29           HE2      PHE  29 -13.472  -7.124  -6.173
  241    HZ   PHE  29           HZ       PHE  29 -12.513  -8.289  -8.137
  242    H    THR  30           H        THR  30 -12.125  -0.850  -9.614
  243    HA   THR  30           HA       THR  30 -10.330   1.447  -9.492
  244    HB   THR  30           HB       THR  30 -13.067   0.934 -10.671
  245    HG1  THR  30           HG1      THR  30 -11.036  -0.039 -11.494
  246   1HG2  THR  30          1HG2      THR  30 -11.306   3.382 -11.003
  247   2HG2  THR  30          2HG2      THR  30 -12.828   3.032 -11.887
  248   3HG2  THR  30          3HG2      THR  30 -12.856   3.299 -10.123
  249    H    SER  31           H        SER  31 -10.498   1.177  -7.084
  250    HA   SER  31           HA       SER  31 -12.469   3.042  -5.888
  251   1HB   SER  31          1HB       SER  31 -11.172   0.525  -4.755
  252   2HB   SER  31          2HB       SER  31 -12.449   1.494  -3.978
  253    HG   SER  31           HG       SER  31 -13.110  -0.510  -5.171
  254    H    ASP  32           H        ASP  32 -11.747   4.366  -4.267
  255    HA   ASP  32           HA       ASP  32  -8.895   4.874  -4.048
  256   1HB   ASP  32          1HB       ASP  32 -10.699   6.569  -3.854
  257   2HB   ASP  32          2HB       ASP  32 -11.295   5.722  -2.409
  258    H    VAL  33           H        VAL  33  -8.152   2.881  -3.555
  259    HA   VAL  33           HA       VAL  33  -9.168   1.306  -1.335
  260    HB   VAL  33           HB       VAL  33  -6.829   0.871  -3.224
  261   1HG1  VAL  33          1HG1      VAL  33  -8.344  -1.067  -1.427
  262   2HG1  VAL  33          2HG1      VAL  33  -7.071  -1.506  -2.588
  263   3HG1  VAL  33          3HG1      VAL  33  -6.678  -0.512  -1.159
  264   1HG2  VAL  33          1HG2      VAL  33  -9.050   1.117  -4.303
  265   2HG2  VAL  33          2HG2      VAL  33  -8.456  -0.553  -4.423
  266   3HG2  VAL  33          3HG2      VAL  33  -9.713  -0.133  -3.228
  267    H    PHE  34           H        PHE  34  -8.099   0.613   0.459
  268    HA   PHE  34           HA       PHE  34  -5.673   2.066   1.311
  269   1HB   PHE  34          1HB       PHE  34  -8.240   2.234   2.916
  270   2HB   PHE  34          2HB       PHE  34  -6.650   2.870   3.344
  271    HD1  PHE  34           HD1      PHE  34  -5.642   4.743   2.047
  272    HD2  PHE  34           HD2      PHE  34  -9.716   3.491   1.466
  273    HE1  PHE  34           HE1      PHE  34  -6.205   6.999   1.147
  274    HE2  PHE  34           HE2      PHE  34 -10.252   5.698   0.468
  275    HZ   PHE  34           HZ       PHE  34  -8.527   7.474   0.375
  276    H    LEU  35           H        LEU  35  -5.140   1.436   3.665
  277    HA   LEU  35           HA       LEU  35  -6.221  -1.093   4.629
  278   1HB   LEU  35          1HB       LEU  35  -3.895  -1.713   5.100
  279   2HB   LEU  35          2HB       LEU  35  -4.219  -1.800   3.346
  280    HG   LEU  35           HG       LEU  35  -3.107   0.698   4.647
  281   1HD1  LEU  35          1HD2      LEU  35  -1.544  -1.791   3.883
  282   2HD1  LEU  35          2HD2      LEU  35  -0.823  -0.224   4.321
  283   3HD1  LEU  35          3HD2      LEU  35  -1.765  -1.141   5.525
  284   1HD2  LEU  35          1HD1      LEU  35  -2.677  -0.648   1.936
  285   2HD2  LEU  35          2HD1      LEU  35  -3.732   0.752   2.247
  286   3HD2  LEU  35          3HD1      LEU  35  -1.970   0.908   2.438
  287    H    GLU  36           H        GLU  36  -6.465  -0.802   6.802
  288    HA   GLU  36           HA       GLU  36  -5.228   1.663   7.995
  289   1HB   GLU  36          1HB       GLU  36  -7.730   0.246   8.955
  290   2HB   GLU  36          2HB       GLU  36  -7.198   1.911   9.308
  291   1HG   GLU  36          1HG       GLU  36  -7.521   2.510   6.937
  292   2HG   GLU  36          2HG       GLU  36  -8.023   0.856   6.567
  293    H    LYS  37           H        LYS  37  -3.364   0.751   9.037
  294    HA   LYS  37           HA       LYS  37  -3.178  -1.838  10.209
  295   1HB   LYS  37          1HB       LYS  37  -1.698   0.781  10.168
  296   2HB   LYS  37          2HB       LYS  37  -1.266  -0.421  11.381
  297   1HG   LYS  37          1HG       LYS  37  -0.807  -2.084   9.623
  298   2HG   LYS  37          2HG       LYS  37  -1.257  -0.917   8.368
  299   1HD   LYS  37          1HD       LYS  37   1.230  -1.006   8.718
  300   2HD   LYS  37          2HD       LYS  37   0.577   0.591   9.175
  301   1HE   LYS  37          1HE       LYS  37   0.442  -0.155  11.547
  302   2HE   LYS  37          2HE       LYS  37   1.150  -1.719  11.094
  303   1HZ   LYS  37          1HZ       LYS  37   2.454   0.896  10.767
  304   2HZ   LYS  37          2HZ       LYS  37   2.776  -0.201  11.956
  305   3HZ   LYS  37          3HZ       LYS  37   3.100  -0.575  10.387
  306    H    ASP  38           H        ASP  38  -5.207  -1.859  11.504
  307    HA   ASP  38           HA       ASP  38  -6.390  -1.628  13.440
  308   1HB   ASP  38          1HB       ASP  38  -3.632  -1.021  14.538
  309   2HB   ASP  38          2HB       ASP  38  -5.067  -1.346  15.537
  310    H    GLY  39           H        GLY  39  -6.022   0.639  11.618
  311   1HA   GLY  39          1HA       GLY  39  -7.251   2.796  12.244
  312   2HA   GLY  39          2HA       GLY  39  -6.073   2.866  13.580
  313    H    LYS  40           H        LYS  40  -3.824   1.815  11.830
  314    HA   LYS  40           HA       LYS  40  -2.996   4.413  10.850
  315   1HB   LYS  40          1HB       LYS  40  -1.597   1.759  10.477
  316   2HB   LYS  40          2HB       LYS  40  -0.871   3.375  10.534
  317   1HG   LYS  40          1HG       LYS  40  -2.110   1.758  12.793
  318   2HG   LYS  40          2HG       LYS  40  -0.422   2.276  12.658
  319   1HD   LYS  40          1HD       LYS  40  -2.795   4.179  12.951
  320   2HD   LYS  40          2HD       LYS  40  -1.814   3.586  14.299
  321   1HE   LYS  40          1HE       LYS  40  -0.986   5.750  13.759
  322   2HE   LYS  40          2HE       LYS  40   0.226   4.578  13.207
  323   1HZ   LYS  40          1HZ       LYS  40  -1.790   5.899  11.515
  324   2HZ   LYS  40          2HZ       LYS  40  -0.201   6.318  11.614
  325   3HZ   LYS  40          3HZ       LYS  40  -0.624   4.856  10.991
  326    H    LYS  41           H        LYS  41  -4.871   4.482   9.330
  327    HA   LYS  41           HA       LYS  41  -4.727   2.714   7.026
  328   1HB   LYS  41          1HB       LYS  41  -6.843   3.235   7.845
  329   2HB   LYS  41          2HB       LYS  41  -6.536   4.966   7.889
  330   1HG   LYS  41          1HG       LYS  41  -6.512   3.470   5.242
  331   2HG   LYS  41          2HG       LYS  41  -8.034   3.969   6.006
  332   1HD   LYS  41          1HD       LYS  41  -6.900   6.303   6.275
  333   2HD   LYS  41          2HD       LYS  41  -5.807   5.745   4.994
  334   1HE   LYS  41          1HE       LYS  41  -7.726   6.933   4.005
  335   2HE   LYS  41          2HE       LYS  41  -7.837   5.217   3.587
  336   1HZ   LYS  41          1HZ       LYS  41  -9.353   4.984   5.481
  337   2HZ   LYS  41          2HZ       LYS  41  -9.312   6.613   5.715
  338   3HZ   LYS  41          3HZ       LYS  41  -9.932   5.987   4.319
  339    H    VAL  42           H        VAL  42  -4.266   3.053   5.030
  340    HA   VAL  42           HA       VAL  42  -3.275   5.582   3.929
  341    HB   VAL  42           HB       VAL  42  -1.288   4.663   5.006
  342   1HG1  VAL  42          1HG2      VAL  42  -2.097   2.324   5.205
  343   2HG1  VAL  42          2HG2      VAL  42  -1.939   2.114   3.445
  344   3HG1  VAL  42          3HG2      VAL  42  -0.487   2.367   4.447
  345   1HG2  VAL  42          1HG1      VAL  42  -0.906   5.652   2.825
  346   2HG2  VAL  42          2HG1      VAL  42   0.194   4.273   3.096
  347   3HG2  VAL  42          3HG1      VAL  42  -1.231   4.079   2.045
  348    H    ASN  43           H        ASN  43  -2.741   5.354   1.689
  349    HA   ASN  43           HA       ASN  43  -4.945   4.005   0.352
  350   1HB   ASN  43          1HB       ASN  43  -4.102   6.246  -0.358
  351   2HB   ASN  43          2HB       ASN  43  -2.583   5.464  -0.870
  352   1HD2  ASN  43          2HD2      ASN  43  -5.976   6.004  -1.627
  353   2HD2  ASN  43          1HD2      ASN  43  -5.955   5.173  -3.157
  354    H    ALA  44           H        ALA  44  -4.921   2.096   0.211
  355    HA   ALA  44           HA       ALA  44  -2.994   0.134   0.573
  356   1HB   ALA  44          1HB       ALA  44  -5.446  -0.249   0.627
  357   2HB   ALA  44          2HB       ALA  44  -5.505  -0.018  -1.133
  358   3HB   ALA  44          3HB       ALA  44  -4.637  -1.410  -0.453
  359    H    LYS  45           H        LYS  45  -3.925   1.659  -2.499
  360    HA   LYS  45           HA       LYS  45  -2.291  -0.313  -3.992
  361   1HB   LYS  45          1HB       LYS  45  -3.020   1.018  -5.982
  362   2HB   LYS  45          2HB       LYS  45  -4.367   0.304  -5.067
  363   1HG   LYS  45          1HG       LYS  45  -4.862   2.402  -4.001
  364   2HG   LYS  45          2HG       LYS  45  -3.374   3.135  -4.573
  365   1HD   LYS  45          1HD       LYS  45  -5.495   3.771  -5.904
  366   2HD   LYS  45          2HD       LYS  45  -4.114   3.185  -6.849
  367   1HE   LYS  45          1HE       LYS  45  -6.171   2.127  -7.662
  368   2HE   LYS  45          2HE       LYS  45  -5.058   0.945  -6.948
  369   1HZ   LYS  45          1HZ       LYS  45  -6.385   1.053  -4.939
  370   2HZ   LYS  45          2HZ       LYS  45  -7.463   2.068  -5.672
  371   3HZ   LYS  45          3HZ       LYS  45  -7.269   0.532  -6.224
  372    H    SER  46           H        SER  46  -1.859   2.704  -2.398
  373    HA   SER  46           HA       SER  46   0.202   3.700  -4.204
  374   1HB   SER  46          1HB       SER  46  -0.733   4.428  -1.396
  375   2HB   SER  46          2HB       SER  46   0.531   5.320  -2.278
  376    HG   SER  46           HG       SER  46  -2.103   4.871  -3.259
  377    H    ILE  47           H        ILE  47   2.363   3.688  -3.849
  378    HA   ILE  47           HA       ILE  47   3.747   1.587  -2.822
  379    HB   ILE  47           HB       ILE  47   4.775   3.406  -4.134
  380   1HG1  ILE  47          1HG1      ILE  47   5.770   2.260  -1.610
  381   2HG1  ILE  47          2HG1      ILE  47   6.551   2.285  -3.198
  382   1HG2  ILE  47          1HG2      ILE  47   3.570   5.291  -3.007
  383   2HG2  ILE  47          2HG2      ILE  47   4.549   5.021  -1.557
  384   3HG2  ILE  47          3HG2      ILE  47   5.331   5.570  -3.053
  385   1HD1  ILE  47          1HD1      ILE  47   6.406   4.562  -1.172
  386   2HD1  ILE  47          2HD1      ILE  47   7.835   3.548  -1.496
  387   3HD1  ILE  47          3HD1      ILE  47   7.220   4.660  -2.755
  388    H    MET  48           H        MET  48   3.041   4.598  -0.972
  389    HA   MET  48           HA       MET  48   4.269   3.565   1.403
  390   1HB   MET  48          1HB       MET  48   4.193   5.922   0.887
  391   2HB   MET  48          2HB       MET  48   2.421   5.928   0.891
  392   1HG   MET  48          1HG       MET  48   2.441   5.337   3.296
  393   2HG   MET  48          2HG       MET  48   4.205   5.159   3.242
  394   1HE   MET  48          1HE       MET  48   5.898   7.042   2.978
  395   2HE   MET  48          2HE       MET  48   5.093   7.586   1.485
  396   3HE   MET  48          3HE       MET  48   5.486   8.763   2.765
  397    H    GLY  49           H        GLY  49   1.146   3.004  -0.025
  398   1HA   GLY  49          1HA       GLY  49  -0.162   2.352   2.509
  399   2HA   GLY  49          2HA       GLY  49  -0.782   2.063   0.855
  400    H    LEU  50           H        LEU  50   1.296   0.667  -0.360
  401    HA   LEU  50           HA       LEU  50   1.061  -1.940   0.806
  402   1HB   LEU  50          1HB       LEU  50   1.196  -1.204  -1.641
  403   2HB   LEU  50          2HB       LEU  50   2.924  -0.923  -1.374
  404    HG   LEU  50           HG       LEU  50   1.443  -3.576  -1.186
  405   1HD1  LEU  50          1HD1      LEU  50   3.614  -2.494  -3.031
  406   2HD1  LEU  50          2HD1      LEU  50   2.918  -4.136  -3.097
  407   3HD1  LEU  50          3HD1      LEU  50   1.903  -2.718  -3.462
  408   1HD2  LEU  50          1HD2      LEU  50   4.396  -2.961  -0.785
  409   2HD2  LEU  50          2HD2      LEU  50   3.257  -3.452   0.489
  410   3HD2  LEU  50          3HD2      LEU  50   3.652  -4.588  -0.826
  411    H    MET  51           H        MET  51   3.964  -0.130  -0.125
  412    HA   MET  51           HA       MET  51   5.807  -1.864   1.187
  413   1HB   MET  51          1HB       MET  51   6.216  -0.459  -0.895
  414   2HB   MET  51          2HB       MET  51   6.116   0.973   0.145
  415   1HG   MET  51          1HG       MET  51   7.962  -0.127   1.560
  416   2HG   MET  51          2HG       MET  51   8.204  -1.219   0.187
  417   1HE   MET  51          1HE       MET  51   7.109   2.501   0.247
  418   2HE   MET  51          2HE       MET  51   8.329   2.437   1.545
  419   3HE   MET  51          3HE       MET  51   8.652   3.372   0.063
  420    H    SER  52           H        SER  52   4.359   1.321   2.055
  421    HA   SER  52           HA       SER  52   6.212   1.481   4.305
  422   1HB   SER  52          1HB       SER  52   3.805   3.231   3.721
  423   2HB   SER  52          2HB       SER  52   5.146   3.590   4.834
  424    HG   SER  52           HG       SER  52   6.537   3.403   2.929
  425    H    LEU  53           H        LEU  53   2.595   1.687   4.350
  426    HA   LEU  53           HA       LEU  53   2.676   0.835   7.116
  427   1HB   LEU  53          1HB       LEU  53   0.545   1.579   5.110
  428   2HB   LEU  53          2HB       LEU  53   0.147   0.850   6.676
  429    HG   LEU  53           HG       LEU  53   1.469   2.657   7.823
  430   1HD1  LEU  53          1HD2      LEU  53   1.659   3.828   5.008
  431   2HD1  LEU  53          2HD2      LEU  53   2.142   4.655   6.511
  432   3HD1  LEU  53          3HD2      LEU  53   3.022   3.205   5.968
  433   1HD2  LEU  53          1HD1      LEU  53  -0.956   2.894   7.436
  434   2HD2  LEU  53          2HD1      LEU  53  -0.128   4.480   7.330
  435   3HD2  LEU  53          3HD1      LEU  53  -0.616   3.623   5.845
  436    H    ALA  54           H        ALA  54   1.154  -0.575   4.211
  437    HA   ALA  54           HA       ALA  54   0.075  -2.878   5.362
  438   1HB   ALA  54          1HB       ALA  54  -0.437  -1.938   3.104
  439   2HB   ALA  54          2HB       ALA  54   1.160  -2.479   2.554
  440   3HB   ALA  54          3HB       ALA  54  -0.056  -3.677   3.050
  441    H    VAL  55           H        VAL  55   3.393  -2.172   4.510
  442    HA   VAL  55           HA       VAL  55   4.257  -4.889   4.442
  443    HB   VAL  55           HB       VAL  55   5.477  -2.766   3.611
  444   1HG1  VAL  55          1HG2      VAL  55   5.409  -1.549   5.784
  445   2HG1  VAL  55          2HG2      VAL  55   6.432  -2.816   6.509
  446   3HG1  VAL  55          3HG2      VAL  55   7.073  -1.784   5.204
  447   1HG2  VAL  55          1HG1      VAL  55   6.985  -4.871   5.203
  448   2HG2  VAL  55          2HG1      VAL  55   6.434  -5.021   3.517
  449   3HG2  VAL  55          3HG1      VAL  55   7.685  -3.826   3.941
  450    H    SER  56           H        SER  56   2.989  -3.233   7.093
  451    HA   SER  56           HA       SER  56   4.753  -4.537   8.990
  452   1HB   SER  56          1HB       SER  56   2.048  -3.254   9.538
  453   2HB   SER  56          2HB       SER  56   3.376  -3.498  10.681
  454    HG   SER  56           HG       SER  56   3.343  -1.774   8.405
  455    H    THR  57           H        THR  57   4.350  -6.664   7.754
  456    HA   THR  57           HA       THR  57   2.244  -8.320   7.886
  457    HB   THR  57           HB       THR  57   4.874  -9.203   9.075
  458    HG1  THR  57           HG1      THR  57   5.557  -9.267   6.788
  459   1HG2  THR  57          1HG2      THR  57   3.001 -10.330   6.945
  460   2HG2  THR  57          2HG2      THR  57   4.437 -11.154   7.603
  461   3HG2  THR  57          3HG2      THR  57   3.030 -10.827   8.647
  462    H    GLY  58           H        GLY  58   0.849  -9.070   9.398
  463   1HA   GLY  58          1HA       GLY  58   0.291  -9.907  11.560
  464   2HA   GLY  58          2HA       GLY  58   1.670  -9.018  12.238
  465    H    THR  59           H        THR  59   0.484  -6.570  10.436
  466    HA   THR  59           HA       THR  59  -0.953  -5.579  12.779
  467    HB   THR  59           HB       THR  59  -0.551  -4.256  10.059
  468    HG1  THR  59           HG1      THR  59   1.423  -4.824  11.054
  469   1HG2  THR  59          1HG2      THR  59  -0.824  -2.156  11.354
  470   2HG2  THR  59          2HG2      THR  59  -2.262  -3.199  11.511
  471   3HG2  THR  59          3HG2      THR  59  -1.081  -3.109  12.834
  472    H    GLU  60           H        GLU  60  -3.213  -5.188  12.946
  473    HA   GLU  60           HA       GLU  60  -4.805  -6.627  10.943
  474   1HB   GLU  60          1HB       GLU  60  -5.745  -5.066  13.374
  475   2HB   GLU  60          2HB       GLU  60  -6.604  -6.365  12.490
  476   1HG   GLU  60          1HG       GLU  60  -3.921  -6.822  13.836
  477   2HG   GLU  60          2HG       GLU  60  -5.452  -7.035  14.693
  478    H    VAL  61           H        VAL  61  -4.334  -5.284   9.181
  479    HA   VAL  61           HA       VAL  61  -5.234  -2.465   9.310
  480    HB   VAL  61           HB       VAL  61  -4.258  -2.319   7.020
  481   1HG1  VAL  61          1HG1      VAL  61  -2.472  -3.526   9.182
  482   2HG1  VAL  61          2HG1      VAL  61  -1.864  -2.710   7.720
  483   3HG1  VAL  61          3HG1      VAL  61  -2.803  -1.793   8.919
  484   1HG2  VAL  61          1HG2      VAL  61  -4.496  -4.745   6.448
  485   2HG2  VAL  61          2HG2      VAL  61  -2.795  -4.173   6.294
  486   3HG2  VAL  61          3HG2      VAL  61  -3.292  -5.110   7.725
  487    H    THR  62           H        THR  62  -7.128  -1.820   8.588
  488    HA   THR  62           HA       THR  62  -8.933  -3.678   7.331
  489    HB   THR  62           HB       THR  62  -9.434  -0.741   7.166
  490    HG1  THR  62           HG1      THR  62  -9.659  -0.470   9.313
  491   1HG2  THR  62          1HG2      THR  62 -11.633  -1.429   8.112
  492   2HG2  THR  62          2HG2      THR  62 -11.215  -2.377   6.678
  493   3HG2  THR  62          3HG2      THR  62 -11.017  -3.089   8.299
  494    H    LEU  63           H        LEU  63  -8.816  -4.240   5.193
  495    HA   LEU  63           HA       LEU  63  -7.537  -2.528   3.198
  496   1HB   LEU  63          1HB       LEU  63  -8.773  -5.258   3.377
  497   2HB   LEU  63          2HB       LEU  63  -8.833  -4.442   1.810
  498    HG   LEU  63           HG       LEU  63  -6.813  -5.862   2.016
  499   1HD1  LEU  63          1HD1      LEU  63  -6.248  -2.865   2.001
  500   2HD1  LEU  63          2HD1      LEU  63  -5.173  -4.127   1.351
  501   3HD1  LEU  63          3HD1      LEU  63  -6.763  -3.838   0.604
  502   1HD2  LEU  63          1HD2      LEU  63  -6.494  -5.655   4.463
  503   2HD2  LEU  63          2HD2      LEU  63  -5.016  -5.211   3.575
  504   3HD2  LEU  63          3HD2      LEU  63  -6.063  -3.942   4.257
  505    H    ILE  64           H        ILE  64  -8.502  -0.873   2.475
  506    HA   ILE  64           HA       ILE  64 -11.456  -0.557   2.514
  507    HB   ILE  64           HB       ILE  64  -9.224   1.484   2.099
  508   1HG1  ILE  64          1HG1      ILE  64 -10.804   0.887   4.619
  509   2HG1  ILE  64          2HG1      ILE  64  -9.065   0.592   4.383
  510   1HG2  ILE  64          1HG2      ILE  64 -12.187   1.799   2.698
  511   2HG2  ILE  64          2HG2      ILE  64 -11.010   3.133   2.621
  512   3HG2  ILE  64          3HG2      ILE  64 -11.375   2.177   1.161
  513   1HD1  ILE  64          1HD1      ILE  64 -10.475   3.300   4.229
  514   2HD1  ILE  64          2HD1      ILE  64  -9.485   2.729   5.589
  515   3HD1  ILE  64          3HD1      ILE  64  -8.732   3.036   4.008
  516    H    ALA  65           H        ALA  65 -12.514   0.186   0.624
  517    HA   ALA  65           HA       ALA  65 -10.956   0.934  -1.676
  518   1HB   ALA  65          1HB       ALA  65 -12.869  -1.417  -1.972
  519   2HB   ALA  65          2HB       ALA  65 -12.105  -0.535  -3.298
  520   3HB   ALA  65          3HB       ALA  65 -11.101  -1.499  -2.193
  521    H    GLN  66           H        GLN  66 -11.845   2.770  -2.062
  522    HA   GLN  66           HA       GLN  66 -14.811   2.953  -1.800
  523   1HB   GLN  66          1HB       GLN  66 -13.464   4.149  -0.093
  524   2HB   GLN  66          2HB       GLN  66 -12.512   4.909  -1.376
  525   1HG   GLN  66          1HG       GLN  66 -15.075   5.500  -2.130
  526   2HG   GLN  66          2HG       GLN  66 -15.185   5.541  -0.346
  527   1HE2  GLN  66          2HE2      GLN  66 -13.248   6.651  -3.130
  528   2HE2  GLN  66          1HE2      GLN  66 -12.653   8.145  -2.385
  529    H    GLY  67           H        GLY  67 -14.596   1.989  -3.983
  530   1HA   GLY  67          1HA       GLY  67 -14.370   4.077  -6.097
  531   2HA   GLY  67          2HA       GLY  67 -13.508   2.558  -6.185
  532    H    GLU  68           H        GLU  68 -14.695   2.426  -8.162
  533    HA   GLU  68           HA       GLU  68 -17.398   1.768  -8.484
  534   1HB   GLU  68          1HB       GLU  68 -14.862   0.644  -9.777
  535   2HB   GLU  68          2HB       GLU  68 -16.494   0.426 -10.431
  536   1HG   GLU  68          1HG       GLU  68 -16.731   2.899 -10.622
  537   2HG   GLU  68          2HG       GLU  68 -15.080   3.093  -9.996
  538    H    ASP  69           H        ASP  69 -14.603  -0.276  -7.371
  539    HA   ASP  69           HA       ASP  69 -16.617  -2.408  -6.725
  540   1HB   ASP  69          1HB       ASP  69 -13.777  -3.127  -6.794
  541   2HB   ASP  69          2HB       ASP  69 -15.203  -4.062  -7.233
  542    H    GLU  70           H        GLU  70 -16.641  -0.287  -5.114
  543    HA   GLU  70           HA       GLU  70 -14.476   0.070  -3.390
  544   1HB   GLU  70          1HB       GLU  70 -16.303   0.943  -1.826
  545   2HB   GLU  70          2HB       GLU  70 -16.156   1.720  -3.408
  546   1HG   GLU  70          1HG       GLU  70 -18.193   1.149  -4.082
  547   2HG   GLU  70          2HG       GLU  70 -18.023  -0.522  -3.506
  548    H    GLN  71           H        GLN  71 -17.388  -1.155  -1.836
  549    HA   GLN  71           HA       GLN  71 -16.344  -2.701   0.093
  550   1HB   GLN  71          1HB       GLN  71 -18.852  -2.488  -1.281
  551   2HB   GLN  71          2HB       GLN  71 -18.475  -4.216  -1.120
  552   1HG   GLN  71          1HG       GLN  71 -18.693  -2.151   1.091
  553   2HG   GLN  71          2HG       GLN  71 -19.722  -3.573   0.834
  554   1HE2  GLN  71          1HE2      GLN  71 -17.524  -5.446   0.223
  555   2HE2  GLN  71          2HE2      GLN  71 -16.528  -5.600   1.597
  556    H    GLU  72           H        GLU  72 -16.791  -3.741  -3.287
  557    HA   GLU  72           HA       GLU  72 -16.144  -6.436  -2.791
  558   1HB   GLU  72          1HB       GLU  72 -17.270  -5.899  -4.886
  559   2HB   GLU  72          2HB       GLU  72 -16.209  -4.505  -5.171
  560   1HG   GLU  72          1HG       GLU  72 -14.458  -5.731  -5.938
  561   2HG   GLU  72          2HG       GLU  72 -15.092  -7.293  -5.362
  562    H    ALA  73           H        ALA  73 -14.108  -3.653  -3.808
  563    HA   ALA  73           HA       ALA  73 -11.697  -5.103  -4.343
  564   1HB   ALA  73          1HB       ALA  73 -12.441  -2.320  -3.435
  565   2HB   ALA  73          2HB       ALA  73 -10.817  -2.734  -4.072
  566   3HB   ALA  73          3HB       ALA  73 -12.294  -2.844  -5.096
  567    H    LEU  74           H        LEU  74 -12.914  -3.253  -1.564
  568    HA   LEU  74           HA       LEU  74 -10.687  -3.703   0.140
  569   1HB   LEU  74          1HB       LEU  74 -12.310  -2.939   1.921
  570   2HB   LEU  74          2HB       LEU  74 -12.163  -1.890   0.477
  571    HG   LEU  74           HG       LEU  74 -14.234  -3.569  -0.174
  572   1HD1  LEU  74          1HD1      LEU  74 -14.389  -2.776   2.768
  573   2HD1  LEU  74          2HD1      LEU  74 -15.715  -3.482   1.811
  574   3HD1  LEU  74          3HD1      LEU  74 -14.254  -4.444   2.146
  575   1HD2  LEU  74          1HD2      LEU  74 -14.248  -0.837   1.177
  576   2HD2  LEU  74          2HD2      LEU  74 -14.035  -1.156  -0.558
  577   3HD2  LEU  74          3HD2      LEU  74 -15.578  -1.529   0.220
  578    H    GLU  75           H        GLU  75 -13.824  -5.480  -0.046
  579    HA   GLU  75           HA       GLU  75 -13.151  -7.278   2.052
  580   1HB   GLU  75          1HB       GLU  75 -14.982  -8.679   1.184
  581   2HB   GLU  75          2HB       GLU  75 -15.447  -6.979   1.355
  582   1HG   GLU  75          1HG       GLU  75 -15.035  -6.658  -1.087
  583   2HG   GLU  75          2HG       GLU  75 -14.701  -8.398  -1.235
  584    H    LYS  76           H        LYS  76 -12.822  -7.701  -1.548
  585    HA   LYS  76           HA       LYS  76 -11.781 -10.321  -1.326
  586   1HB   LYS  76          1HB       LYS  76 -11.119 -10.119  -3.573
  587   2HB   LYS  76          2HB       LYS  76 -12.570  -9.103  -3.413
  588   1HG   LYS  76          1HG       LYS  76 -11.204  -7.086  -3.346
  589   2HG   LYS  76          2HG       LYS  76  -9.714  -8.074  -3.306
  590   1HD   LYS  76          1HD       LYS  76 -10.499  -9.099  -5.529
  591   2HD   LYS  76          2HD       LYS  76 -11.707  -7.804  -5.575
  592   1HE   LYS  76          1HE       LYS  76  -8.699  -7.594  -5.729
  593   2HE   LYS  76          2HE       LYS  76  -9.927  -6.969  -6.848
  594   1HZ   LYS  76          1HZ       LYS  76 -10.578  -5.421  -5.165
  595   2HZ   LYS  76          2HZ       LYS  76  -9.407  -5.948  -4.133
  596   3HZ   LYS  76          3HZ       LYS  76  -9.003  -5.221  -5.567
  597    H    LEU  77           H        LEU  77 -10.082  -7.167  -1.475
  598    HA   LEU  77           HA       LEU  77  -7.461  -8.101  -1.271
  599   1HB   LEU  77          1HB       LEU  77  -9.003  -5.643  -0.961
  600   2HB   LEU  77          2HB       LEU  77  -7.539  -5.679   0.065
  601    HG   LEU  77           HG       LEU  77  -7.327  -4.850  -2.459
  602   1HD1  LEU  77          1HD1      LEU  77  -5.681  -5.046  -0.657
  603   2HD1  LEU  77          2HD1      LEU  77  -5.553  -6.800  -0.977
  604   3HD1  LEU  77          3HD1      LEU  77  -5.008  -5.627  -2.216
  605   1HD2  LEU  77          1HD2      LEU  77  -6.846  -7.876  -2.596
  606   2HD2  LEU  77          2HD2      LEU  77  -8.092  -7.011  -3.536
  607   3HD2  LEU  77          3HD2      LEU  77  -6.360  -6.696  -3.824
  608    H    ALA  78           H        ALA  78  -9.534  -6.915   1.486
  609    HA   ALA  78           HA       ALA  78  -7.632  -7.655   3.450
  610   1HB   ALA  78          1HB       ALA  78  -9.494  -6.132   3.940
  611   2HB   ALA  78          2HB       ALA  78 -10.653  -7.470   3.736
  612   3HB   ALA  78          3HB       ALA  78  -9.467  -7.497   5.058
  613    H    ALA  79           H        ALA  79 -10.138  -9.600   1.817
  614    HA   ALA  79           HA       ALA  79 -10.032 -11.879   3.535
  615   1HB   ALA  79          1HB       ALA  79 -11.691 -11.490   1.689
  616   2HB   ALA  79          2HB       ALA  79 -10.364 -11.699   0.512
  617   3HB   ALA  79          3HB       ALA  79 -10.867 -13.066   1.537
  618    H    TYR  80           H        TYR  80  -8.240 -10.944   0.591
  619    HA   TYR  80           HA       TYR  80  -6.579 -13.243   0.409
  620   1HB   TYR  80          1HB       TYR  80  -7.158 -11.767  -1.409
  621   2HB   TYR  80          2HB       TYR  80  -6.496 -10.378  -0.554
  622    HD1  TYR  80           HD1      TYR  80  -5.048 -13.776  -1.296
  623    HD2  TYR  80           HD2      TYR  80  -4.639  -9.493  -1.485
  624    HE1  TYR  80           HE1      TYR  80  -2.738 -14.033  -2.191
  625    HE2  TYR  80           HE2      TYR  80  -2.319  -9.752  -2.347
  626    HH   TYR  80           HH       TYR  80  -0.760 -11.166  -2.971
  627    H    VAL  81           H        VAL  81  -5.684  -9.955   1.249
  628    HA   VAL  81           HA       VAL  81  -3.058 -10.000   1.833
  629    HB   VAL  81           HB       VAL  81  -3.574  -8.063   3.321
  630   1HG1  VAL  81          1HG2      VAL  81  -3.641  -7.897   0.829
  631   2HG1  VAL  81          2HG2      VAL  81  -5.367  -8.328   0.879
  632   3HG1  VAL  81          3HG2      VAL  81  -4.821  -6.798   1.613
  633   1HG2  VAL  81          1HG1      VAL  81  -5.549  -9.142   4.420
  634   2HG2  VAL  81          2HG1      VAL  81  -5.983  -7.558   3.746
  635   3HG2  VAL  81          3HG1      VAL  81  -6.440  -9.059   2.896
  636    H    GLN  82           H        GLN  82  -5.503 -11.269   4.055
  637    HA   GLN  82           HA       GLN  82  -3.387 -11.552   6.143
  638   1HB   GLN  82          1HB       GLN  82  -5.215 -11.288   7.688
  639   2HB   GLN  82          2HB       GLN  82  -5.419 -10.058   6.430
  640   1HG   GLN  82          1HG       GLN  82  -7.125 -11.567   5.332
  641   2HG   GLN  82          2HG       GLN  82  -6.778 -12.763   6.563
  642   1HE2  GLN  82          2HE2      GLN  82  -8.726 -10.221   5.831
  643   2HE2  GLN  82          1HE2      GLN  82  -9.315  -9.712   7.422
  644    H    GLU  83           H        GLU  83  -4.960 -13.453   3.860
  645    HA   GLU  83           HA       GLU  83  -6.201 -15.264   5.684
  646   1HB   GLU  83          1HB       GLU  83  -6.983 -16.383   3.694
  647   2HB   GLU  83          2HB       GLU  83  -7.042 -14.595   3.546
  648   1HG   GLU  83          1HG       GLU  83  -4.929 -14.657   2.238
  649   2HG   GLU  83          2HG       GLU  83  -4.909 -16.433   2.348
  650    H    GLU  84           H        GLU  84  -3.093 -15.692   3.902
  651    HA   GLU  84           HA       GLU  84  -2.885 -18.209   5.509
  652   1HB   GLU  84          1HB       GLU  84  -1.162 -18.881   3.796
  653   2HB   GLU  84          2HB       GLU  84  -2.827 -18.775   3.198
  654   1HG   GLU  84          1HG       GLU  84  -1.165 -16.306   2.918
  655   2HG   GLU  84          2HG       GLU  84  -0.790 -17.685   1.852
  656    H    VAL  85           H        VAL  85   0.072 -17.484   4.196
  657    HA   VAL  85           HA       VAL  85   1.021 -15.480   6.129
  658    HB   VAL  85           HB       VAL  85   2.149 -18.354   5.934
  659   1HG1  VAL  85          1HG1      VAL  85   3.686 -15.944   7.137
  660   2HG1  VAL  85          2HG1      VAL  85   4.170 -17.654   7.262
  661   3HG1  VAL  85          3HG1      VAL  85   4.154 -16.872   5.692
  662   1HG2  VAL  85          1HG2      VAL  85   0.533 -17.994   7.854
  663   2HG2  VAL  85          2HG2      VAL  85   2.165 -18.370   8.419
  664   3HG2  VAL  85          3HG2      VAL  85   1.569 -16.692   8.485
  Start of MODEL   14
    1   1H    VAL   2          1H        VAL   2 -17.685   6.704  -0.877
    2   2H    VAL   2          2H        VAL   2 -18.051   6.011  -2.365
    3   3H    VAL   2          3H        VAL   2 -19.216   6.903  -1.543
    4    HA   VAL   2           HA       VAL   2 -19.344   5.358   0.173
    5    HB   VAL   2           HB       VAL   2 -20.735   5.075  -1.818
    6   1HG1  VAL   2          1HG1      VAL   2 -18.985   4.411  -3.466
    7   2HG1  VAL   2          2HG1      VAL   2 -18.776   2.887  -2.578
    8   3HG1  VAL   2          3HG1      VAL   2 -20.324   3.238  -3.386
    9   1HG2  VAL   2          1HG2      VAL   2 -21.029   3.730   0.230
   10   2HG2  VAL   2          2HG2      VAL   2 -21.457   2.804  -1.230
   11   3HG2  VAL   2          3HG2      VAL   2 -19.902   2.511  -0.419
   12    H    GLN   3           H        GLN   3 -17.682   4.992   1.504
   13    HA   GLN   3           HA       GLN   3 -15.468   3.342   0.456
   14   1HB   GLN   3          1HB       GLN   3 -15.358   5.716   1.645
   15   2HB   GLN   3          2HB       GLN   3 -15.411   4.738   3.128
   16   1HG   GLN   3          1HG       GLN   3 -13.417   3.441   2.238
   17   2HG   GLN   3          2HG       GLN   3 -13.463   4.410   0.813
   18   1HE2  GLN   3          2HE2      GLN   3 -13.542   5.078   4.375
   19   2HE2  GLN   3          1HE2      GLN   3 -12.370   6.376   4.282
   20    H    GLN   4           H        GLN   4 -15.201   1.273   1.052
   21    HA   GLN   4           HA       GLN   4 -16.274   0.574   3.747
   22   1HB   GLN   4          1HB       GLN   4 -16.060  -1.423   1.484
   23   2HB   GLN   4          2HB       GLN   4 -16.882  -1.633   3.032
   24   1HG   GLN   4          1HG       GLN   4 -18.609  -0.011   2.312
   25   2HG   GLN   4          2HG       GLN   4 -17.696   0.275   0.812
   26   1HE2  GLN   4          2HE2      GLN   4 -19.665  -0.394  -0.309
   27   2HE2  GLN   4          1HE2      GLN   4 -20.047  -2.098  -0.482
   28    H    LYS   5           H        LYS   5 -14.886  -1.111   4.862
   29    HA   LYS   5           HA       LYS   5 -12.337  -1.682   3.583
   30   1HB   LYS   5          1HB       LYS   5 -11.090  -0.850   5.547
   31   2HB   LYS   5          2HB       LYS   5 -11.846   0.451   4.615
   32   1HG   LYS   5          1HG       LYS   5 -13.190  -0.749   7.046
   33   2HG   LYS   5          2HG       LYS   5 -11.990   0.559   7.192
   34   1HD   LYS   5          1HD       LYS   5 -14.502   0.686   5.485
   35   2HD   LYS   5          2HD       LYS   5 -14.337   1.436   7.082
   36   1HE   LYS   5          1HE       LYS   5 -12.530   2.017   4.696
   37   2HE   LYS   5          2HE       LYS   5 -13.951   2.993   5.122
   38   1HZ   LYS   5          1HZ       LYS   5 -11.616   2.553   6.859
   39   2HZ   LYS   5          2HZ       LYS   5 -11.930   3.919   6.002
   40   3HZ   LYS   5          3HZ       LYS   5 -12.935   3.469   7.226
   41    H    VAL   6           H        VAL   6 -11.863  -3.731   4.043
   42    HA   VAL   6           HA       VAL   6 -13.152  -4.959   6.441
   43    HB   VAL   6           HB       VAL   6 -13.010  -7.128   5.164
   44   1HG1  VAL   6          1HG1      VAL   6 -14.653  -4.884   3.923
   45   2HG1  VAL   6          2HG1      VAL   6 -14.991  -6.621   3.748
   46   3HG1  VAL   6          3HG1      VAL   6 -15.109  -5.845   5.351
   47   1HG2  VAL   6          1HG2      VAL   6 -12.476  -5.262   2.808
   48   2HG2  VAL   6          2HG2      VAL   6 -11.343  -6.473   3.455
   49   3HG2  VAL   6          3HG2      VAL   6 -12.867  -6.994   2.692
   50    H    GLU   7           H        GLU   7 -11.615  -5.559   7.985
   51    HA   GLU   7           HA       GLU   7  -8.896  -5.036   7.078
   52   1HB   GLU   7          1HB       GLU   7  -8.237  -5.144   9.410
   53   2HB   GLU   7          2HB       GLU   7  -9.640  -4.074   9.246
   54   1HG   GLU   7          1HG       GLU   7 -11.096  -5.720  10.209
   55   2HG   GLU   7          2HG       GLU   7  -9.895  -7.017   9.974
   56    H    VAL   8           H        VAL   8  -7.080  -6.260   7.883
   57    HA   VAL   8           HA       VAL   8  -7.460  -9.181   7.850
   58    HB   VAL   8           HB       VAL   8  -6.422  -9.462   5.804
   59   1HG1  VAL   8          1HG2      VAL   8  -8.425  -8.023   5.367
   60   2HG1  VAL   8          2HG2      VAL   8  -7.364  -6.600   5.360
   61   3HG1  VAL   8          3HG2      VAL   8  -7.161  -7.868   4.123
   62   1HG2  VAL   8          1HG1      VAL   8  -5.012  -6.798   6.166
   63   2HG2  VAL   8          2HG1      VAL   8  -4.302  -8.412   6.397
   64   3HG2  VAL   8          3HG1      VAL   8  -4.801  -7.891   4.774
   65    H    ARG   9           H        ARG   9  -5.593 -10.222   8.873
   66    HA   ARG   9           HA       ARG   9  -3.526  -8.309   9.844
   67   1HB   ARG   9          1HB       ARG   9  -3.764 -10.141  11.323
   68   2HB   ARG   9          2HB       ARG   9  -3.743 -11.345   9.993
   69   1HG   ARG   9          1HG       ARG   9  -1.390  -9.550  10.537
   70   2HG   ARG   9          2HG       ARG   9  -1.624 -11.029  11.448
   71   1HD   ARG   9          1HD       ARG   9  -0.924 -10.714   8.561
   72   2HD   ARG   9          2HD       ARG   9  -0.337 -11.910   9.723
   73    HE   ARG   9           HE       ARG   9  -2.675 -12.014   7.967
   74   1HH1  ARG   9          1HH2      ARG   9  -1.241 -13.393  10.870
   75   2HH1  ARG   9          2HH2      ARG   9  -2.033 -14.939  10.715
   76   1HH2  ARG   9          2HH1      ARG   9  -3.702 -14.077   7.691
   77   2HH2  ARG   9          1HH1      ARG   9  -3.509 -15.289   8.919
   78    H    LEU  10           H        LEU  10  -2.222  -7.489   8.352
   79    HA   LEU  10           HA       LEU  10  -2.277  -8.521   5.684
   80   1HB   LEU  10          1HB       LEU  10  -2.008  -6.169   6.115
   81   2HB   LEU  10          2HB       LEU  10  -0.497  -6.439   7.014
   82    HG   LEU  10           HG       LEU  10   0.710  -6.954   5.109
   83   1HD1  LEU  10          1HD1      LEU  10  -0.809  -8.681   4.262
   84   2HD1  LEU  10          2HD1      LEU  10  -1.918  -7.431   3.625
   85   3HD1  LEU  10          3HD1      LEU  10  -0.274  -7.596   2.946
   86   1HD2  LEU  10          1HD2      LEU  10  -0.014  -4.636   5.146
   87   2HD2  LEU  10          2HD2      LEU  10   0.308  -5.237   3.512
   88   3HD2  LEU  10          3HD2      LEU  10  -1.390  -5.033   4.065
   89    H    LYS  11           H        LYS  11  -1.717 -10.713   5.964
   90    HA   LYS  11           HA       LYS  11   0.821 -11.563   6.990
   91   1HB   LYS  11          1HB       LYS  11  -0.686 -13.291   6.892
   92   2HB   LYS  11          2HB       LYS  11  -1.430 -12.744   5.384
   93   1HG   LYS  11          1HG       LYS  11   1.343 -13.973   5.418
   94   2HG   LYS  11          2HG       LYS  11  -0.163 -14.923   5.296
   95   1HD   LYS  11          1HD       LYS  11   0.784 -12.830   3.296
   96   2HD   LYS  11          2HD       LYS  11   0.514 -14.574   3.049
   97   1HE   LYS  11          1HE       LYS  11  -1.887 -14.261   3.632
   98   2HE   LYS  11          2HE       LYS  11  -1.595 -12.506   3.772
   99   1HZ   LYS  11          1HZ       LYS  11  -1.185 -14.067   1.323
  100   2HZ   LYS  11          2HZ       LYS  11  -2.489 -13.118   1.634
  101   3HZ   LYS  11          3HZ       LYS  11  -1.002 -12.431   1.500
  102    H    THR  12           H        THR  12  -0.342 -10.697   3.757
  103    HA   THR  12           HA       THR  12   1.931 -11.234   2.230
  104    HB   THR  12           HB       THR  12   0.378  -8.645   1.922
  105    HG1  THR  12           HG1      THR  12  -1.119 -10.384   2.175
  106   1HG2  THR  12          1HG2      THR  12   0.795  -9.063  -0.459
  107   2HG2  THR  12          2HG2      THR  12   2.331  -9.042   0.450
  108   3HG2  THR  12          3HG2      THR  12   1.617 -10.584  -0.047
  109    H    GLY  13           H        GLY  13   1.138  -8.438   4.253
  110   1HA   GLY  13          1HA       GLY  13   2.310  -6.648   5.050
  111   2HA   GLY  13          2HA       GLY  13   3.863  -7.455   4.639
  112    H    LEU  14           H        LEU  14   3.912  -7.735   2.065
  113    HA   LEU  14           HA       LEU  14   3.438  -6.864  -0.075
  114   1HB   LEU  14          1HB       LEU  14   2.690  -4.407   1.487
  115   2HB   LEU  14          2HB       LEU  14   3.295  -4.228  -0.164
  116    HG   LEU  14           HG       LEU  14   1.505  -5.660  -1.036
  117   1HD1  LEU  14          1HD2      LEU  14   0.696  -5.924   1.878
  118   2HD1  LEU  14          2HD2      LEU  14  -0.308  -6.445   0.498
  119   3HD1  LEU  14          3HD2      LEU  14   1.269  -7.223   0.807
  120   1HD2  LEU  14          1HD1      LEU  14   0.472  -3.574   0.929
  121   2HD2  LEU  14          2HD1      LEU  14   1.021  -3.262  -0.737
  122   3HD2  LEU  14          3HD1      LEU  14  -0.437  -4.240  -0.447
  123    H    GLN  15           H        GLN  15   5.379  -7.726  -0.021
  124    HA   GLN  15           HA       GLN  15   7.623  -5.790   0.350
  125   1HB   GLN  15          1HB       GLN  15   7.471  -8.736   1.050
  126   2HB   GLN  15          2HB       GLN  15   8.971  -7.769   1.126
  127   1HG   GLN  15          1HG       GLN  15   8.156  -6.405   2.852
  128   2HG   GLN  15          2HG       GLN  15   6.472  -6.678   2.354
  129   1HE2  GLN  15          2HE2      GLN  15   5.970  -6.999   4.668
  130   2HE2  GLN  15          1HE2      GLN  15   6.120  -8.632   5.240
  131    H    ALA  16           H        ALA  16   6.640  -8.843  -1.543
  132    HA   ALA  16           HA       ALA  16   8.418  -7.575  -3.575
  133   1HB   ALA  16          1HB       ALA  16   9.755  -9.132  -2.236
  134   2HB   ALA  16          2HB       ALA  16   8.632 -10.451  -2.643
  135   3HB   ALA  16          3HB       ALA  16   9.600  -9.679  -3.923
  136    H    ARG  17           H        ARG  17   5.782  -9.945  -2.995
  137    HA   ARG  17           HA       ARG  17   5.451  -9.798  -5.974
  138   1HB   ARG  17          1HB       ARG  17   5.261 -12.462  -4.537
  139   2HB   ARG  17          2HB       ARG  17   5.287 -12.135  -6.282
  140   1HG   ARG  17          1HG       ARG  17   7.493 -12.833  -5.871
  141   2HG   ARG  17          2HG       ARG  17   7.616 -11.060  -5.779
  142   1HD   ARG  17          1HD       ARG  17   8.761 -11.872  -3.845
  143   2HD   ARG  17          2HD       ARG  17   7.181 -11.320  -3.252
  144    HE   ARG  17           HE       ARG  17   7.448 -14.175  -3.962
  145   1HH1  ARG  17          1HH2      ARG  17   7.045 -11.733  -1.393
  146   2HH1  ARG  17          2HH2      ARG  17   7.511 -12.830  -0.125
  147   1HH2  ARG  17          2HH1      ARG  17   7.674 -15.666  -2.243
  148   2HH2  ARG  17          1HH1      ARG  17   7.624 -15.129  -0.585
  149    HA   PRO  18           HA       PRO  18   1.191 -11.675  -4.302
  150   1HB   PRO  18          1HB       PRO  18   0.936 -11.576  -1.594
  151   2HB   PRO  18          2HB       PRO  18   1.756 -12.965  -2.383
  152   1HG   PRO  18          1HG       PRO  18   3.104 -10.410  -1.398
  153   2HG   PRO  18          2HG       PRO  18   3.531 -11.994  -0.789
  154   1HD   PRO  18          1HD       PRO  18   4.942 -11.124  -2.734
  155   2HD   PRO  18          2HD       PRO  18   4.185 -12.715  -3.033
  156    H    ALA  19           H        ALA  19   2.914  -9.283  -2.326
  157    HA   ALA  19           HA       ALA  19   0.953  -7.389  -1.781
  158   1HB   ALA  19          1HB       ALA  19   3.266  -7.695  -0.928
  159   2HB   ALA  19          2HB       ALA  19   3.878  -7.148  -2.512
  160   3HB   ALA  19          3HB       ALA  19   2.942  -6.016  -1.473
  161    H    ALA  20           H        ALA  20   3.065  -7.843  -4.626
  162    HA   ALA  20           HA       ALA  20   2.433  -5.291  -5.880
  163   1HB   ALA  20          1HB       ALA  20   3.550  -7.900  -7.013
  164   2HB   ALA  20          2HB       ALA  20   3.507  -6.333  -7.855
  165   3HB   ALA  20          3HB       ALA  20   4.516  -6.533  -6.404
  166    H    LEU  21           H        LEU  21   1.378  -8.662  -6.015
  167    HA   LEU  21           HA       LEU  21  -0.636  -8.487  -8.004
  168   1HB   LEU  21          1HB       LEU  21   0.370 -10.463  -6.593
  169   2HB   LEU  21          2HB       LEU  21  -0.999 -10.146  -5.512
  170    HG   LEU  21           HG       LEU  21  -1.173 -10.727  -8.506
  171   1HD1  LEU  21          1HD1      LEU  21  -0.468 -12.685  -7.156
  172   2HD1  LEU  21          2HD1      LEU  21  -1.865 -12.435  -6.083
  173   3HD1  LEU  21          3HD1      LEU  21  -2.116 -12.893  -7.787
  174   1HD2  LEU  21          1HD2      LEU  21  -3.326 -10.442  -6.364
  175   2HD2  LEU  21          2HD2      LEU  21  -3.017  -9.300  -7.697
  176   3HD2  LEU  21          3HD2      LEU  21  -3.610 -10.939  -8.050
  177    H    PHE  22           H        PHE  22  -0.805  -8.065  -4.522
  178    HA   PHE  22           HA       PHE  22  -3.421  -7.316  -3.886
  179   1HB   PHE  22          1HB       PHE  22  -1.637  -7.731  -2.276
  180   2HB   PHE  22          2HB       PHE  22  -0.673  -6.418  -2.953
  181    HD1  PHE  22           HD1      PHE  22  -2.105  -7.241  -0.087
  182    HD2  PHE  22           HD2      PHE  22  -2.182  -4.025  -2.928
  183    HE1  PHE  22           HE1      PHE  22  -2.502  -5.624   1.752
  184    HE2  PHE  22           HE2      PHE  22  -2.605  -2.404  -1.119
  185    HZ   PHE  22           HZ       PHE  22  -2.795  -3.198   1.245
  186    H    VAL  23           H        VAL  23  -0.716  -5.015  -4.364
  187    HA   VAL  23           HA       VAL  23  -2.423  -2.757  -4.528
  188    HB   VAL  23           HB       VAL  23   0.463  -3.256  -5.302
  189   1HG1  VAL  23          1HG2      VAL  23  -1.038  -0.620  -5.101
  190   2HG1  VAL  23          2HG2      VAL  23   0.719  -0.803  -5.299
  191   3HG1  VAL  23          3HG2      VAL  23  -0.381  -1.321  -6.599
  192   1HG2  VAL  23          1HG1      VAL  23  -0.955  -1.883  -2.960
  193   2HG2  VAL  23          2HG1      VAL  23  -0.140  -3.461  -2.897
  194   3HG2  VAL  23          3HG1      VAL  23   0.802  -1.984  -3.172
  195    H    GLN  24           H        GLN  24  -1.259  -4.984  -7.028
  196    HA   GLN  24           HA       GLN  24  -1.956  -3.534  -9.354
  197   1HB   GLN  24          1HB       GLN  24  -0.474  -5.430  -9.212
  198   2HB   GLN  24          2HB       GLN  24  -1.767  -6.463  -8.605
  199   1HG   GLN  24          1HG       GLN  24  -1.997  -5.169 -11.339
  200   2HG   GLN  24          2HG       GLN  24  -1.038  -6.648 -11.021
  201   1HE2  GLN  24          2HE2      GLN  24  -2.813  -7.561  -8.818
  202   2HE2  GLN  24          1HE2      GLN  24  -4.140  -8.257  -9.715
  203    H    GLU  25           H        GLU  25  -3.840  -5.988  -7.528
  204    HA   GLU  25           HA       GLU  25  -6.117  -5.504  -9.255
  205   1HB   GLU  25          1HB       GLU  25  -7.250  -7.087  -7.525
  206   2HB   GLU  25          2HB       GLU  25  -5.943  -7.738  -8.533
  207   1HG   GLU  25          1HG       GLU  25  -4.319  -7.337  -6.709
  208   2HG   GLU  25          2HG       GLU  25  -5.624  -6.726  -5.684
  209    H    ALA  26           H        ALA  26  -5.244  -4.606  -5.933
  210    HA   ALA  26           HA       ALA  26  -7.598  -3.310  -5.106
  211   1HB   ALA  26          1HB       ALA  26  -4.690  -2.492  -4.821
  212   2HB   ALA  26          2HB       ALA  26  -6.019  -1.900  -3.785
  213   3HB   ALA  26          3HB       ALA  26  -5.552  -3.625  -3.741
  214    H    ASN  27           H        ASN  27  -4.806  -2.162  -7.032
  215    HA   ASN  27           HA       ASN  27  -5.750   0.395  -7.788
  216   1HB   ASN  27          1HB       ASN  27  -3.746  -1.646  -8.642
  217   2HB   ASN  27          2HB       ASN  27  -4.360  -0.663  -9.971
  218   1HD2  ASN  27          2HD2      ASN  27  -2.072  -0.805  -7.560
  219   2HD2  ASN  27          1HD2      ASN  27  -1.562   0.880  -7.466
  220    H    ARG  28           H        ARG  28  -6.121  -2.831  -9.291
  221    HA   ARG  28           HA       ARG  28  -7.322  -2.068 -11.744
  222   1HB   ARG  28          1HB       ARG  28  -7.997  -4.443  -9.962
  223   2HB   ARG  28          2HB       ARG  28  -8.486  -4.252 -11.660
  224   1HG   ARG  28          1HG       ARG  28  -6.038  -4.013 -12.267
  225   2HG   ARG  28          2HG       ARG  28  -5.630  -4.431 -10.600
  226   1HD   ARG  28          1HD       ARG  28  -6.975  -6.149 -12.720
  227   2HD   ARG  28          2HD       ARG  28  -5.430  -6.432 -11.900
  228    HE   ARG  28           HE       ARG  28  -7.899  -6.395 -10.255
  229   1HH1  ARG  28          2HH1      ARG  28  -5.268  -8.195 -11.741
  230   2HH1  ARG  28          1HH1      ARG  28  -5.754  -9.754 -11.118
  231   1HH2  ARG  28          1HH2      ARG  28  -8.470  -8.376  -9.262
  232   2HH2  ARG  28          2HH2      ARG  28  -7.573  -9.834  -9.586
  233    H    PHE  29           H        PHE  29  -8.772  -2.675  -8.527
  234    HA   PHE  29           HA       PHE  29 -11.411  -1.747  -9.169
  235   1HB   PHE  29          1HB       PHE  29  -9.810  -1.310  -6.647
  236   2HB   PHE  29          2HB       PHE  29 -11.582  -1.354  -6.770
  237    HD1  PHE  29           HD1      PHE  29  -9.040  -3.103  -5.421
  238    HD2  PHE  29           HD2      PHE  29 -12.322  -3.739  -8.120
  239    HE1  PHE  29           HE1      PHE  29  -9.129  -5.495  -4.739
  240    HE2  PHE  29           HE2      PHE  29 -12.460  -6.110  -7.417
  241    HZ   PHE  29           HZ       PHE  29 -10.883  -6.986  -5.685
  242    H    THR  30           H        THR  30 -11.663   0.225 -10.149
  243    HA   THR  30           HA       THR  30  -9.637   2.220  -9.916
  244    HB   THR  30           HB       THR  30 -11.734   1.673 -11.623
  245    HG1  THR  30           HG1      THR  30  -9.711   2.573 -12.111
  246   1HG2  THR  30          1HG2      THR  30 -12.966   3.793 -11.874
  247   2HG2  THR  30          2HG2      THR  30 -13.331   3.015 -10.315
  248   3HG2  THR  30          3HG2      THR  30 -12.219   4.406 -10.379
  249    H    SER  31           H        SER  31 -12.265   1.465  -7.851
  250    HA   SER  31           HA       SER  31 -12.976   3.611  -6.444
  251   1HB   SER  31          1HB       SER  31 -11.837   1.004  -5.367
  252   2HB   SER  31          2HB       SER  31 -13.154   1.951  -4.640
  253    HG   SER  31           HG       SER  31 -13.532  -0.032  -6.195
  254    H    ASP  32           H        ASP  32 -12.293   4.695  -4.581
  255    HA   ASP  32           HA       ASP  32  -9.475   5.239  -4.317
  256   1HB   ASP  32          1HB       ASP  32 -11.575   6.691  -3.771
  257   2HB   ASP  32          2HB       ASP  32 -11.601   5.754  -2.253
  258    H    VAL  33           H        VAL  33  -8.403   3.336  -3.835
  259    HA   VAL  33           HA       VAL  33  -9.452   1.632  -1.670
  260    HB   VAL  33           HB       VAL  33  -8.006  -0.099  -2.476
  261   1HG1  VAL  33          1HG2      VAL  33  -9.240   1.543  -4.713
  262   2HG1  VAL  33          2HG2      VAL  33  -8.779  -0.174  -4.864
  263   3HG1  VAL  33          3HG2      VAL  33 -10.074   0.320  -3.731
  264   1HG2  VAL  33          1HG1      VAL  33  -6.010   1.321  -2.898
  265   2HG2  VAL  33          2HG1      VAL  33  -6.392   0.259  -4.283
  266   3HG2  VAL  33          3HG1      VAL  33  -6.812   1.987  -4.345
  267    H    PHE  34           H        PHE  34  -8.258   0.831   0.033
  268    HA   PHE  34           HA       PHE  34  -5.734   2.202   0.670
  269   1HB   PHE  34          1HB       PHE  34  -8.064   2.483   2.596
  270   2HB   PHE  34          2HB       PHE  34  -6.431   3.149   2.726
  271    HD1  PHE  34           HD1      PHE  34  -5.692   5.012   1.292
  272    HD2  PHE  34           HD2      PHE  34  -9.761   3.597   1.228
  273    HE1  PHE  34           HE1      PHE  34  -6.439   7.190   0.346
  274    HE2  PHE  34           HE2      PHE  34 -10.492   5.751   0.239
  275    HZ   PHE  34           HZ       PHE  34  -8.848   7.569  -0.134
  276    H    LEU  35           H        LEU  35  -4.877   1.570   2.801
  277    HA   LEU  35           HA       LEU  35  -5.964  -0.926   3.929
  278   1HB   LEU  35          1HB       LEU  35  -4.143  -1.555   2.314
  279   2HB   LEU  35          2HB       LEU  35  -3.009  -0.555   3.264
  280    HG   LEU  35           HG       LEU  35  -3.528  -1.915   5.277
  281   1HD1  LEU  35          1HD2      LEU  35  -5.876  -2.481   4.616
  282   2HD1  LEU  35          2HD2      LEU  35  -5.235  -3.574   3.366
  283   3HD1  LEU  35          3HD2      LEU  35  -4.937  -3.915   5.085
  284   1HD2  LEU  35          1HD1      LEU  35  -1.681  -2.635   3.780
  285   2HD2  LEU  35          2HD1      LEU  35  -2.488  -4.023   4.547
  286   3HD2  LEU  35          3HD1      LEU  35  -2.835  -3.623   2.849
  287    H    GLU  36           H        GLU  36  -6.095  -0.639   6.051
  288    HA   GLU  36           HA       GLU  36  -4.804   1.793   7.238
  289   1HB   GLU  36          1HB       GLU  36  -7.237   0.366   8.270
  290   2HB   GLU  36          2HB       GLU  36  -6.776   2.066   8.496
  291   1HG   GLU  36          1HG       GLU  36  -7.246   2.496   6.105
  292   2HG   GLU  36          2HG       GLU  36  -7.652   0.782   5.877
  293    H    LYS  37           H        LYS  37  -2.902   0.688   8.207
  294    HA   LYS  37           HA       LYS  37  -2.872  -1.852   9.463
  295   1HB   LYS  37          1HB       LYS  37  -1.262   0.680   9.399
  296   2HB   LYS  37          2HB       LYS  37  -0.922  -0.512  10.656
  297   1HG   LYS  37          1HG       LYS  37  -0.586  -2.265   8.922
  298   2HG   LYS  37          2HG       LYS  37  -0.937  -1.071   7.662
  299   1HD   LYS  37          1HD       LYS  37   1.459  -1.219   7.826
  300   2HD   LYS  37          2HD       LYS  37   1.033   0.299   8.637
  301   1HE   LYS  37          1HE       LYS  37   1.380  -2.351  10.130
  302   2HE   LYS  37          2HE       LYS  37   2.723  -1.240   9.807
  303   1HZ   LYS  37          1HZ       LYS  37   1.540   0.452  11.007
  304   2HZ   LYS  37          2HZ       LYS  37   0.305  -0.591  11.339
  305   3HZ   LYS  37          3HZ       LYS  37   1.805  -0.876  11.947
  306    H    ASP  38           H        ASP  38  -4.720  -2.045  10.850
  307    HA   ASP  38           HA       ASP  38  -5.975  -1.769  12.703
  308   1HB   ASP  38          1HB       ASP  38  -3.288  -0.921  13.792
  309   2HB   ASP  38          2HB       ASP  38  -4.736  -1.119  14.803
  310    H    GLY  39           H        GLY  39  -5.764   0.388  10.737
  311   1HA   GLY  39          1HA       GLY  39  -7.192   2.460  11.203
  312   2HA   GLY  39          2HA       GLY  39  -6.080   2.688  12.584
  313    H    LYS  40           H        LYS  40  -3.698   1.760  10.914
  314    HA   LYS  40           HA       LYS  40  -3.008   4.385   9.940
  315   1HB   LYS  40          1HB       LYS  40  -1.467   1.785   9.684
  316   2HB   LYS  40          2HB       LYS  40  -0.817   3.439   9.603
  317   1HG   LYS  40          1HG       LYS  40  -1.970   1.912  11.965
  318   2HG   LYS  40          2HG       LYS  40  -0.375   2.695  11.880
  319   1HD   LYS  40          1HD       LYS  40  -1.396   4.908  12.023
  320   2HD   LYS  40          2HD       LYS  40  -2.991   4.232  11.617
  321   1HE   LYS  40          1HE       LYS  40  -1.489   3.779  14.199
  322   2HE   LYS  40          2HE       LYS  40  -2.970   4.739  13.958
  323   1HZ   LYS  40          1HZ       LYS  40  -2.727   1.831  13.524
  324   2HZ   LYS  40          2HZ       LYS  40  -3.453   2.553  14.814
  325   3HZ   LYS  40          3HZ       LYS  40  -4.087   2.726  13.311
  326    H    LYS  41           H        LYS  41  -4.795   4.400   8.442
  327    HA   LYS  41           HA       LYS  41  -4.672   2.719   6.078
  328   1HB   LYS  41          1HB       LYS  41  -6.800   3.381   6.973
  329   2HB   LYS  41          2HB       LYS  41  -6.309   5.074   6.967
  330   1HG   LYS  41          1HG       LYS  41  -6.098   4.835   4.402
  331   2HG   LYS  41          2HG       LYS  41  -7.006   3.319   4.572
  332   1HD   LYS  41          1HD       LYS  41  -8.940   4.439   5.278
  333   2HD   LYS  41          2HD       LYS  41  -8.028   5.796   5.968
  334   1HE   LYS  41          1HE       LYS  41  -7.547   6.745   3.833
  335   2HE   LYS  41          2HE       LYS  41  -8.064   5.292   2.972
  336   1HZ   LYS  41          1HZ       LYS  41  -9.844   7.039   4.523
  337   2HZ   LYS  41          2HZ       LYS  41  -9.703   7.016   2.880
  338   3HZ   LYS  41          3HZ       LYS  41 -10.285   5.698   3.663
  339    H    VAL  42           H        VAL  42  -4.037   3.073   4.160
  340    HA   VAL  42           HA       VAL  42  -3.225   5.704   3.120
  341    HB   VAL  42           HB       VAL  42  -1.177   4.881   4.104
  342   1HG1  VAL  42          1HG2      VAL  42  -1.950   2.524   4.368
  343   2HG1  VAL  42          2HG2      VAL  42  -1.704   2.257   2.626
  344   3HG1  VAL  42          3HG2      VAL  42  -0.310   2.607   3.686
  345   1HG2  VAL  42          1HG1      VAL  42  -0.851   5.797   1.860
  346   2HG2  VAL  42          2HG1      VAL  42   0.306   4.486   2.193
  347   3HG2  VAL  42          3HG1      VAL  42  -1.114   4.172   1.167
  348    H    ASN  43           H        ASN  43  -2.706   5.544   0.828
  349    HA   ASN  43           HA       ASN  43  -4.921   4.218  -0.513
  350   1HB   ASN  43          1HB       ASN  43  -4.066   6.348  -1.342
  351   2HB   ASN  43          2HB       ASN  43  -2.474   5.619  -1.639
  352   1HD2  ASN  43          2HD2      ASN  43  -5.862   4.416  -2.377
  353   2HD2  ASN  43          1HD2      ASN  43  -5.572   4.422  -4.108
  354    H    ALA  44           H        ALA  44  -5.003   2.273  -0.499
  355    HA   ALA  44           HA       ALA  44  -3.149   0.277  -0.130
  356   1HB   ALA  44          1HB       ALA  44  -5.624  -0.031  -0.054
  357   2HB   ALA  44          2HB       ALA  44  -5.685   0.132  -1.822
  358   3HB   ALA  44          3HB       ALA  44  -4.858  -1.259  -1.090
  359    H    LYS  45           H        LYS  45  -3.972   1.825  -3.161
  360    HA   LYS  45           HA       LYS  45  -2.512  -0.164  -4.744
  361   1HB   LYS  45          1HB       LYS  45  -3.408   1.149  -6.617
  362   2HB   LYS  45          2HB       LYS  45  -4.692   0.687  -5.465
  363   1HG   LYS  45          1HG       LYS  45  -4.603   2.923  -4.458
  364   2HG   LYS  45          2HG       LYS  45  -3.200   3.344  -5.449
  365   1HD   LYS  45          1HD       LYS  45  -5.206   4.239  -6.550
  366   2HD   LYS  45          2HD       LYS  45  -4.532   2.901  -7.518
  367   1HE   LYS  45          1HE       LYS  45  -6.132   1.341  -6.263
  368   2HE   LYS  45          2HE       LYS  45  -6.943   2.791  -5.647
  369   1HZ   LYS  45          1HZ       LYS  45  -6.626   2.068  -8.481
  370   2HZ   LYS  45          2HZ       LYS  45  -8.000   1.929  -7.592
  371   3HZ   LYS  45          3HZ       LYS  45  -7.376   3.424  -7.911
  372    H    SER  46           H        SER  46  -1.596   2.730  -3.090
  373    HA   SER  46           HA       SER  46   0.368   3.356  -5.219
  374   1HB   SER  46          1HB       SER  46  -0.479   4.785  -2.685
  375   2HB   SER  46          2HB       SER  46   1.039   5.185  -3.517
  376    HG   SER  46           HG       SER  46  -1.570   5.295  -4.609
  377    H    ILE  47           H        ILE  47   2.485   3.278  -5.004
  378    HA   ILE  47           HA       ILE  47   3.954   1.354  -3.904
  379    HB   ILE  47           HB       ILE  47   4.941   2.903  -5.356
  380   1HG1  ILE  47          1HG1      ILE  47   6.474   1.949  -3.537
  381   2HG1  ILE  47          2HG1      ILE  47   7.044   3.368  -4.448
  382   1HG2  ILE  47          1HG2      ILE  47   3.641   4.914  -4.770
  383   2HG2  ILE  47          2HG2      ILE  47   4.615   5.098  -3.289
  384   3HG2  ILE  47          3HG2      ILE  47   5.386   5.247  -4.882
  385   1HD1  ILE  47          1HD1      ILE  47   6.310   4.863  -2.604
  386   2HD1  ILE  47          2HD1      ILE  47   5.840   3.439  -1.658
  387   3HD1  ILE  47          3HD1      ILE  47   7.547   3.696  -2.081
  388    H    MET  48           H        MET  48   3.638   4.484  -2.150
  389    HA   MET  48           HA       MET  48   4.843   3.474   0.199
  390   1HB   MET  48          1HB       MET  48   4.190   5.550   1.201
  391   2HB   MET  48          2HB       MET  48   4.575   5.891  -0.499
  392   1HG   MET  48          1HG       MET  48   2.162   5.737  -1.054
  393   2HG   MET  48          2HG       MET  48   1.802   5.400   0.644
  394   1HE   MET  48          1HE       MET  48   4.043   7.398   1.878
  395   2HE   MET  48          2HE       MET  48   3.040   8.822   2.256
  396   3HE   MET  48          3HE       MET  48   2.431   7.185   2.612
  397    H    GLY  49           H        GLY  49   1.548   3.080  -0.951
  398   1HA   GLY  49          1HA       GLY  49   0.333   2.647   1.662
  399   2HA   GLY  49          2HA       GLY  49  -0.357   2.273   0.059
  400    H    LEU  50           H        LEU  50   1.522   0.716  -1.110
  401    HA   LEU  50           HA       LEU  50   1.176  -1.859   0.097
  402   1HB   LEU  50          1HB       LEU  50   1.248  -1.301  -2.309
  403   2HB   LEU  50          2HB       LEU  50   2.936  -0.802  -2.160
  404    HG   LEU  50           HG       LEU  50   1.897  -3.643  -1.768
  405   1HD1  LEU  50          1HD1      LEU  50   1.775  -2.749  -4.128
  406   2HD1  LEU  50          2HD1      LEU  50   3.509  -2.367  -4.022
  407   3HD1  LEU  50          3HD1      LEU  50   2.965  -4.058  -3.948
  408   1HD2  LEU  50          1HD2      LEU  50   4.724  -2.542  -2.052
  409   2HD2  LEU  50          2HD2      LEU  50   4.027  -3.207  -0.550
  410   3HD2  LEU  50          3HD2      LEU  50   4.269  -4.266  -1.962
  411    H    MET  51           H        MET  51   4.192  -0.191  -0.804
  412    HA   MET  51           HA       MET  51   5.805  -1.999   0.724
  413   1HB   MET  51          1HB       MET  51   6.486  -0.987  -1.465
  414   2HB   MET  51          2HB       MET  51   6.449   0.613  -0.701
  415   1HG   MET  51          1HG       MET  51   8.128  -0.365   1.003
  416   2HG   MET  51          2HG       MET  51   8.349  -1.677  -0.165
  417   1HE   MET  51          1HE       MET  51   8.713   2.066   0.681
  418   2HE   MET  51          2HE       MET  51   9.375   2.775  -0.810
  419   3HE   MET  51          3HE       MET  51   7.690   2.194  -0.767
  420    H    SER  52           H        SER  52   4.691   1.427   1.275
  421    HA   SER  52           HA       SER  52   6.638   1.635   3.419
  422   1HB   SER  52          1HB       SER  52   4.332   3.476   2.758
  423   2HB   SER  52          2HB       SER  52   5.735   3.848   3.793
  424    HG   SER  52           HG       SER  52   6.060   4.641   1.667
  425    H    LEU  53           H        LEU  53   3.009   1.948   3.527
  426    HA   LEU  53           HA       LEU  53   3.147   1.355   6.376
  427   1HB   LEU  53          1HB       LEU  53   0.813   1.738   4.478
  428   2HB   LEU  53          2HB       LEU  53   0.689   1.582   6.241
  429    HG   LEU  53           HG       LEU  53   2.235   3.588   6.467
  430   1HD1  LEU  53          1HD2      LEU  53   1.480   3.871   3.517
  431   2HD1  LEU  53          2HD2      LEU  53   2.139   5.179   4.528
  432   3HD1  LEU  53          3HD2      LEU  53   3.131   3.744   4.170
  433   1HD2  LEU  53          1HD1      LEU  53  -0.206   3.529   6.787
  434   2HD2  LEU  53          2HD1      LEU  53   0.332   5.089   6.080
  435   3HD2  LEU  53          3HD1      LEU  53  -0.415   3.843   5.038
  436    H    ALA  54           H        ALA  54   1.284  -0.139   3.715
  437    HA   ALA  54           HA       ALA  54   0.128  -2.308   4.902
  438   1HB   ALA  54          1HB       ALA  54  -0.127  -1.634   2.486
  439   2HB   ALA  54          2HB       ALA  54   1.496  -2.251   2.170
  440   3HB   ALA  54          3HB       ALA  54   0.212  -3.371   2.654
  441    H    VAL  55           H        VAL  55   3.310  -2.315   3.422
  442    HA   VAL  55           HA       VAL  55   4.319  -4.645   3.545
  443    HB   VAL  55           HB       VAL  55   5.523  -2.487   3.108
  444   1HG1  VAL  55          1HG1      VAL  55   6.131  -2.683   6.089
  445   2HG1  VAL  55          2HG1      VAL  55   6.917  -1.573   4.938
  446   3HG1  VAL  55          3HG1      VAL  55   5.184  -1.402   5.291
  447   1HG2  VAL  55          1HG2      VAL  55   6.988  -4.643   4.676
  448   2HG2  VAL  55          2HG2      VAL  55   6.640  -4.647   2.927
  449   3HG2  VAL  55          3HG2      VAL  55   7.756  -3.436   3.610
  450    H    SER  56           H        SER  56   3.617  -3.118   6.583
  451    HA   SER  56           HA       SER  56   5.101  -4.765   8.341
  452   1HB   SER  56          1HB       SER  56   2.432  -3.408   8.864
  453   2HB   SER  56          2HB       SER  56   3.734  -3.688  10.027
  454    HG   SER  56           HG       SER  56   3.608  -1.786   7.896
  455    H    THR  57           H        THR  57   4.591  -6.846   7.135
  456    HA   THR  57           HA       THR  57   2.353  -8.349   7.139
  457    HB   THR  57           HB       THR  57   5.098  -9.147   8.159
  458    HG1  THR  57           HG1      THR  57   3.979  -9.671   5.614
  459   1HG2  THR  57          1HG2      THR  57   4.498 -11.445   7.517
  460   2HG2  THR  57          2HG2      THR  57   3.414 -10.833   8.789
  461   3HG2  THR  57          3HG2      THR  57   2.854 -10.914   7.097
  462    H    GLY  58           H        GLY  58   0.779  -8.757   8.520
  463   1HA   GLY  58          1HA       GLY  58   0.171  -9.997  10.583
  464   2HA   GLY  58          2HA       GLY  58   1.606  -9.301  11.352
  465    H    THR  59           H        THR  59   0.544  -6.663   9.842
  466    HA   THR  59           HA       THR  59  -0.715  -5.660  12.282
  467    HB   THR  59           HB       THR  59  -0.549  -4.318   9.547
  468    HG1  THR  59           HG1      THR  59   1.527  -4.922  10.298
  469   1HG2  THR  59          1HG2      THR  59  -0.614  -2.234  10.852
  470   2HG2  THR  59          2HG2      THR  59  -2.046  -3.232  11.219
  471   3HG2  THR  59          3HG2      THR  59  -0.689  -3.169  12.365
  472    H    GLU  60           H        GLU  60  -2.984  -5.313  12.605
  473    HA   GLU  60           HA       GLU  60  -4.658  -6.746  10.640
  474   1HB   GLU  60          1HB       GLU  60  -5.501  -5.412  13.242
  475   2HB   GLU  60          2HB       GLU  60  -6.442  -6.538  12.212
  476   1HG   GLU  60          1HG       GLU  60  -4.827  -8.324  12.600
  477   2HG   GLU  60          2HG       GLU  60  -3.825  -7.244  13.593
  478    H    VAL  61           H        VAL  61  -4.275  -5.442   8.949
  479    HA   VAL  61           HA       VAL  61  -5.008  -2.579   9.096
  480    HB   VAL  61           HB       VAL  61  -3.810  -2.352   7.011
  481   1HG1  VAL  61          1HG1      VAL  61  -2.463  -2.611   9.160
  482   2HG1  VAL  61          2HG1      VAL  61  -2.322  -4.341   8.792
  483   3HG1  VAL  61          3HG1      VAL  61  -1.573  -3.141   7.713
  484   1HG2  VAL  61          1HG2      VAL  61  -3.417  -5.369   7.160
  485   2HG2  VAL  61          2HG2      VAL  61  -4.409  -4.518   5.934
  486   3HG2  VAL  61          3HG2      VAL  61  -2.640  -4.262   5.999
  487    H    THR  62           H        THR  62  -6.792  -1.756   8.255
  488    HA   THR  62           HA       THR  62  -8.686  -3.710   7.106
  489    HB   THR  62           HB       THR  62  -9.251  -0.797   7.792
  490    HG1  THR  62           HG1      THR  62  -8.519  -2.161   9.592
  491   1HG2  THR  62          1HG2      THR  62 -11.577  -1.668   7.921
  492   2HG2  THR  62          2HG2      THR  62 -10.902  -1.919   6.304
  493   3HG2  THR  62          3HG2      THR  62 -10.995  -3.279   7.450
  494    H    LEU  63           H        LEU  63  -9.054  -3.954   4.979
  495    HA   LEU  63           HA       LEU  63  -7.689  -2.037   3.222
  496   1HB   LEU  63          1HB       LEU  63  -7.312  -4.509   3.096
  497   2HB   LEU  63          2HB       LEU  63  -8.978  -4.688   2.483
  498    HG   LEU  63           HG       LEU  63  -7.257  -2.568   1.242
  499   1HD1  LEU  63          1HD2      LEU  63  -6.814  -5.541   0.776
  500   2HD1  LEU  63          2HD2      LEU  63  -6.125  -4.227  -0.211
  501   3HD1  LEU  63          3HD2      LEU  63  -5.658  -4.395   1.497
  502   1HD2  LEU  63          1HD1      LEU  63  -9.154  -4.696   0.149
  503   2HD2  LEU  63          2HD1      LEU  63  -9.566  -2.997   0.479
  504   3HD2  LEU  63          3HD1      LEU  63  -8.403  -3.392  -0.806
  505    H    ILE  64           H        ILE  64  -8.721  -0.489   2.342
  506    HA   ILE  64           HA       ILE  64 -11.688  -0.417   2.332
  507    HB   ILE  64           HB       ILE  64  -9.628   1.799   1.945
  508   1HG1  ILE  64          1HG1      ILE  64 -11.189   1.129   4.458
  509   2HG1  ILE  64          2HG1      ILE  64  -9.436   0.885   4.227
  510   1HG2  ILE  64          1HG2      ILE  64 -12.610   1.830   2.549
  511   2HG2  ILE  64          2HG2      ILE  64 -11.575   3.280   2.424
  512   3HG2  ILE  64          3HG2      ILE  64 -11.852   2.251   0.998
  513   1HD1  ILE  64          1HD1      ILE  64  -9.257   3.355   3.688
  514   2HD1  ILE  64          2HD1      ILE  64 -10.976   3.519   4.124
  515   3HD1  ILE  64          3HD1      ILE  64  -9.787   3.028   5.356
  516    H    ALA  65           H        ALA  65 -12.787   0.384   0.535
  517    HA   ALA  65           HA       ALA  65 -11.340   1.236  -1.809
  518   1HB   ALA  65          1HB       ALA  65 -13.298  -1.104  -1.994
  519   2HB   ALA  65          2HB       ALA  65 -12.610  -0.209  -3.363
  520   3HB   ALA  65          3HB       ALA  65 -11.547  -1.178  -2.316
  521    H    GLN  66           H        GLN  66 -12.438   2.965  -2.473
  522    HA   GLN  66           HA       GLN  66 -15.348   3.171  -1.938
  523   1HB   GLN  66          1HB       GLN  66 -14.531   3.932  -0.019
  524   2HB   GLN  66          2HB       GLN  66 -13.090   4.684  -0.601
  525   1HG   GLN  66          1HG       GLN  66 -15.821   5.755  -1.329
  526   2HG   GLN  66          2HG       GLN  66 -15.170   6.008   0.307
  527   1HE2  GLN  66          2HE2      GLN  66 -12.570   6.613   0.111
  528   2HE2  GLN  66          1HE2      GLN  66 -12.248   7.909  -1.015
  529    H    GLY  67           H        GLY  67 -14.864   2.509  -4.190
  530   1HA   GLY  67          1HA       GLY  67 -15.189   4.852  -5.927
  531   2HA   GLY  67          2HA       GLY  67 -13.909   3.692  -6.296
  532    H    GLU  68           H        GLU  68 -15.215   3.357  -8.266
  533    HA   GLU  68           HA       GLU  68 -17.736   2.486  -8.598
  534   1HB   GLU  68          1HB       GLU  68 -16.884   1.119 -10.503
  535   2HB   GLU  68          2HB       GLU  68 -16.166   2.741 -10.456
  536   1HG   GLU  68          1HG       GLU  68 -14.138   1.824  -9.382
  537   2HG   GLU  68          2HG       GLU  68 -14.906   0.230  -9.276
  538    H    ASP  69           H        ASP  69 -15.138   0.217  -7.341
  539    HA   ASP  69           HA       ASP  69 -17.409  -1.623  -6.953
  540   1HB   ASP  69          1HB       ASP  69 -15.671  -3.486  -7.104
  541   2HB   ASP  69          2HB       ASP  69 -16.161  -2.836  -8.658
  542    H    GLU  70           H        GLU  70 -16.395   0.401  -5.193
  543    HA   GLU  70           HA       GLU  70 -14.467  -0.220  -3.488
  544   1HB   GLU  70          1HB       GLU  70 -16.039   0.773  -1.671
  545   2HB   GLU  70          2HB       GLU  70 -15.466   1.661  -3.080
  546   1HG   GLU  70          1HG       GLU  70 -17.630   2.358  -2.886
  547   2HG   GLU  70          2HG       GLU  70 -17.610   1.250  -4.271
  548    H    GLN  71           H        GLN  71 -17.732  -1.557  -2.775
  549    HA   GLN  71           HA       GLN  71 -17.169  -3.177  -0.651
  550   1HB   GLN  71          1HB       GLN  71 -19.281  -2.749  -2.223
  551   2HB   GLN  71          2HB       GLN  71 -18.735  -4.241  -3.005
  552   1HG   GLN  71          1HG       GLN  71 -19.633  -3.856  -0.120
  553   2HG   GLN  71          2HG       GLN  71 -20.427  -4.827  -1.381
  554   1HE2  GLN  71          2HE2      GLN  71 -17.799  -4.532   0.889
  555   2HE2  GLN  71          1HE2      GLN  71 -17.127  -6.152   0.690
  556    H    GLU  72           H        GLU  72 -16.868  -4.142  -4.112
  557    HA   GLU  72           HA       GLU  72 -15.914  -6.777  -3.501
  558   1HB   GLU  72          1HB       GLU  72 -17.087  -6.296  -5.633
  559   2HB   GLU  72          2HB       GLU  72 -16.013  -4.910  -5.920
  560   1HG   GLU  72          1HG       GLU  72 -14.100  -6.569  -6.055
  561   2HG   GLU  72          2HG       GLU  72 -15.356  -7.824  -6.260
  562    H    ALA  73           H        ALA  73 -14.450  -3.645  -4.248
  563    HA   ALA  73           HA       ALA  73 -11.808  -4.383  -4.966
  564   1HB   ALA  73          1HB       ALA  73 -13.158  -1.974  -3.686
  565   2HB   ALA  73          2HB       ALA  73 -11.558  -1.933  -4.494
  566   3HB   ALA  73          3HB       ALA  73 -13.043  -2.308  -5.416
  567    H    LEU  74           H        LEU  74 -13.236  -3.216  -1.924
  568    HA   LEU  74           HA       LEU  74 -10.886  -3.634  -0.335
  569   1HB   LEU  74          1HB       LEU  74 -12.526  -3.326   1.579
  570   2HB   LEU  74          2HB       LEU  74 -12.445  -2.044   0.348
  571    HG   LEU  74           HG       LEU  74 -14.414  -3.595  -0.702
  572   1HD1  LEU  74          1HD1      LEU  74 -14.838  -3.459   2.307
  573   2HD1  LEU  74          2HD1      LEU  74 -16.041  -3.942   1.085
  574   3HD1  LEU  74          3HD1      LEU  74 -14.603  -4.952   1.349
  575   1HD2  LEU  74          1HD2      LEU  74 -14.462  -1.165   1.125
  576   2HD2  LEU  74          2HD2      LEU  74 -14.334  -1.193  -0.646
  577   3HD2  LEU  74          3HD2      LEU  74 -15.842  -1.706   0.126
  578    H    GLU  75           H        GLU  75 -13.806  -5.654  -0.962
  579    HA   GLU  75           HA       GLU  75 -13.167  -7.785   0.733
  580   1HB   GLU  75          1HB       GLU  75 -14.419  -7.820  -2.049
  581   2HB   GLU  75          2HB       GLU  75 -14.374  -9.212  -0.943
  582   1HG   GLU  75          1HG       GLU  75 -15.740  -6.564  -0.425
  583   2HG   GLU  75          2HG       GLU  75 -16.542  -8.109  -0.779
  584    H    LYS  76           H        LYS  76 -12.287  -7.640  -2.780
  585    HA   LYS  76           HA       LYS  76 -11.030 -10.177  -2.715
  586   1HB   LYS  76          1HB       LYS  76 -10.135  -7.944  -4.556
  587   2HB   LYS  76          2HB       LYS  76 -10.135  -9.698  -4.839
  588   1HG   LYS  76          1HG       LYS  76 -12.742  -9.430  -4.400
  589   2HG   LYS  76          2HG       LYS  76 -12.441  -7.753  -4.863
  590   1HD   LYS  76          1HD       LYS  76 -12.058 -10.311  -6.481
  591   2HD   LYS  76          2HD       LYS  76 -13.101  -8.930  -6.853
  592   1HE   LYS  76          1HE       LYS  76 -11.016  -7.555  -7.243
  593   2HE   LYS  76          2HE       LYS  76 -10.050  -9.014  -6.949
  594   1HZ   LYS  76          1HZ       LYS  76 -11.320 -10.020  -8.789
  595   2HZ   LYS  76          2HZ       LYS  76 -12.024  -8.560  -9.079
  596   3HZ   LYS  76          3HZ       LYS  76 -10.399  -8.735  -9.259
  597    H    LEU  77           H        LEU  77  -9.575  -6.915  -2.444
  598    HA   LEU  77           HA       LEU  77  -6.932  -7.836  -2.082
  599   1HB   LEU  77          1HB       LEU  77  -8.505  -5.357  -1.795
  600   2HB   LEU  77          2HB       LEU  77  -6.997  -5.448  -0.829
  601    HG   LEU  77           HG       LEU  77  -6.833  -4.545  -3.301
  602   1HD1  LEU  77          1HD1      LEU  77  -5.091  -6.622  -1.965
  603   2HD1  LEU  77          2HD1      LEU  77  -4.542  -5.457  -3.208
  604   3HD1  LEU  77          3HD1      LEU  77  -5.102  -4.869  -1.613
  605   1HD2  LEU  77          1HD2      LEU  77  -6.604  -7.588  -3.570
  606   2HD2  LEU  77          2HD2      LEU  77  -7.751  -6.552  -4.463
  607   3HD2  LEU  77          3HD2      LEU  77  -5.996  -6.414  -4.748
  608    H    ALA  78           H        ALA  78  -9.302  -6.776   0.541
  609    HA   ALA  78           HA       ALA  78  -7.433  -7.465   2.583
  610   1HB   ALA  78          1HB       ALA  78  -9.372  -5.969   2.937
  611   2HB   ALA  78          2HB       ALA  78 -10.459  -7.370   2.747
  612   3HB   ALA  78          3HB       ALA  78  -9.313  -7.299   4.105
  613    H    ALA  79           H        ALA  79  -9.761  -9.413   0.753
  614    HA   ALA  79           HA       ALA  79  -9.764 -11.735   2.394
  615   1HB   ALA  79          1HB       ALA  79 -11.206 -11.231   0.361
  616   2HB   ALA  79          2HB       ALA  79  -9.751 -11.514  -0.642
  617   3HB   ALA  79          3HB       ALA  79 -10.447 -12.848   0.323
  618    H    TYR  80           H        TYR  80  -7.740 -10.720  -0.406
  619    HA   TYR  80           HA       TYR  80  -6.104 -13.056  -0.407
  620   1HB   TYR  80          1HB       TYR  80  -6.593 -11.579  -2.269
  621   2HB   TYR  80          2HB       TYR  80  -5.739 -10.249  -1.485
  622    HD1  TYR  80           HD1      TYR  80  -4.801 -13.860  -1.980
  623    HD2  TYR  80           HD2      TYR  80  -3.782  -9.731  -2.660
  624    HE1  TYR  80           HE1      TYR  80  -2.622 -14.557  -2.916
  625    HE2  TYR  80           HE2      TYR  80  -1.570 -10.433  -3.579
  626    HH   TYR  80           HH       TYR  80  -0.702 -13.877  -3.919
  627    H    VAL  81           H        VAL  81  -5.368  -9.743   0.630
  628    HA   VAL  81           HA       VAL  81  -2.759  -9.807   1.317
  629    HB   VAL  81           HB       VAL  81  -3.328  -8.034   2.980
  630   1HG1  VAL  81          1HG1      VAL  81  -3.423  -7.567   0.526
  631   2HG1  VAL  81          2HG1      VAL  81  -5.141  -7.993   0.540
  632   3HG1  VAL  81          3HG1      VAL  81  -4.580  -6.577   1.458
  633   1HG2  VAL  81          1HG2      VAL  81  -6.165  -9.049   2.477
  634   2HG2  VAL  81          2HG2      VAL  81  -5.272  -9.142   4.006
  635   3HG2  VAL  81          3HG2      VAL  81  -5.766  -7.558   3.367
  636    H    GLN  82           H        GLN  82  -5.315 -11.143   3.389
  637    HA   GLN  82           HA       GLN  82  -3.293 -11.694   5.512
  638   1HB   GLN  82          1HB       GLN  82  -5.165 -11.561   6.980
  639   2HB   GLN  82          2HB       GLN  82  -5.330 -10.209   5.856
  640   1HG   GLN  82          1HG       GLN  82  -6.976 -11.592   4.525
  641   2HG   GLN  82          2HG       GLN  82  -6.755 -12.893   5.687
  642   1HE2  GLN  82          2HE2      GLN  82  -8.499 -10.167   4.985
  643   2HE2  GLN  82          1HE2      GLN  82  -9.217  -9.763   6.555
  644    H    GLU  83           H        GLU  83  -4.588 -13.296   2.950
  645    HA   GLU  83           HA       GLU  83  -5.972 -15.426   4.300
  646   1HB   GLU  83          1HB       GLU  83  -6.580 -14.201   2.264
  647   2HB   GLU  83          2HB       GLU  83  -5.248 -14.990   1.377
  648   1HG   GLU  83          1HG       GLU  83  -6.291 -17.202   1.797
  649   2HG   GLU  83          2HG       GLU  83  -7.611 -16.406   2.693
  650    H    GLU  84           H        GLU  84  -3.120 -15.547   1.988
  651    HA   GLU  84           HA       GLU  84  -2.616 -18.168   3.261
  652   1HB   GLU  84          1HB       GLU  84  -1.177 -18.614   1.331
  653   2HB   GLU  84          2HB       GLU  84  -2.819 -18.191   0.827
  654   1HG   GLU  84          1HG       GLU  84  -0.810 -15.965   0.967
  655   2HG   GLU  84          2HG       GLU  84  -0.654 -17.151  -0.347
  656    H    VAL  85           H        VAL  85   0.251 -17.385   1.965
  657    HA   VAL  85           HA       VAL  85   1.331 -15.598   4.051
  658    HB   VAL  85           HB       VAL  85   1.522 -17.879   5.146
  659   1HG1  VAL  85          1HG1      VAL  85   3.211 -18.784   2.708
  660   2HG1  VAL  85          2HG1      VAL  85   3.054 -19.664   4.249
  661   3HG1  VAL  85          3HG1      VAL  85   1.650 -19.471   3.216
  662   1HG2  VAL  85          1HG2      VAL  85   3.391 -16.212   5.538
  663   2HG2  VAL  85          2HG2      VAL  85   3.962 -17.882   5.618
  664   3HG2  VAL  85          3HG2      VAL  85   4.296 -16.900   4.169
  Start of MODEL   15
    1   1H    VAL   2          1H        VAL   2 -18.397   3.589  -1.521
    2   2H    VAL   2          2H        VAL   2 -18.310   4.877  -0.443
    3   3H    VAL   2          3H        VAL   2 -19.215   5.020  -1.853
    4    HA   VAL   2           HA       VAL   2 -17.256   4.839  -3.189
    5    HB   VAL   2           HB       VAL   2 -17.023   6.957  -1.014
    6   1HG1  VAL   2          1HG2      VAL   2 -15.889   6.778  -3.844
    7   2HG1  VAL   2          2HG2      VAL   2 -15.763   8.193  -2.769
    8   3HG1  VAL   2          3HG2      VAL   2 -14.946   6.670  -2.340
    9   1HG2  VAL   2          1HG1      VAL   2 -18.348   6.958  -3.765
   10   2HG2  VAL   2          2HG1      VAL   2 -19.201   6.956  -2.200
   11   3HG2  VAL   2          3HG1      VAL   2 -18.217   8.363  -2.676
   12    H    GLN   3           H        GLN   3 -16.384   5.205   0.286
   13    HA   GLN   3           HA       GLN   3 -14.182   3.255  -0.187
   14   1HB   GLN   3          1HB       GLN   3 -13.641   5.604   0.827
   15   2HB   GLN   3          2HB       GLN   3 -14.527   5.037   2.264
   16   1HG   GLN   3          1HG       GLN   3 -13.011   3.033   2.297
   17   2HG   GLN   3          2HG       GLN   3 -12.044   3.830   1.036
   18   1HE2  GLN   3          2HE2      GLN   3 -13.638   4.735   4.182
   19   2HE2  GLN   3          1HE2      GLN   3 -12.241   5.608   4.780
   20    H    GLN   4           H        GLN   4 -14.012   1.528   1.275
   21    HA   GLN   4           HA       GLN   4 -15.763   1.124   3.535
   22   1HB   GLN   4          1HB       GLN   4 -15.795  -0.737   1.125
   23   2HB   GLN   4          2HB       GLN   4 -16.487  -1.142   2.703
   24   1HG   GLN   4          1HG       GLN   4 -17.416   1.273   1.127
   25   2HG   GLN   4          2HG       GLN   4 -18.061  -0.348   0.809
   26   1HE2  GLN   4          2HE2      GLN   4 -18.589  -1.572   3.097
   27   2HE2  GLN   4          1HE2      GLN   4 -19.587  -0.584   4.143
   28    H    LYS   5           H        LYS   5 -14.776  -0.955   4.691
   29    HA   LYS   5           HA       LYS   5 -12.249  -1.859   3.547
   30   1HB   LYS   5          1HB       LYS   5 -11.132  -1.383   5.771
   31   2HB   LYS   5          2HB       LYS   5 -11.450  -0.005   4.708
   32   1HG   LYS   5          1HG       LYS   5 -11.958   0.630   6.973
   33   2HG   LYS   5          2HG       LYS   5 -13.459   0.590   6.021
   34   1HD   LYS   5          1HD       LYS   5 -14.049  -1.604   6.990
   35   2HD   LYS   5          2HD       LYS   5 -12.478  -1.675   7.810
   36   1HE   LYS   5          1HE       LYS   5 -13.040   0.409   9.065
   37   2HE   LYS   5          2HE       LYS   5 -14.671   0.356   8.364
   38   1HZ   LYS   5          1HZ       LYS   5 -14.930  -1.817   9.381
   39   2HZ   LYS   5          2HZ       LYS   5 -13.428  -1.712  10.059
   40   3HZ   LYS   5          3HZ       LYS   5 -14.611  -0.661  10.512
   41    H    VAL   6           H        VAL   6 -11.432  -3.720   4.560
   42    HA   VAL   6           HA       VAL   6 -13.224  -5.175   6.432
   43    HB   VAL   6           HB       VAL   6 -11.709  -6.278   4.021
   44   1HG1  VAL   6          1HG1      VAL   6 -11.794  -7.835   5.937
   45   2HG1  VAL   6          2HG1      VAL   6 -13.562  -7.641   6.015
   46   3HG1  VAL   6          3HG1      VAL   6 -12.814  -8.412   4.596
   47   1HG2  VAL   6          1HG2      VAL   6 -13.747  -5.042   3.361
   48   2HG2  VAL   6          2HG2      VAL   6 -13.940  -6.793   3.094
   49   3HG2  VAL   6          3HG2      VAL   6 -14.707  -6.016   4.503
   50    H    GLU   7           H        GLU   7 -11.932  -5.678   8.277
   51    HA   GLU   7           HA       GLU   7  -9.145  -4.933   7.913
   52   1HB   GLU   7          1HB       GLU   7 -10.647  -5.893  10.400
   53   2HB   GLU   7          2HB       GLU   7  -8.995  -5.230  10.423
   54   1HG   GLU   7          1HG       GLU   7  -9.748  -3.079   9.639
   55   2HG   GLU   7          2HG       GLU   7 -11.331  -3.740   9.184
   56    H    VAL   8           H        VAL   8  -7.274  -6.097   8.384
   57    HA   VAL   8           HA       VAL   8  -7.621  -9.033   8.228
   58    HB   VAL   8           HB       VAL   8  -6.556  -9.191   6.215
   59   1HG1  VAL   8          1HG2      VAL   8  -8.447  -7.665   5.768
   60   2HG1  VAL   8          2HG2      VAL   8  -7.380  -6.265   6.051
   61   3HG1  VAL   8          3HG2      VAL   8  -7.080  -7.353   4.670
   62   1HG2  VAL   8          1HG1      VAL   8  -4.418  -8.278   7.002
   63   2HG2  VAL   8          2HG1      VAL   8  -4.806  -7.695   5.366
   64   3HG2  VAL   8          3HG1      VAL   8  -5.037  -6.622   6.775
   65    H    ARG   9           H        ARG   9  -5.859 -10.257   9.030
   66    HA   ARG   9           HA       ARG   9  -3.818  -8.673  10.527
   67   1HB   ARG   9          1HB       ARG   9  -4.713 -10.796  11.554
   68   2HB   ARG   9          2HB       ARG   9  -4.099 -11.656  10.102
   69   1HG   ARG   9          1HG       ARG   9  -1.794 -10.574  10.769
   70   2HG   ARG   9          2HG       ARG   9  -2.555 -10.434  12.369
   71   1HD   ARG   9          1HD       ARG   9  -1.444 -12.581  12.268
   72   2HD   ARG   9          2HD       ARG   9  -3.173 -12.925  12.113
   73    HE   ARG   9           HE       ARG   9  -1.064 -13.164  10.063
   74   1HH1  ARG   9          2HH1      ARG   9  -4.554 -13.257  10.705
   75   2HH1  ARG   9          1HH1      ARG   9  -4.944 -13.906   9.131
   76   1HH2  ARG   9          1HH2      ARG   9  -1.603 -14.105   8.051
   77   2HH2  ARG   9          2HH2      ARG   9  -3.286 -14.317   7.608
   78    H    LEU  10           H        LEU  10  -2.551  -7.769   9.078
   79    HA   LEU  10           HA       LEU  10  -2.046  -8.246   6.456
   80   1HB   LEU  10          1HB       LEU  10  -1.490  -6.313   7.895
   81   2HB   LEU  10          2HB       LEU  10  -0.108  -7.205   8.550
   82    HG   LEU  10           HG       LEU  10   1.049  -7.118   6.460
   83   1HD1  LEU  10          1HD1      LEU  10  -1.550  -6.047   5.267
   84   2HD1  LEU  10          2HD1      LEU  10   0.009  -6.187   4.419
   85   3HD1  LEU  10          3HD1      LEU  10  -0.851  -7.655   4.948
   86   1HD2  LEU  10          1HD2      LEU  10   0.874  -5.067   7.866
   87   2HD2  LEU  10          2HD2      LEU  10   1.105  -4.697   6.145
   88   3HD2  LEU  10          3HD2      LEU  10  -0.511  -4.530   6.882
   89    H    LYS  11           H        LYS  11  -1.871 -10.524   6.048
   90    HA   LYS  11           HA       LYS  11   0.308 -12.112   7.104
   91   1HB   LYS  11          1HB       LYS  11  -1.616 -13.332   6.544
   92   2HB   LYS  11          2HB       LYS  11  -1.893 -12.429   5.049
   93   1HG   LYS  11          1HG       LYS  11   0.555 -14.169   5.282
   94   2HG   LYS  11          2HG       LYS  11  -1.044 -14.865   4.896
   95   1HD   LYS  11          1HD       LYS  11   0.409 -12.683   3.345
   96   2HD   LYS  11          2HD       LYS  11  -0.047 -14.315   2.766
   97   1HE   LYS  11          1HE       LYS  11  -2.414 -13.754   2.972
   98   2HE   LYS  11          2HE       LYS  11  -1.989 -12.188   3.731
   99   1HZ   LYS  11          1HZ       LYS  11  -1.284 -12.981   1.002
  100   2HZ   LYS  11          2HZ       LYS  11  -2.557 -12.028   1.412
  101   3HZ   LYS  11          3HZ       LYS  11  -1.022 -11.506   1.713
  102    H    THR  12           H        THR  12  -0.424 -10.518   3.949
  103    HA   THR  12           HA       THR  12   1.843 -11.228   2.530
  104    HB   THR  12           HB       THR  12   0.881  -8.367   2.597
  105    HG1  THR  12           HG1      THR  12  -0.924  -8.910   1.494
  106   1HG2  THR  12          1HG2      THR  12   1.533 -10.212   0.282
  107   2HG2  THR  12          2HG2      THR  12   1.160  -8.482   0.179
  108   3HG2  THR  12          3HG2      THR  12   2.654  -9.033   0.979
  109    H    GLY  13           H        GLY  13   1.306  -8.524   4.777
  110   1HA   GLY  13          1HA       GLY  13   2.646  -6.950   5.759
  111   2HA   GLY  13          2HA       GLY  13   3.951  -8.163   5.790
  112    H    LEU  14           H        LEU  14   2.423  -7.274   2.870
  113    HA   LEU  14           HA       LEU  14   3.361  -6.698   0.837
  114   1HB   LEU  14          1HB       LEU  14   3.325  -4.269   2.572
  115   2HB   LEU  14          2HB       LEU  14   3.435  -4.218   0.812
  116    HG   LEU  14           HG       LEU  14   1.071  -4.562   2.461
  117   1HD1  LEU  14          1HD1      LEU  14   1.338  -3.034   0.532
  118   2HD1  LEU  14          2HD1      LEU  14   1.424  -4.437  -0.560
  119   3HD1  LEU  14          3HD1      LEU  14  -0.075  -4.103   0.344
  120   1HD2  LEU  14          1HD2      LEU  14   1.489  -6.730   0.380
  121   2HD2  LEU  14          2HD2      LEU  14   1.222  -6.957   2.124
  122   3HD2  LEU  14          3HD2      LEU  14  -0.077  -6.290   1.109
  123    H    GLN  15           H        GLN  15   5.167  -8.007   1.016
  124    HA   GLN  15           HA       GLN  15   7.669  -6.667   1.928
  125   1HB   GLN  15          1HB       GLN  15   7.105  -9.517   1.062
  126   2HB   GLN  15          2HB       GLN  15   8.697  -8.931   1.599
  127   1HG   GLN  15          1HG       GLN  15   6.189  -8.654   3.302
  128   2HG   GLN  15          2HG       GLN  15   7.277 -10.056   3.391
  129   1HE2  GLN  15          2HE2      GLN  15   6.783  -6.783   4.448
  130   2HE2  GLN  15          1HE2      GLN  15   8.336  -6.608   5.250
  131    H    ALA  16           H        ALA  16   6.960  -8.749  -0.952
  132    HA   ALA  16           HA       ALA  16   8.330  -6.645  -2.541
  133   1HB   ALA  16          1HB       ALA  16  10.098  -8.128  -1.745
  134   2HB   ALA  16          2HB       ALA  16   9.238  -9.540  -2.401
  135   3HB   ALA  16          3HB       ALA  16   9.882  -8.295  -3.503
  136    H    ARG  17           H        ARG  17   6.188  -9.533  -2.498
  137    HA   ARG  17           HA       ARG  17   5.790  -8.863  -5.390
  138   1HB   ARG  17          1HB       ARG  17   5.719 -11.630  -4.146
  139   2HB   ARG  17          2HB       ARG  17   5.425 -11.260  -5.863
  140   1HG   ARG  17          1HG       ARG  17   7.699 -10.483  -6.144
  141   2HG   ARG  17          2HG       ARG  17   7.932 -10.422  -4.391
  142   1HD   ARG  17          1HD       ARG  17   7.739 -12.869  -6.155
  143   2HD   ARG  17          2HD       ARG  17   9.080 -12.393  -5.104
  144    HE   ARG  17           HE       ARG  17   7.101 -14.162  -4.415
  145   1HH1  ARG  17          2HH1      ARG  17   8.215 -11.127  -3.009
  146   2HH1  ARG  17          1HH1      ARG  17   7.298 -11.329  -1.540
  147   1HH2  ARG  17          1HH2      ARG  17   6.472 -14.708  -2.317
  148   2HH2  ARG  17          2HH2      ARG  17   6.862 -13.666  -0.976
  149    HA   PRO  18           HA       PRO  18   1.500 -10.502  -4.188
  150   1HB   PRO  18          1HB       PRO  18   0.919 -11.359  -1.688
  151   2HB   PRO  18          2HB       PRO  18   1.767 -12.439  -2.855
  152   1HG   PRO  18          1HG       PRO  18   3.074 -10.529  -0.867
  153   2HG   PRO  18          2HG       PRO  18   3.296 -12.274  -0.895
  154   1HD   PRO  18          1HD       PRO  18   5.039 -10.757  -2.207
  155   2HD   PRO  18          2HD       PRO  18   4.358 -12.143  -3.115
  156    H    ALA  19           H        ALA  19   3.304  -8.628  -1.715
  157    HA   ALA  19           HA       ALA  19   1.259  -7.040  -0.757
  158   1HB   ALA  19          1HB       ALA  19   3.742  -6.961  -0.279
  159   2HB   ALA  19          2HB       ALA  19   3.944  -6.145  -1.858
  160   3HB   ALA  19          3HB       ALA  19   3.020  -5.345  -0.551
  161    H    ALA  20           H        ALA  20   3.125  -6.520  -3.764
  162    HA   ALA  20           HA       ALA  20   1.477  -4.181  -4.544
  163   1HB   ALA  20          1HB       ALA  20   3.648  -5.753  -6.032
  164   2HB   ALA  20          2HB       ALA  20   2.911  -4.226  -6.568
  165   3HB   ALA  20          3HB       ALA  20   3.915  -4.263  -5.096
  166    H    LEU  21           H        LEU  21   1.727  -7.673  -5.214
  167    HA   LEU  21           HA       LEU  21  -0.125  -7.662  -7.394
  168   1HB   LEU  21          1HB       LEU  21   1.314  -9.571  -6.544
  169   2HB   LEU  21          2HB       LEU  21   0.089  -9.837  -5.285
  170    HG   LEU  21           HG       LEU  21  -0.156 -11.297  -7.314
  171   1HD1  LEU  21          1HD2      LEU  21  -2.107 -10.789  -5.903
  172   2HD1  LEU  21          2HD2      LEU  21  -2.448  -9.347  -6.888
  173   3HD1  LEU  21          3HD2      LEU  21  -2.570 -10.968  -7.614
  174   1HD2  LEU  21          1HD1      LEU  21   0.623  -9.627  -8.973
  175   2HD2  LEU  21          2HD1      LEU  21  -0.974 -10.285  -9.402
  176   3HD2  LEU  21          3HD1      LEU  21  -0.845  -8.664  -8.683
  177    H    PHE  22           H        PHE  22  -0.548  -7.713  -3.895
  178    HA   PHE  22           HA       PHE  22  -3.366  -7.802  -3.616
  179   1HB   PHE  22          1HB       PHE  22  -2.119  -8.066  -1.629
  180   2HB   PHE  22          2HB       PHE  22  -0.958  -6.836  -2.131
  181    HD1  PHE  22           HD1      PHE  22  -0.811  -4.893  -1.127
  182    HD2  PHE  22           HD2      PHE  22  -4.637  -6.847  -1.261
  183    HE1  PHE  22           HE1      PHE  22  -1.833  -2.953   0.055
  184    HE2  PHE  22           HE2      PHE  22  -5.658  -4.917  -0.065
  185    HZ   PHE  22           HZ       PHE  22  -4.260  -2.999   0.634
  186    H    VAL  23           H        VAL  23  -1.153  -4.940  -3.543
  187    HA   VAL  23           HA       VAL  23  -3.104  -3.007  -3.644
  188    HB   VAL  23           HB       VAL  23  -1.500  -1.489  -4.113
  189   1HG1  VAL  23          1HG1      VAL  23  -0.648  -2.699  -2.252
  190   2HG1  VAL  23          2HG1      VAL  23   0.290  -3.762  -3.338
  191   3HG1  VAL  23          3HG1      VAL  23   0.648  -2.017  -3.248
  192   1HG2  VAL  23          1HG2      VAL  23  -1.300  -2.052  -6.401
  193   2HG2  VAL  23          2HG2      VAL  23   0.284  -1.647  -5.712
  194   3HG2  VAL  23          3HG2      VAL  23  -0.171  -3.364  -6.029
  195    H    GLN  24           H        GLN  24  -1.610  -4.680  -6.441
  196    HA   GLN  24           HA       GLN  24  -3.130  -3.215  -8.358
  197   1HB   GLN  24          1HB       GLN  24  -2.085  -4.457 -10.016
  198   2HB   GLN  24          2HB       GLN  24  -0.886  -4.179  -8.738
  199   1HG   GLN  24          1HG       GLN  24  -0.635  -6.488  -9.469
  200   2HG   GLN  24          2HG       GLN  24  -1.476  -6.543  -7.907
  201   1HE2  GLN  24          2HE2      GLN  24  -3.016  -7.942  -7.975
  202   2HE2  GLN  24          1HE2      GLN  24  -4.054  -8.272  -9.352
  203    H    GLU  25           H        GLU  25  -4.028  -6.010  -6.432
  204    HA   GLU  25           HA       GLU  25  -6.251  -6.675  -8.251
  205   1HB   GLU  25          1HB       GLU  25  -5.763  -7.120  -5.239
  206   2HB   GLU  25          2HB       GLU  25  -7.102  -7.868  -6.144
  207   1HG   GLU  25          1HG       GLU  25  -4.214  -8.255  -6.916
  208   2HG   GLU  25          2HG       GLU  25  -4.992  -9.276  -5.692
  209    H    ALA  26           H        ALA  26  -5.733  -4.805  -5.287
  210    HA   ALA  26           HA       ALA  26  -8.352  -3.709  -4.996
  211   1HB   ALA  26          1HB       ALA  26  -5.632  -2.386  -4.624
  212   2HB   ALA  26          2HB       ALA  26  -7.160  -1.809  -3.920
  213   3HB   ALA  26          3HB       ALA  26  -6.475  -3.369  -3.401
  214    H    ASN  27           H        ASN  27  -5.566  -2.632  -6.832
  215    HA   ASN  27           HA       ASN  27  -6.418  -0.360  -8.223
  216   1HB   ASN  27          1HB       ASN  27  -4.477  -2.625  -8.486
  217   2HB   ASN  27          2HB       ASN  27  -4.861  -1.826  -9.996
  218   1HD2  ASN  27          2HD2      ASN  27  -3.827  -1.113  -6.638
  219   2HD2  ASN  27          1HD2      ASN  27  -2.774   0.236  -7.015
  220    H    ARG  28           H        ARG  28  -6.495  -3.767  -9.001
  221    HA   ARG  28           HA       ARG  28  -7.365  -3.939 -11.599
  222   1HB   ARG  28          1HB       ARG  28  -7.203  -5.551  -9.142
  223   2HB   ARG  28          2HB       ARG  28  -8.419  -6.142 -10.241
  224   1HG   ARG  28          1HG       ARG  28  -6.551  -5.772 -12.082
  225   2HG   ARG  28          2HG       ARG  28  -5.456  -5.783 -10.684
  226   1HD   ARG  28          1HD       ARG  28  -5.715  -8.064 -11.639
  227   2HD   ARG  28          2HD       ARG  28  -6.364  -7.986  -9.989
  228    HE   ARG  28           HE       ARG  28  -8.340  -7.468 -12.076
  229   1HH1  ARG  28          1HH2      ARG  28  -6.752  -9.904 -10.079
  230   2HH1  ARG  28          2HH2      ARG  28  -7.959 -11.136 -10.349
  231   1HH2  ARG  28          2HH1      ARG  28  -9.960  -9.047 -12.419
  232   2HH2  ARG  28          1HH1      ARG  28  -9.833 -10.627 -11.692
  233    H    PHE  29           H        PHE  29  -9.238  -3.097  -8.748
  234    HA   PHE  29           HA       PHE  29 -11.794  -3.316 -10.171
  235   1HB   PHE  29          1HB       PHE  29 -10.885  -2.024  -7.564
  236   2HB   PHE  29          2HB       PHE  29 -12.573  -2.089  -8.104
  237    HD1  PHE  29           HD1      PHE  29 -13.489  -4.538  -8.589
  238    HD2  PHE  29           HD2      PHE  29  -9.845  -3.748  -6.449
  239    HE1  PHE  29           HE1      PHE  29 -13.663  -6.754  -7.468
  240    HE2  PHE  29           HE2      PHE  29 -10.044  -5.950  -5.293
  241    HZ   PHE  29           HZ       PHE  29 -12.038  -7.385  -5.715
  242    H    THR  30           H        THR  30 -10.787  -0.497  -8.394
  243    HA   THR  30           HA       THR  30 -10.113   1.263 -10.535
  244    HB   THR  30           HB       THR  30 -12.152   2.781 -10.048
  245    HG1  THR  30           HG1      THR  30 -13.358   0.282  -9.411
  246   1HG2  THR  30          1HG2      THR  30 -13.582   1.649 -11.752
  247   2HG2  THR  30          2HG2      THR  30 -11.868   1.739 -12.227
  248   3HG2  THR  30          3HG2      THR  30 -12.532   0.210 -11.622
  249    H    SER  31           H        SER  31 -11.940   1.134  -7.593
  250    HA   SER  31           HA       SER  31 -11.648   2.989  -5.972
  251   1HB   SER  31          1HB       SER  31 -10.791   0.240  -5.083
  252   2HB   SER  31          2HB       SER  31 -11.723   1.447  -4.166
  253    HG   SER  31           HG       SER  31 -13.126  -0.089  -5.064
  254    H    ASP  32           H        ASP  32 -10.539   4.177  -4.716
  255    HA   ASP  32           HA       ASP  32  -7.601   4.041  -4.789
  256   1HB   ASP  32          1HB       ASP  32  -9.027   6.211  -4.811
  257   2HB   ASP  32          2HB       ASP  32  -9.259   5.877  -3.070
  258    H    VAL  33           H        VAL  33  -7.122   2.218  -3.773
  259    HA   VAL  33           HA       VAL  33  -8.591   1.253  -1.491
  260    HB   VAL  33           HB       VAL  33  -6.197   0.270  -3.073
  261   1HG1  VAL  33          1HG1      VAL  33  -6.255  -0.781  -0.811
  262   2HG1  VAL  33          2HG1      VAL  33  -7.948  -1.241  -1.088
  263   3HG1  VAL  33          3HG1      VAL  33  -6.664  -1.942  -2.105
  264   1HG2  VAL  33          1HG2      VAL  33  -8.334   0.743  -4.209
  265   2HG2  VAL  33          2HG2      VAL  33  -8.056  -1.015  -4.172
  266   3HG2  VAL  33          3HG2      VAL  33  -9.206  -0.245  -3.032
  267    H    PHE  34           H        PHE  34  -7.800   0.755   0.550
  268    HA   PHE  34           HA       PHE  34  -5.424   2.290   1.401
  269   1HB   PHE  34          1HB       PHE  34  -8.161   2.618   2.665
  270   2HB   PHE  34          2HB       PHE  34  -6.622   3.244   3.273
  271    HD1  PHE  34           HD1      PHE  34  -9.471   4.280   1.548
  272    HD2  PHE  34           HD2      PHE  34  -5.182   4.510   1.416
  273    HE1  PHE  34           HE1      PHE  34  -9.631   6.225   0.031
  274    HE2  PHE  34           HE2      PHE  34  -5.340   6.472  -0.135
  275    HZ   PHE  34           HZ       PHE  34  -7.565   7.276  -0.875
  276    H    LEU  35           H        LEU  35  -4.749   1.750   3.597
  277    HA   LEU  35           HA       LEU  35  -5.802  -0.831   4.595
  278   1HB   LEU  35          1HB       LEU  35  -3.781  -1.232   3.089
  279   2HB   LEU  35          2HB       LEU  35  -2.814  -0.336   4.286
  280    HG   LEU  35           HG       LEU  35  -3.536  -1.939   6.040
  281   1HD1  LEU  35          1HD2      LEU  35  -4.999  -3.296   3.730
  282   2HD1  LEU  35          2HD2      LEU  35  -4.862  -3.930   5.387
  283   3HD1  LEU  35          3HD2      LEU  35  -5.773  -2.435   5.080
  284   1HD2  LEU  35          1HD1      LEU  35  -1.515  -2.462   4.698
  285   2HD2  LEU  35          2HD1      LEU  35  -2.376  -3.945   5.178
  286   3HD2  LEU  35          3HD1      LEU  35  -2.530  -3.325   3.517
  287    H    GLU  36           H        GLU  36  -6.267  -0.483   6.667
  288    HA   GLU  36           HA       GLU  36  -5.072   1.920   8.006
  289   1HB   GLU  36          1HB       GLU  36  -7.711   0.628   8.699
  290   2HB   GLU  36          2HB       GLU  36  -7.171   2.282   9.032
  291   1HG   GLU  36          1HG       GLU  36  -7.314   2.821   6.651
  292   2HG   GLU  36          2HG       GLU  36  -7.787   1.160   6.272
  293    H    LYS  37           H        LYS  37  -3.326   0.650   9.035
  294    HA   LYS  37           HA       LYS  37  -3.493  -1.891  10.232
  295   1HB   LYS  37          1HB       LYS  37  -1.776   0.556  10.777
  296   2HB   LYS  37          2HB       LYS  37  -1.422  -1.101  11.268
  297   1HG   LYS  37          1HG       LYS  37  -1.477  -1.679   8.830
  298   2HG   LYS  37          2HG       LYS  37  -1.458   0.058   8.467
  299   1HD   LYS  37          1HD       LYS  37   0.809  -1.122   8.503
  300   2HD   LYS  37          2HD       LYS  37   0.711   0.304   9.560
  301   1HE   LYS  37          1HE       LYS  37   0.159  -2.499  10.620
  302   2HE   LYS  37          2HE       LYS  37   1.807  -1.864  10.421
  303   1HZ   LYS  37          1HZ       LYS  37   1.281  -0.043  11.820
  304   2HZ   LYS  37          2HZ       LYS  37  -0.247  -0.610  12.087
  305   3HZ   LYS  37          3HZ       LYS  37   1.056  -1.472  12.605
  306    H    ASP  38           H        ASP  38  -5.373  -1.992  11.653
  307    HA   ASP  38           HA       ASP  38  -6.654  -1.533  13.487
  308   1HB   ASP  38          1HB       ASP  38  -3.892  -0.897  14.571
  309   2HB   ASP  38          2HB       ASP  38  -5.366  -0.965  15.560
  310    H    GLY  39           H        GLY  39  -6.240   0.587  11.475
  311   1HA   GLY  39          1HA       GLY  39  -7.530   2.738  11.794
  312   2HA   GLY  39          2HA       GLY  39  -6.539   2.948  13.258
  313    H    LYS  40           H        LYS  40  -4.092   1.821  11.722
  314    HA   LYS  40           HA       LYS  40  -3.141   4.405  10.826
  315   1HB   LYS  40          1HB       LYS  40  -1.851   1.660  10.659
  316   2HB   LYS  40          2HB       LYS  40  -1.028   3.235  10.590
  317   1HG   LYS  40          1HG       LYS  40  -1.923   3.675  12.941
  318   2HG   LYS  40          2HG       LYS  40  -2.498   1.984  12.951
  319   1HD   LYS  40          1HD       LYS  40  -0.275   2.189  14.037
  320   2HD   LYS  40          2HD       LYS  40  -0.209   1.179  12.574
  321   1HE   LYS  40          1HE       LYS  40   0.598   3.121  11.263
  322   2HE   LYS  40          2HE       LYS  40   0.523   4.140  12.715
  323   1HZ   LYS  40          1HZ       LYS  40   2.231   1.774  12.383
  324   2HZ   LYS  40          2HZ       LYS  40   2.731   3.340  12.304
  325   3HZ   LYS  40          3HZ       LYS  40   2.160   2.733  13.723
  326    H    LYS  41           H        LYS  41  -4.811   4.589   9.145
  327    HA   LYS  41           HA       LYS  41  -4.611   2.834   6.838
  328   1HB   LYS  41          1HB       LYS  41  -6.732   3.537   7.563
  329   2HB   LYS  41          2HB       LYS  41  -6.275   5.240   7.559
  330   1HG   LYS  41          1HG       LYS  41  -6.187   3.676   4.969
  331   2HG   LYS  41          2HG       LYS  41  -7.743   4.235   5.614
  332   1HD   LYS  41          1HD       LYS  41  -6.618   6.549   5.902
  333   2HD   LYS  41          2HD       LYS  41  -5.314   5.929   4.875
  334   1HE   LYS  41          1HE       LYS  41  -6.959   7.140   3.509
  335   2HE   LYS  41          2HE       LYS  41  -7.027   5.416   3.109
  336   1HZ   LYS  41          1HZ       LYS  41  -8.903   5.248   4.634
  337   2HZ   LYS  41          2HZ       LYS  41  -8.865   6.878   4.882
  338   3HZ   LYS  41          3HZ       LYS  41  -9.209   6.266   3.387
  339    H    VAL  42           H        VAL  42  -3.855   3.080   4.979
  340    HA   VAL  42           HA       VAL  42  -2.699   5.601   3.937
  341    HB   VAL  42           HB       VAL  42  -0.962   4.331   5.111
  342   1HG1  VAL  42          1HG2      VAL  42  -2.068   2.144   4.960
  343   2HG1  VAL  42          2HG2      VAL  42  -1.784   2.095   3.208
  344   3HG1  VAL  42          3HG2      VAL  42  -0.404   2.020   4.344
  345   1HG2  VAL  42          1HG1      VAL  42  -0.264   5.559   3.128
  346   2HG2  VAL  42          2HG1      VAL  42   0.696   4.074   3.360
  347   3HG2  VAL  42          3HG1      VAL  42  -0.584   4.117   2.126
  348    H    ASN  43           H        ASN  43  -1.889   5.036   1.605
  349    HA   ASN  43           HA       ASN  43  -4.263   4.084   0.155
  350   1HB   ASN  43          1HB       ASN  43  -3.038   6.215  -0.417
  351   2HB   ASN  43          2HB       ASN  43  -1.634   5.222  -0.867
  352   1HD2  ASN  43          2HD2      ASN  43  -5.056   4.214  -1.563
  353   2HD2  ASN  43          1HD2      ASN  43  -4.971   4.720  -3.239
  354    H    ALA  44           H        ALA  44  -4.377   2.044   0.432
  355    HA   ALA  44           HA       ALA  44  -2.329   0.135   0.541
  356   1HB   ALA  44          1HB       ALA  44  -5.264  -0.064  -0.261
  357   2HB   ALA  44          2HB       ALA  44  -4.247  -1.468   0.114
  358   3HB   ALA  44          3HB       ALA  44  -4.625  -0.271   1.385
  359    H    LYS  45           H        LYS  45  -4.239   1.387  -2.131
  360    HA   LYS  45           HA       LYS  45  -3.355  -0.717  -3.962
  361   1HB   LYS  45          1HB       LYS  45  -4.466   0.626  -5.690
  362   2HB   LYS  45          2HB       LYS  45  -5.538   0.327  -4.300
  363   1HG   LYS  45          1HG       LYS  45  -5.171   2.567  -3.450
  364   2HG   LYS  45          2HG       LYS  45  -3.852   2.835  -4.601
  365   1HD   LYS  45          1HD       LYS  45  -6.792   2.396  -5.390
  366   2HD   LYS  45          2HD       LYS  45  -5.897   3.939  -5.462
  367   1HE   LYS  45          1HE       LYS  45  -4.391   2.974  -7.145
  368   2HE   LYS  45          2HE       LYS  45  -5.142   1.379  -6.937
  369   1HZ   LYS  45          1HZ       LYS  45  -7.217   2.336  -7.718
  370   2HZ   LYS  45          2HZ       LYS  45  -6.480   3.785  -7.959
  371   3HZ   LYS  45          3HZ       LYS  45  -6.019   2.472  -8.840
  372    H    SER  46           H        SER  46  -1.884   2.192  -2.776
  373    HA   SER  46           HA       SER  46  -0.172   2.198  -5.185
  374   1HB   SER  46          1HB       SER  46  -1.416   4.332  -4.719
  375   2HB   SER  46          2HB       SER  46  -0.501   4.488  -3.218
  376    HG   SER  46           HG       SER  46   0.411   5.574  -5.119
  377    H    ILE  47           H        ILE  47   1.920   3.237  -4.567
  378    HA   ILE  47           HA       ILE  47   3.699   1.475  -3.289
  379    HB   ILE  47           HB       ILE  47   4.632   3.009  -4.749
  380   1HG1  ILE  47          1HG1      ILE  47   5.900   2.950  -2.478
  381   2HG1  ILE  47          2HG1      ILE  47   6.307   4.214  -3.656
  382   1HG2  ILE  47          1HG2      ILE  47   2.757   4.592  -4.861
  383   2HG2  ILE  47          2HG2      ILE  47   3.289   5.317  -3.325
  384   3HG2  ILE  47          3HG2      ILE  47   4.328   5.424  -4.763
  385   1HD1  ILE  47          1HD1      ILE  47   4.788   5.809  -2.467
  386   2HD1  ILE  47          2HD1      ILE  47   4.491   4.571  -1.240
  387   3HD1  ILE  47          3HD1      ILE  47   6.121   5.237  -1.430
  388    H    MET  48           H        MET  48   2.353   4.510  -2.061
  389    HA   MET  48           HA       MET  48   3.688   4.481   0.396
  390   1HB   MET  48          1HB       MET  48   2.591   6.416  -0.668
  391   2HB   MET  48          2HB       MET  48   1.009   5.734  -0.256
  392   1HG   MET  48          1HG       MET  48   1.734   7.434   1.398
  393   2HG   MET  48          2HG       MET  48   1.655   5.834   2.163
  394   1HE   MET  48          1HE       MET  48   4.004   8.431   0.410
  395   2HE   MET  48          2HE       MET  48   5.611   7.729   0.733
  396   3HE   MET  48          3HE       MET  48   4.466   6.876  -0.332
  397    H    GLY  49           H        GLY  49   0.427   3.163  -0.364
  398   1HA   GLY  49          1HA       GLY  49  -0.151   2.473   2.385
  399   2HA   GLY  49          2HA       GLY  49  -1.019   1.936   0.921
  400    H    LEU  50           H        LEU  50   0.873   0.669  -0.567
  401    HA   LEU  50           HA       LEU  50   1.022  -1.889   0.432
  402   1HB   LEU  50          1HB       LEU  50   1.343  -0.838  -1.922
  403   2HB   LEU  50          2HB       LEU  50   3.032  -0.589  -1.433
  404    HG   LEU  50           HG       LEU  50   1.566  -3.250  -1.633
  405   1HD1  LEU  50          1HD1      LEU  50   2.169  -2.212  -3.797
  406   2HD1  LEU  50          2HD1      LEU  50   3.850  -2.030  -3.240
  407   3HD1  LEU  50          3HD1      LEU  50   3.159  -3.654  -3.479
  408   1HD2  LEU  50          1HD2      LEU  50   4.457  -2.626  -0.889
  409   2HD2  LEU  50          2HD2      LEU  50   3.196  -3.234   0.204
  410   3HD2  LEU  50          3HD2      LEU  50   3.761  -4.255  -1.134
  411    H    MET  51           H        MET  51   3.673   0.512   0.178
  412    HA   MET  51           HA       MET  51   5.501  -1.229   1.534
  413   1HB   MET  51          1HB       MET  51   6.130   0.327  -0.299
  414   2HB   MET  51          2HB       MET  51   5.705   1.702   0.743
  415   1HG   MET  51          1HG       MET  51   7.412   0.896   2.397
  416   2HG   MET  51          2HG       MET  51   7.912  -0.332   1.222
  417   1HE   MET  51          1HE       MET  51   6.674   3.248   0.367
  418   2HE   MET  51          2HE       MET  51   7.488   3.491   1.932
  419   3HE   MET  51          3HE       MET  51   8.171   4.212   0.453
  420    H    SER  52           H        SER  52   3.651   1.715   2.605
  421    HA   SER  52           HA       SER  52   5.304   1.762   4.994
  422   1HB   SER  52          1HB       SER  52   2.753   3.326   4.503
  423   2HB   SER  52          2HB       SER  52   4.069   3.698   5.643
  424    HG   SER  52           HG       SER  52   4.023   3.805   2.825
  425    H    LEU  53           H        LEU  53   1.717   1.451   4.657
  426    HA   LEU  53           HA       LEU  53   1.623   0.460   7.412
  427   1HB   LEU  53          1HB       LEU  53  -0.472   1.065   5.363
  428   2HB   LEU  53          2HB       LEU  53  -0.816   0.289   6.921
  429    HG   LEU  53           HG       LEU  53  -1.121   2.624   7.233
  430   1HD1  LEU  53          1HD1      LEU  53  -0.094   1.436   9.086
  431   2HD1  LEU  53          2HD1      LEU  53   1.531   1.779   8.432
  432   3HD1  LEU  53          3HD1      LEU  53   0.502   3.112   9.016
  433   1HD2  LEU  53          1HD2      LEU  53   0.277   3.459   5.349
  434   2HD2  LEU  53          2HD2      LEU  53   0.644   4.303   6.875
  435   3HD2  LEU  53          3HD2      LEU  53   1.735   3.029   6.276
  436    H    ALA  54           H        ALA  54   0.756  -0.714   4.153
  437    HA   ALA  54           HA       ALA  54  -0.128  -3.286   4.846
  438   1HB   ALA  54          1HB       ALA  54  -0.607  -2.090   2.729
  439   2HB   ALA  54          2HB       ALA  54   1.097  -2.273   2.257
  440   3HB   ALA  54          3HB       ALA  54   0.070  -3.709   2.440
  441    H    VAL  55           H        VAL  55   3.152  -2.104   4.752
  442    HA   VAL  55           HA       VAL  55   4.350  -4.694   4.322
  443    HB   VAL  55           HB       VAL  55   5.370  -2.372   3.929
  444   1HG1  VAL  55          1HG1      VAL  55   4.901  -1.443   6.184
  445   2HG1  VAL  55          2HG1      VAL  55   5.948  -2.688   6.907
  446   3HG1  VAL  55          3HG1      VAL  55   6.640  -1.451   5.830
  447   1HG2  VAL  55          1HG2      VAL  55   6.908  -4.507   5.452
  448   2HG2  VAL  55          2HG2      VAL  55   6.596  -4.479   3.700
  449   3HG2  VAL  55          3HG2      VAL  55   7.632  -3.233   4.435
  450    H    SER  56           H        SER  56   2.603  -3.456   7.004
  451    HA   SER  56           HA       SER  56   4.395  -4.665   8.938
  452   1HB   SER  56          1HB       SER  56   1.588  -3.624   9.432
  453   2HB   SER  56          2HB       SER  56   2.919  -3.765  10.595
  454    HG   SER  56           HG       SER  56   2.744  -2.014   8.347
  455    H    THR  57           H        THR  57   4.235  -6.832   7.785
  456    HA   THR  57           HA       THR  57   2.171  -8.575   7.918
  457    HB   THR  57           HB       THR  57   4.807  -9.424   9.074
  458    HG1  THR  57           HG1      THR  57   5.639  -9.315   6.903
  459   1HG2  THR  57          1HG2      THR  57   2.943 -10.444   6.872
  460   2HG2  THR  57          2HG2      THR  57   4.377 -11.303   7.488
  461   3HG2  THR  57          3HG2      THR  57   2.975 -11.019   8.550
  462    H    GLY  58           H        GLY  58   0.787  -9.235   9.402
  463   1HA   GLY  58          1HA       GLY  58   0.131 -10.272  11.398
  464   2HA   GLY  58          2HA       GLY  58   1.632  -9.762  12.175
  465    H    THR  59           H        THR  59  -0.045  -7.186  10.476
  466    HA   THR  59           HA       THR  59  -1.165  -6.435  13.126
  467    HB   THR  59           HB       THR  59   0.638  -4.929  12.500
  468    HG1  THR  59           HG1      THR  59   0.358  -5.118  10.205
  469   1HG2  THR  59          1HG2      THR  59  -0.581  -2.792  12.660
  470   2HG2  THR  59          2HG2      THR  59  -2.094  -3.622  12.232
  471   3HG2  THR  59          3HG2      THR  59  -1.268  -4.016  13.756
  472    H    GLU  60           H        GLU  60  -3.319  -5.674  13.233
  473    HA   GLU  60           HA       GLU  60  -4.907  -6.796  11.078
  474   1HB   GLU  60          1HB       GLU  60  -6.036  -5.390  13.485
  475   2HB   GLU  60          2HB       GLU  60  -6.685  -6.774  12.552
  476   1HG   GLU  60          1HG       GLU  60  -4.185  -6.855  14.292
  477   2HG   GLU  60          2HG       GLU  60  -5.764  -7.467  14.778
  478    H    VAL  61           H        VAL  61  -4.299  -5.420   9.478
  479    HA   VAL  61           HA       VAL  61  -5.050  -2.560   9.707
  480    HB   VAL  61           HB       VAL  61  -3.748  -2.270   7.655
  481   1HG1  VAL  61          1HG1      VAL  61  -2.421  -4.299   9.529
  482   2HG1  VAL  61          2HG1      VAL  61  -1.563  -3.256   8.375
  483   3HG1  VAL  61          3HG1      VAL  61  -2.419  -2.537   9.764
  484   1HG2  VAL  61          1HG2      VAL  61  -4.590  -4.349   6.624
  485   2HG2  VAL  61          2HG2      VAL  61  -2.799  -4.231   6.543
  486   3HG2  VAL  61          3HG2      VAL  61  -3.586  -5.296   7.758
  487    H    THR  62           H        THR  62  -6.740  -1.719   8.784
  488    HA   THR  62           HA       THR  62  -8.811  -3.373   7.695
  489    HB   THR  62           HB       THR  62  -8.787  -0.347   7.756
  490    HG1  THR  62           HG1      THR  62  -8.006  -0.958   9.811
  491   1HG2  THR  62          1HG2      THR  62 -11.149  -0.765   8.379
  492   2HG2  THR  62          2HG2      THR  62 -10.752  -1.564   6.848
  493   3HG2  THR  62          3HG2      THR  62 -10.846  -2.517   8.349
  494    H    LEU  63           H        LEU  63  -8.650  -4.081   5.549
  495    HA   LEU  63           HA       LEU  63  -7.376  -2.321   3.613
  496   1HB   LEU  63          1HB       LEU  63  -7.034  -4.820   3.715
  497   2HB   LEU  63          2HB       LEU  63  -8.741  -5.036   3.277
  498    HG   LEU  63           HG       LEU  63  -7.086  -5.229   1.417
  499   1HD1  LEU  63          1HD1      LEU  63  -9.459  -4.710   0.964
  500   2HD1  LEU  63          2HD1      LEU  63  -9.107  -2.971   1.109
  501   3HD1  LEU  63          3HD1      LEU  63  -8.388  -3.914  -0.216
  502   1HD2  LEU  63          1HD2      LEU  63  -5.560  -3.421   2.137
  503   2HD2  LEU  63          2HD2      LEU  63  -6.146  -3.117   0.484
  504   3HD2  LEU  63          3HD2      LEU  63  -6.836  -2.215   1.851
  505    H    ILE  64           H        ILE  64  -8.306  -0.798   2.872
  506    HA   ILE  64           HA       ILE  64 -11.229  -0.533   2.593
  507    HB   ILE  64           HB       ILE  64  -8.793   1.304   2.583
  508   1HG1  ILE  64          1HG1      ILE  64 -11.195   0.843   4.361
  509   2HG1  ILE  64          2HG1      ILE  64  -9.478   0.716   4.791
  510   1HG2  ILE  64          1HG2      ILE  64 -11.680   2.021   2.007
  511   2HG2  ILE  64          2HG2      ILE  64 -10.367   3.188   2.306
  512   3HG2  ILE  64          3HG2      ILE  64 -10.313   2.137   0.869
  513   1HD1  ILE  64          1HD1      ILE  64  -9.184   3.147   4.342
  514   2HD1  ILE  64          2HD1      ILE  64 -10.940   3.289   4.014
  515   3HD1  ILE  64          3HD1      ILE  64 -10.356   2.831   5.648
  516    H    ALA  65           H        ALA  65 -12.114   0.151   0.670
  517    HA   ALA  65           HA       ALA  65 -10.339   0.523  -1.643
  518   1HB   ALA  65          1HB       ALA  65 -11.085  -1.846  -1.808
  519   2HB   ALA  65          2HB       ALA  65 -12.779  -1.303  -1.683
  520   3HB   ALA  65          3HB       ALA  65 -11.794  -0.837  -3.095
  521    H    GLN  66           H        GLN  66 -10.696   2.594  -1.916
  522    HA   GLN  66           HA       GLN  66 -13.493   3.506  -1.612
  523   1HB   GLN  66          1HB       GLN  66 -11.705   4.362  -0.015
  524   2HB   GLN  66          2HB       GLN  66 -10.799   4.952  -1.415
  525   1HG   GLN  66          1HG       GLN  66 -13.327   5.998  -1.812
  526   2HG   GLN  66          2HG       GLN  66 -13.114   6.095  -0.044
  527   1HE2  GLN  66          2HE2      GLN  66 -11.238   6.601  -3.072
  528   2HE2  GLN  66          1HE2      GLN  66 -10.397   8.055  -2.522
  529    H    GLY  67           H        GLY  67 -13.749   2.538  -3.712
  530   1HA   GLY  67          1HA       GLY  67 -13.574   4.605  -5.734
  531   2HA   GLY  67          2HA       GLY  67 -12.628   3.150  -6.113
  532    H    GLU  68           H        GLU  68 -14.099   2.944  -7.939
  533    HA   GLU  68           HA       GLU  68 -16.895   2.742  -7.680
  534   1HB   GLU  68          1HB       GLU  68 -15.096   1.488  -9.782
  535   2HB   GLU  68          2HB       GLU  68 -16.818   1.909  -9.963
  536   1HG   GLU  68          1HG       GLU  68 -14.520   3.847  -9.456
  537   2HG   GLU  68          2HG       GLU  68 -15.354   3.612 -11.006
  538    H    ASP  69           H        ASP  69 -14.426   0.271  -6.872
  539    HA   ASP  69           HA       ASP  69 -16.685  -1.703  -6.925
  540   1HB   ASP  69          1HB       ASP  69 -13.736  -2.320  -6.904
  541   2HB   ASP  69          2HB       ASP  69 -15.079  -3.441  -7.072
  542    H    GLU  70           H        GLU  70 -15.748   0.483  -4.915
  543    HA   GLU  70           HA       GLU  70 -14.128  -0.065  -3.046
  544   1HB   GLU  70          1HB       GLU  70 -15.706   0.979  -1.415
  545   2HB   GLU  70          2HB       GLU  70 -15.476   1.787  -2.975
  546   1HG   GLU  70          1HG       GLU  70 -17.622   1.929  -3.281
  547   2HG   GLU  70          2HG       GLU  70 -17.681   0.168  -3.455
  548    H    GLN  71           H        GLN  71 -17.341  -1.202  -1.900
  549    HA   GLN  71           HA       GLN  71 -16.428  -2.839   0.065
  550   1HB   GLN  71          1HB       GLN  71 -18.759  -2.156  -0.445
  551   2HB   GLN  71          2HB       GLN  71 -18.815  -3.352  -1.753
  552   1HG   GLN  71          1HG       GLN  71 -19.874  -4.108   0.392
  553   2HG   GLN  71          2HG       GLN  71 -18.566  -5.170  -0.163
  554   1HE2  GLN  71          2HE2      GLN  71 -16.546  -5.154   0.909
  555   2HE2  GLN  71          1HE2      GLN  71 -16.453  -4.615   2.586
  556    H    GLU  72           H        GLU  72 -16.666  -3.694  -3.367
  557    HA   GLU  72           HA       GLU  72 -16.250  -6.552  -3.128
  558   1HB   GLU  72          1HB       GLU  72 -17.373  -5.723  -5.064
  559   2HB   GLU  72          2HB       GLU  72 -16.248  -4.348  -5.192
  560   1HG   GLU  72          1HG       GLU  72 -15.773  -5.765  -7.003
  561   2HG   GLU  72          2HG       GLU  72 -14.435  -5.898  -5.858
  562    H    ALA  73           H        ALA  73 -14.296  -3.644  -3.802
  563    HA   ALA  73           HA       ALA  73 -11.869  -4.944  -4.508
  564   1HB   ALA  73          1HB       ALA  73 -12.643  -2.178  -3.494
  565   2HB   ALA  73          2HB       ALA  73 -11.049  -2.570  -4.195
  566   3HB   ALA  73          3HB       ALA  73 -12.527  -2.683  -5.190
  567    H    LEU  74           H        LEU  74 -12.937  -3.213  -1.566
  568    HA   LEU  74           HA       LEU  74 -10.652  -3.937  -0.028
  569   1HB   LEU  74          1HB       LEU  74 -12.006  -3.097   1.888
  570   2HB   LEU  74          2HB       LEU  74 -11.950  -2.036   0.461
  571    HG   LEU  74           HG       LEU  74 -14.188  -3.618  -0.018
  572   1HD1  LEU  74          1HD2      LEU  74 -14.063  -2.614   2.859
  573   2HD1  LEU  74          2HD2      LEU  74 -15.527  -3.197   2.026
  574   3HD1  LEU  74          3HD2      LEU  74 -14.180  -4.321   2.342
  575   1HD2  LEU  74          1HD1      LEU  74 -13.809  -0.813   1.119
  576   2HD2  LEU  74          2HD1      LEU  74 -13.756  -1.278  -0.595
  577   3HD2  LEU  74          3HD1      LEU  74 -15.278  -1.409   0.303
  578    H    GLU  75           H        GLU  75 -13.792  -5.641  -0.511
  579    HA   GLU  75           HA       GLU  75 -13.341  -7.676   1.411
  580   1HB   GLU  75          1HB       GLU  75 -14.712  -7.669  -1.303
  581   2HB   GLU  75          2HB       GLU  75 -14.661  -9.109  -0.262
  582   1HG   GLU  75          1HG       GLU  75 -15.763  -7.911   1.561
  583   2HG   GLU  75          2HG       GLU  75 -15.718  -6.412   0.600
  584    H    LYS  76           H        LYS  76 -12.454  -7.687  -2.121
  585    HA   LYS  76           HA       LYS  76 -11.204 -10.248  -1.986
  586   1HB   LYS  76          1HB       LYS  76 -10.334  -7.989  -3.824
  587   2HB   LYS  76          2HB       LYS  76 -10.170  -9.739  -4.066
  588   1HG   LYS  76          1HG       LYS  76 -12.816  -9.673  -3.837
  589   2HG   LYS  76          2HG       LYS  76 -12.579  -7.985  -4.312
  590   1HD   LYS  76          1HD       LYS  76 -11.919 -10.587  -5.759
  591   2HD   LYS  76          2HD       LYS  76 -12.867  -9.230  -6.378
  592   1HE   LYS  76          1HE       LYS  76 -10.742  -7.906  -6.632
  593   2HE   LYS  76          2HE       LYS  76  -9.828  -9.252  -5.930
  594   1HZ   LYS  76          1HZ       LYS  76 -11.391  -9.327  -8.409
  595   2HZ   LYS  76          2HZ       LYS  76  -9.750  -9.236  -8.301
  596   3HZ   LYS  76          3HZ       LYS  76 -10.536 -10.591  -7.778
  597    H    LEU  77           H        LEU  77  -9.873  -6.962  -1.720
  598    HA   LEU  77           HA       LEU  77  -7.190  -7.896  -1.440
  599   1HB   LEU  77          1HB       LEU  77  -8.495  -5.233  -0.897
  600   2HB   LEU  77          2HB       LEU  77  -6.752  -5.545  -0.704
  601    HG   LEU  77           HG       LEU  77  -7.040  -4.677  -2.956
  602   1HD1  LEU  77          1HD2      LEU  77  -6.877  -7.711  -3.016
  603   2HD1  LEU  77          2HD2      LEU  77  -6.307  -6.602  -4.285
  604   3HD1  LEU  77          3HD2      LEU  77  -5.496  -6.613  -2.691
  605   1HD2  LEU  77          1HD1      LEU  77  -8.963  -6.994  -3.383
  606   2HD2  LEU  77          2HD1      LEU  77  -9.441  -5.284  -3.322
  607   3HD2  LEU  77          3HD1      LEU  77  -8.384  -5.879  -4.641
  608    H    ALA  78           H        ALA  78  -9.496  -6.769   1.141
  609    HA   ALA  78           HA       ALA  78  -7.544  -7.258   3.200
  610   1HB   ALA  78          1HB       ALA  78  -9.474  -5.792   3.644
  611   2HB   ALA  78          2HB       ALA  78 -10.576  -7.182   3.471
  612   3HB   ALA  78          3HB       ALA  78  -9.389  -7.122   4.789
  613    H    ALA  79           H        ALA  79  -9.904  -9.322   1.519
  614    HA   ALA  79           HA       ALA  79  -9.682 -11.611   3.221
  615   1HB   ALA  79          1HB       ALA  79 -11.273 -11.311   1.266
  616   2HB   ALA  79          2HB       ALA  79  -9.861 -11.437   0.180
  617   3HB   ALA  79          3HB       ALA  79 -10.341 -12.835   1.177
  618    H    TYR  80           H        TYR  80  -8.012 -10.640   0.266
  619    HA   TYR  80           HA       TYR  80  -6.133 -12.632  -0.116
  620   1HB   TYR  80          1HB       TYR  80  -6.855 -10.842  -1.622
  621   2HB   TYR  80          2HB       TYR  80  -6.121  -9.628  -0.577
  622    HD1  TYR  80           HD1      TYR  80  -3.506  -9.936  -0.151
  623    HD2  TYR  80           HD2      TYR  80  -5.691 -11.402  -3.556
  624    HE1  TYR  80           HE1      TYR  80  -1.411  -9.934  -1.492
  625    HE2  TYR  80           HE2      TYR  80  -3.601 -11.353  -4.911
  626    HH   TYR  80           HH       TYR  80  -0.579 -10.068  -3.569
  627    H    VAL  81           H        VAL  81  -5.421  -9.452   1.231
  628    HA   VAL  81           HA       VAL  81  -2.792  -9.587   1.903
  629    HB   VAL  81           HB       VAL  81  -3.341  -7.875   3.643
  630   1HG1  VAL  81          1HG1      VAL  81  -3.184  -7.271   1.253
  631   2HG1  VAL  81          2HG1      VAL  81  -4.916  -7.642   1.061
  632   3HG1  VAL  81          3HG1      VAL  81  -4.407  -6.291   2.103
  633   1HG2  VAL  81          1HG2      VAL  81  -5.425  -8.952   4.465
  634   2HG2  VAL  81          2HG2      VAL  81  -5.729  -7.273   3.972
  635   3HG2  VAL  81          3HG2      VAL  81  -6.209  -8.621   2.910
  636    H    GLN  82           H        GLN  82  -5.400 -10.989   3.892
  637    HA   GLN  82           HA       GLN  82  -3.327 -11.520   5.975
  638   1HB   GLN  82          1HB       GLN  82  -5.188 -11.417   7.521
  639   2HB   GLN  82          2HB       GLN  82  -5.289 -10.026   6.432
  640   1HG   GLN  82          1HG       GLN  82  -7.022 -11.242   5.116
  641   2HG   GLN  82          2HG       GLN  82  -6.806 -12.647   6.165
  642   1HE2  GLN  82          2HE2      GLN  82  -8.613 -10.017   5.651
  643   2HE2  GLN  82          1HE2      GLN  82  -9.266  -9.633   7.254
  644    H    GLU  83           H        GLU  83  -4.398 -13.114   3.404
  645    HA   GLU  83           HA       GLU  83  -5.202 -15.534   4.930
  646   1HB   GLU  83          1HB       GLU  83  -6.836 -14.277   3.528
  647   2HB   GLU  83          2HB       GLU  83  -5.857 -14.598   2.099
  648   1HG   GLU  83          1HG       GLU  83  -6.954 -16.873   3.773
  649   2HG   GLU  83          2HG       GLU  83  -7.887 -16.087   2.479
  650    H    GLU  84           H        GLU  84  -3.868 -14.760   1.711
  651    HA   GLU  84           HA       GLU  84  -2.868 -17.464   1.442
  652   1HB   GLU  84          1HB       GLU  84  -2.319 -16.559  -0.867
  653   2HB   GLU  84          2HB       GLU  84  -4.029 -16.376  -0.348
  654   1HG   GLU  84          1HG       GLU  84  -3.270 -14.135   0.661
  655   2HG   GLU  84          2HG       GLU  84  -1.841 -14.280  -0.333
  656    H    VAL  85           H        VAL  85  -1.468 -16.500   3.412
  657    HA   VAL  85           HA       VAL  85   0.692 -15.455   3.952
  658    HB   VAL  85           HB       VAL  85   2.062 -17.571   4.413
  659   1HG1  VAL  85          1HG1      VAL  85  -0.917 -17.917   5.202
  660   2HG1  VAL  85          2HG1      VAL  85   0.460 -18.784   5.928
  661   3HG1  VAL  85          3HG1      VAL  85   0.323 -17.048   6.138
  662   1HG2  VAL  85          1HG2      VAL  85   1.445 -18.932   2.365
  663   2HG2  VAL  85          2HG2      VAL  85   1.181 -19.828   3.865
  664   3HG2  VAL  85          3HG2      VAL  85  -0.208 -19.132   2.992
  Start of MODEL   16
    1   1H    VAL   2          1H        VAL   2 -16.153   6.422  -2.425
    2   2H    VAL   2          2H        VAL   2 -16.979   5.133  -3.122
    3   3H    VAL   2          3H        VAL   2 -17.757   6.607  -2.895
    4    HA   VAL   2           HA       VAL   2 -17.597   6.392  -0.536
    5    HB   VAL   2           HB       VAL   2 -19.113   4.430  -0.272
    6   1HG1  VAL   2          1HG2      VAL   2 -19.665   6.230  -2.662
    7   2HG1  VAL   2          2HG2      VAL   2 -20.889   5.278  -1.786
    8   3HG1  VAL   2          3HG2      VAL   2 -20.023   6.596  -0.958
    9   1HG2  VAL   2          1HG1      VAL   2 -18.051   2.936  -1.917
   10   2HG2  VAL   2          2HG1      VAL   2 -19.784   3.153  -2.271
   11   3HG2  VAL   2          3HG1      VAL   2 -18.561   4.008  -3.240
   12    H    GLN   3           H        GLN   3 -16.620   5.459   1.255
   13    HA   GLN   3           HA       GLN   3 -14.544   3.440   0.580
   14   1HB   GLN   3          1HB       GLN   3 -13.906   5.808   1.503
   15   2HB   GLN   3          2HB       GLN   3 -14.655   5.246   3.012
   16   1HG   GLN   3          1HG       GLN   3 -13.087   3.157   2.665
   17   2HG   GLN   3          2HG       GLN   3 -12.125   4.275   1.684
   18   1HE2  GLN   3          2HE2      GLN   3 -12.389   6.708   3.047
   19   2HE2  GLN   3          1HE2      GLN   3 -11.772   6.510   4.680
   20    H    GLN   4           H        GLN   4 -14.445   1.561   1.632
   21    HA   GLN   4           HA       GLN   4 -15.690   1.204   4.277
   22   1HB   GLN   4          1HB       GLN   4 -16.380  -0.357   1.771
   23   2HB   GLN   4          2HB       GLN   4 -16.480  -1.107   3.381
   24   1HG   GLN   4          1HG       GLN   4 -17.933   1.442   2.577
   25   2HG   GLN   4          2HG       GLN   4 -18.665  -0.175   2.683
   26   1HE2  GLN   4          2HE2      GLN   4 -17.399   2.552   4.496
   27   2HE2  GLN   4          1HE2      GLN   4 -17.952   1.998   6.080
   28    H    LYS   5           H        LYS   5 -14.610  -0.813   5.340
   29    HA   LYS   5           HA       LYS   5 -12.387  -1.926   3.833
   30   1HB   LYS   5          1HB       LYS   5 -10.867  -1.167   5.843
   31   2HB   LYS   5          2HB       LYS   5 -11.163  -0.131   4.445
   32   1HG   LYS   5          1HG       LYS   5 -11.359   1.265   6.385
   33   2HG   LYS   5          2HG       LYS   5 -12.961   1.054   5.658
   34   1HD   LYS   5          1HD       LYS   5 -13.421  -0.753   7.374
   35   2HD   LYS   5          2HD       LYS   5 -11.839  -0.370   8.102
   36   1HE   LYS   5          1HE       LYS   5 -12.504   1.992   8.367
   37   2HE   LYS   5          2HE       LYS   5 -14.152   1.568   7.847
   38   1HZ   LYS   5          1HZ       LYS   5 -12.715   0.438  10.153
   39   2HZ   LYS   5          2HZ       LYS   5 -13.907   1.574  10.232
   40   3HZ   LYS   5          3HZ       LYS   5 -14.252   0.049   9.705
   41    H    VAL   6           H        VAL   6 -11.643  -3.811   4.682
   42    HA   VAL   6           HA       VAL   6 -13.048  -4.822   7.121
   43    HB   VAL   6           HB       VAL   6 -13.050  -7.065   6.014
   44   1HG1  VAL   6          1HG2      VAL   6 -15.052  -5.579   5.977
   45   2HG1  VAL   6          2HG2      VAL   6 -14.497  -4.910   4.423
   46   3HG1  VAL   6          3HG2      VAL   6 -14.952  -6.626   4.542
   47   1HG2  VAL   6          1HG1      VAL   6 -12.244  -5.445   3.560
   48   2HG2  VAL   6          2HG1      VAL   6 -11.258  -6.676   4.379
   49   3HG2  VAL   6          3HG1      VAL   6 -12.756  -7.154   3.542
   50    H    GLU   7           H        GLU   7 -11.554  -5.405   8.703
   51    HA   GLU   7           HA       GLU   7  -8.745  -5.258   7.900
   52   1HB   GLU   7          1HB       GLU   7  -9.950  -5.883  10.646
   53   2HB   GLU   7          2HB       GLU   7  -8.292  -5.376  10.297
   54   1HG   GLU   7          1HG       GLU   7  -9.342  -3.485  11.206
   55   2HG   GLU   7          2HG       GLU   7  -9.261  -3.148   9.479
   56    H    VAL   8           H        VAL   8  -7.139  -6.709   8.435
   57    HA   VAL   8           HA       VAL   8  -7.735  -9.475   9.139
   58    HB   VAL   8           HB       VAL   8  -6.551 -10.211   6.891
   59   1HG1  VAL   8          1HG1      VAL   8  -9.364  -9.107   6.946
   60   2HG1  VAL   8          2HG1      VAL   8  -8.689 -10.268   5.757
   61   3HG1  VAL   8          3HG1      VAL   8  -8.835 -10.731   7.466
   62   1HG2  VAL   8          1HG2      VAL   8  -7.633  -7.423   6.231
   63   2HG2  VAL   8          2HG2      VAL   8  -5.925  -7.920   6.148
   64   3HG2  VAL   8          3HG2      VAL   8  -7.108  -8.631   5.021
   65    H    ARG   9           H        ARG   9  -5.563 -10.703   9.037
   66    HA   ARG   9           HA       ARG   9  -3.501  -8.839  10.093
   67   1HB   ARG   9          1HB       ARG   9  -3.612 -10.935  11.310
   68   2HB   ARG   9          2HB       ARG   9  -3.542 -11.851   9.771
   69   1HG   ARG   9          1HG       ARG   9  -1.235 -10.633   9.473
   70   2HG   ARG   9          2HG       ARG   9  -1.345 -10.444  11.241
   71   1HD   ARG   9          1HD       ARG   9  -0.179 -12.547  10.513
   72   2HD   ARG   9          2HD       ARG   9  -1.632 -12.877  11.482
   73    HE   ARG   9           HE       ARG   9  -2.597 -12.929   8.922
   74   1HH1  ARG   9          1HH2      ARG   9   0.153 -14.552  10.447
   75   2HH1  ARG   9          2HH2      ARG   9   0.059 -15.952   9.410
   76   1HH2  ARG   9          2HH1      ARG   9  -2.747 -14.779   7.596
   77   2HH2  ARG   9          1HH1      ARG   9  -1.523 -16.001   7.660
   78    H    LEU  10           H        LEU  10  -2.211  -7.915   8.824
   79    HA   LEU  10           HA       LEU  10  -2.053  -8.207   6.018
   80   1HB   LEU  10          1HB       LEU  10  -1.744  -6.166   7.355
   81   2HB   LEU  10          2HB       LEU  10  -0.368  -6.900   8.195
   82    HG   LEU  10           HG       LEU  10   0.908  -6.962   6.111
   83   1HD1  LEU  10          1HD1      LEU  10  -1.524  -5.487   4.997
   84   2HD1  LEU  10          2HD1      LEU  10   0.031  -5.712   4.151
   85   3HD1  LEU  10          3HD1      LEU  10  -0.993  -7.122   4.530
   86   1HD2  LEU  10          1HD2      LEU  10   0.834  -5.117   7.817
   87   2HD2  LEU  10          2HD2      LEU  10   1.334  -4.586   6.195
   88   3HD2  LEU  10          3HD2      LEU  10  -0.324  -4.247   6.776
   89    H    LYS  11           H        LYS  11  -1.654 -10.681   6.278
   90    HA   LYS  11           HA       LYS  11   0.957 -11.588   7.125
   91   1HB   LYS  11          1HB       LYS  11  -0.719 -13.086   7.509
   92   2HB   LYS  11          2HB       LYS  11  -1.590 -12.780   6.006
   93   1HG   LYS  11          1HG       LYS  11   1.160 -14.096   6.108
   94   2HG   LYS  11          2HG       LYS  11  -0.371 -14.997   6.197
   95   1HD   LYS  11          1HD       LYS  11   0.672 -13.304   3.894
   96   2HD   LYS  11          2HD       LYS  11   0.214 -15.022   3.878
   97   1HE   LYS  11          1HE       LYS  11  -2.160 -14.359   4.331
   98   2HE   LYS  11          2HE       LYS  11  -1.621 -12.655   4.367
   99   1HZ   LYS  11          1HZ       LYS  11  -0.897 -12.898   2.116
  100   2HZ   LYS  11          2HZ       LYS  11  -1.560 -14.407   2.030
  101   3HZ   LYS  11          3HZ       LYS  11  -2.518 -13.097   2.288
  102    H    THR  12           H        THR  12  -0.413 -10.393   4.112
  103    HA   THR  12           HA       THR  12   1.607 -11.373   2.329
  104    HB   THR  12           HB       THR  12   1.001  -9.172   1.120
  105    HG1  THR  12           HG1      THR  12  -0.782  -8.084   1.989
  106   1HG2  THR  12          1HG2      THR  12  -1.343 -10.957   1.939
  107   2HG2  THR  12          2HG2      THR  12  -1.168 -10.042   0.415
  108   3HG2  THR  12          3HG2      THR  12  -0.104 -11.424   0.755
  109    H    GLY  13           H        GLY  13   1.192  -8.523   4.415
  110   1HA   GLY  13          1HA       GLY  13   2.526  -6.889   5.222
  111   2HA   GLY  13          2HA       GLY  13   3.803  -8.103   5.369
  112    H    LEU  14           H        LEU  14   2.298  -7.197   2.400
  113    HA   LEU  14           HA       LEU  14   3.172  -6.369   0.371
  114   1HB   LEU  14          1HB       LEU  14   3.235  -4.324   2.533
  115   2HB   LEU  14          2HB       LEU  14   3.591  -3.840   0.886
  116    HG   LEU  14           HG       LEU  14   1.198  -3.512   1.611
  117   1HD1  LEU  14          1HD2      LEU  14   1.599  -5.346  -0.752
  118   2HD1  LEU  14          2HD2      LEU  14   0.154  -4.354  -0.437
  119   3HD1  LEU  14          3HD2      LEU  14   1.717  -3.571  -0.739
  120   1HD2  LEU  14          1HD1      LEU  14   0.883  -5.605   2.903
  121   2HD2  LEU  14          2HD1      LEU  14  -0.358  -5.380   1.646
  122   3HD2  LEU  14          3HD1      LEU  14   0.975  -6.533   1.384
  123    H    GLN  15           H        GLN  15   5.167  -7.944   0.916
  124    HA   GLN  15           HA       GLN  15   7.640  -6.358   1.327
  125   1HB   GLN  15          1HB       GLN  15   7.099  -9.340   1.156
  126   2HB   GLN  15          2HB       GLN  15   8.701  -8.624   1.460
  127   1HG   GLN  15          1HG       GLN  15   7.997  -7.702   3.546
  128   2HG   GLN  15          2HG       GLN  15   6.282  -7.903   3.150
  129   1HE2  GLN  15          1HE2      GLN  15   5.229  -9.833   3.600
  130   2HE2  GLN  15          2HE2      GLN  15   6.017 -11.249   4.230
  131    H    ALA  16           H        ALA  16   5.959  -8.405  -1.075
  132    HA   ALA  16           HA       ALA  16   6.958  -6.787  -3.228
  133   1HB   ALA  16          1HB       ALA  16   9.062  -7.948  -2.690
  134   2HB   ALA  16          2HB       ALA  16   8.262  -9.519  -2.948
  135   3HB   ALA  16          3HB       ALA  16   8.458  -8.383  -4.307
  136    H    ARG  17           H        ARG  17   6.055 -10.198  -2.575
  137    HA   ARG  17           HA       ARG  17   4.866 -10.373  -5.247
  138   1HB   ARG  17          1HB       ARG  17   4.777 -12.474  -3.062
  139   2HB   ARG  17          2HB       ARG  17   4.546 -12.703  -4.807
  140   1HG   ARG  17          1HG       ARG  17   6.782 -13.108  -4.966
  141   2HG   ARG  17          2HG       ARG  17   7.050 -11.408  -4.510
  142   1HD   ARG  17          1HD       ARG  17   6.870 -12.080  -2.096
  143   2HD   ARG  17          2HD       ARG  17   6.786 -13.775  -2.606
  144    HE   ARG  17           HE       ARG  17   9.043 -13.569  -3.521
  145   1HH1  ARG  17          2HH1      ARG  17   7.943 -10.978  -1.367
  146   2HH1  ARG  17          1HH1      ARG  17   9.553 -10.400  -1.015
  147   1HH2  ARG  17          1HH2      ARG  17  11.154 -12.866  -3.008
  148   2HH2  ARG  17          2HH2      ARG  17  11.411 -11.523  -1.929
  149    HA   PRO  18           HA       PRO  18   0.725 -10.905  -2.929
  150   1HB   PRO  18          1HB       PRO  18   0.671 -10.686  -0.206
  151   2HB   PRO  18          2HB       PRO  18   0.986 -12.259  -1.017
  152   1HG   PRO  18          1HG       PRO  18   3.057 -10.239  -0.039
  153   2HG   PRO  18          2HG       PRO  18   2.947 -11.970   0.380
  154   1HD   PRO  18          1HD       PRO  18   4.568 -11.165  -1.615
  155   2HD   PRO  18          2HD       PRO  18   3.529 -12.601  -1.889
  156    H    ALA  19           H        ALA  19   3.231  -8.816  -1.536
  157    HA   ALA  19           HA       ALA  19   1.734  -6.528  -0.888
  158   1HB   ALA  19          1HB       ALA  19   4.209  -6.943  -0.691
  159   2HB   ALA  19          2HB       ALA  19   4.279  -6.826  -2.480
  160   3HB   ALA  19          3HB       ALA  19   3.812  -5.391  -1.512
  161    H    ALA  20           H        ALA  20   3.220  -7.518  -3.996
  162    HA   ALA  20           HA       ALA  20   2.239  -5.327  -5.548
  163   1HB   ALA  20          1HB       ALA  20   3.168  -8.118  -6.334
  164   2HB   ALA  20          2HB       ALA  20   2.967  -6.748  -7.454
  165   3HB   ALA  20          3HB       ALA  20   4.203  -6.686  -6.169
  166    H    LEU  21           H        LEU  21   1.100  -8.659  -4.953
  167    HA   LEU  21           HA       LEU  21  -1.069  -8.496  -6.821
  168   1HB   LEU  21          1HB       LEU  21  -0.133 -10.578  -5.801
  169   2HB   LEU  21          2HB       LEU  21  -1.055 -10.228  -4.326
  170    HG   LEU  21           HG       LEU  21  -2.326 -10.332  -7.100
  171   1HD1  LEU  21          1HD1      LEU  21  -1.927 -12.616  -5.132
  172   2HD1  LEU  21          2HD1      LEU  21  -2.916 -12.683  -6.612
  173   3HD1  LEU  21          3HD1      LEU  21  -1.155 -12.453  -6.725
  174   1HD2  LEU  21          1HD2      LEU  21  -3.671  -9.323  -5.272
  175   2HD2  LEU  21          2HD2      LEU  21  -4.374 -10.865  -5.813
  176   3HD2  LEU  21          3HD2      LEU  21  -3.443 -10.796  -4.299
  177    H    PHE  22           H        PHE  22  -0.914  -7.824  -3.350
  178    HA   PHE  22           HA       PHE  22  -3.502  -7.010  -2.701
  179   1HB   PHE  22          1HB       PHE  22  -1.743  -7.318  -1.165
  180   2HB   PHE  22          2HB       PHE  22  -0.696  -6.137  -1.943
  181    HD1  PHE  22           HD1      PHE  22  -2.643  -6.626   0.904
  182    HD2  PHE  22           HD2      PHE  22  -1.589  -3.623  -1.984
  183    HE1  PHE  22           HE1      PHE  22  -2.985  -4.864   2.615
  184    HE2  PHE  22           HE2      PHE  22  -1.918  -1.871  -0.309
  185    HZ   PHE  22           HZ       PHE  22  -2.650  -2.469   2.013
  186    H    VAL  23           H        VAL  23  -0.754  -4.864  -3.530
  187    HA   VAL  23           HA       VAL  23  -2.305  -2.519  -3.812
  188    HB   VAL  23           HB       VAL  23   0.385  -3.389  -4.911
  189   1HG1  VAL  23          1HG2      VAL  23  -0.835  -0.599  -4.897
  190   2HG1  VAL  23          2HG2      VAL  23   0.837  -1.002  -5.344
  191   3HG1  VAL  23          3HG2      VAL  23  -0.511  -1.576  -6.350
  192   1HG2  VAL  23          1HG1      VAL  23   0.122  -3.153  -2.423
  193   2HG2  VAL  23          2HG1      VAL  23   1.221  -1.926  -3.099
  194   3HG2  VAL  23          3HG1      VAL  23  -0.442  -1.484  -2.669
  195    H    GLN  24           H        GLN  24  -1.452  -5.042  -6.220
  196    HA   GLN  24           HA       GLN  24  -2.453  -3.417  -8.371
  197   1HB   GLN  24          1HB       GLN  24  -1.997  -5.147  -9.844
  198   2HB   GLN  24          2HB       GLN  24  -0.664  -4.972  -8.697
  199   1HG   GLN  24          1HG       GLN  24  -0.861  -7.263  -9.042
  200   2HG   GLN  24          2HG       GLN  24  -1.643  -6.999  -7.470
  201   1HE2  GLN  24          1HE2      GLN  24  -3.671  -7.862  -7.254
  202   2HE2  GLN  24          2HE2      GLN  24  -4.754  -8.172  -8.604
  203    H    GLU  25           H        GLU  25  -4.048  -5.944  -6.365
  204    HA   GLU  25           HA       GLU  25  -6.366  -5.659  -8.186
  205   1HB   GLU  25          1HB       GLU  25  -7.526  -7.063  -6.384
  206   2HB   GLU  25          2HB       GLU  25  -6.171  -7.873  -7.185
  207   1HG   GLU  25          1HG       GLU  25  -4.716  -7.481  -5.297
  208   2HG   GLU  25          2HG       GLU  25  -5.885  -6.373  -4.559
  209    H    ALA  26           H        ALA  26  -5.321  -4.405  -5.010
  210    HA   ALA  26           HA       ALA  26  -7.649  -2.964  -4.309
  211   1HB   ALA  26          1HB       ALA  26  -4.712  -2.128  -4.264
  212   2HB   ALA  26          2HB       ALA  26  -6.017  -1.353  -3.334
  213   3HB   ALA  26          3HB       ALA  26  -5.543  -3.037  -2.976
  214    H    ASN  27           H        ASN  27  -5.038  -2.273  -6.590
  215    HA   ASN  27           HA       ASN  27  -5.910   0.291  -7.565
  216   1HB   ASN  27          1HB       ASN  27  -3.945  -1.860  -8.149
  217   2HB   ASN  27          2HB       ASN  27  -4.469  -0.964  -9.569
  218   1HD2  ASN  27          2HD2      ASN  27  -2.376  -0.936  -6.919
  219   2HD2  ASN  27          1HD2      ASN  27  -1.875   0.749  -6.887
  220    H    ARG  28           H        ARG  28  -6.465  -3.019  -8.458
  221    HA   ARG  28           HA       ARG  28  -7.387  -2.797 -11.165
  222   1HB   ARG  28          1HB       ARG  28  -7.575  -4.616  -8.761
  223   2HB   ARG  28          2HB       ARG  28  -8.475  -5.057 -10.190
  224   1HG   ARG  28          1HG       ARG  28  -6.437  -5.015 -11.561
  225   2HG   ARG  28          2HG       ARG  28  -5.526  -4.314 -10.221
  226   1HD   ARG  28          1HD       ARG  28  -5.018  -6.701 -10.637
  227   2HD   ARG  28          2HD       ARG  28  -5.544  -6.349  -8.992
  228    HE   ARG  28           HE       ARG  28  -7.886  -7.093  -9.967
  229   1HH1  ARG  28          1HH2      ARG  28  -4.709  -8.457 -10.769
  230   2HH1  ARG  28          2HH2      ARG  28  -5.322 -10.060 -11.052
  231   1HH2  ARG  28          2HH1      ARG  28  -8.694  -9.198 -10.351
  232   2HH2  ARG  28          1HH1      ARG  28  -7.621 -10.482 -10.833
  233    H    PHE  29           H        PHE  29  -8.818  -3.084  -8.025
  234    HA   PHE  29           HA       PHE  29 -11.518  -2.407  -8.488
  235   1HB   PHE  29          1HB       PHE  29  -9.455  -2.456  -6.307
  236   2HB   PHE  29          2HB       PHE  29 -10.980  -1.705  -5.960
  237    HD1  PHE  29           HD1      PHE  29  -9.300  -4.691  -5.664
  238    HD2  PHE  29           HD2      PHE  29 -12.879  -3.294  -7.554
  239    HE1  PHE  29           HE1      PHE  29 -10.160  -7.025  -5.744
  240    HE2  PHE  29           HE2      PHE  29 -13.714  -5.619  -7.720
  241    HZ   PHE  29           HZ       PHE  29 -12.387  -7.486  -6.782
  242    H    THR  30           H        THR  30 -12.338  -0.616  -9.097
  243    HA   THR  30           HA       THR  30 -10.726   1.786  -9.574
  244    HB   THR  30           HB       THR  30 -13.659   1.119 -10.027
  245    HG1  THR  30           HG1      THR  30 -11.912  -0.037 -11.192
  246   1HG2  THR  30          1HG2      THR  30 -12.015   3.402 -11.180
  247   2HG2  THR  30          2HG2      THR  30 -13.735   3.036 -11.497
  248   3HG2  THR  30          3HG2      THR  30 -13.214   3.549  -9.870
  249    H    SER  31           H        SER  31 -10.529   1.478  -6.981
  250    HA   SER  31           HA       SER  31 -12.338   3.413  -5.661
  251   1HB   SER  31          1HB       SER  31 -11.185   0.796  -4.618
  252   2HB   SER  31          2HB       SER  31 -12.329   1.851  -3.763
  253    HG   SER  31           HG       SER  31 -13.166  -0.097  -4.934
  254    H    ASP  32           H        ASP  32 -11.461   4.592  -4.003
  255    HA   ASP  32           HA       ASP  32  -8.586   4.977  -3.904
  256   1HB   ASP  32          1HB       ASP  32 -10.860   5.746  -2.044
  257   2HB   ASP  32          2HB       ASP  32  -9.215   6.406  -1.926
  258    H    VAL  33           H        VAL  33  -8.095   2.652  -3.625
  259    HA   VAL  33           HA       VAL  33  -9.097   1.233  -1.343
  260    HB   VAL  33           HB       VAL  33  -6.776   0.659  -3.216
  261   1HG1  VAL  33          1HG1      VAL  33  -6.684  -0.560  -1.008
  262   2HG1  VAL  33          2HG1      VAL  33  -8.316  -1.194  -1.335
  263   3HG1  VAL  33          3HG1      VAL  33  -6.959  -1.643  -2.395
  264   1HG2  VAL  33          1HG2      VAL  33  -9.026   0.967  -4.202
  265   2HG2  VAL  33          2HG2      VAL  33  -8.533  -0.743  -4.285
  266   3HG2  VAL  33          3HG2      VAL  33  -9.696  -0.197  -3.036
  267    H    PHE  34           H        PHE  34  -8.223   0.762   0.570
  268    HA   PHE  34           HA       PHE  34  -5.825   2.327   1.334
  269   1HB   PHE  34          1HB       PHE  34  -8.355   2.314   3.008
  270   2HB   PHE  34          2HB       PHE  34  -6.852   3.186   3.306
  271    HD1  PHE  34           HD1      PHE  34  -9.912   4.101   2.957
  272    HD2  PHE  34           HD2      PHE  34  -6.371   4.277   0.517
  273    HE1  PHE  34           HE1      PHE  34 -10.817   6.098   1.781
  274    HE2  PHE  34           HE2      PHE  34  -7.204   6.341  -0.562
  275    HZ   PHE  34           HZ       PHE  34  -9.481   7.217   0.023
  276    H    LEU  35           H        LEU  35  -5.056   1.770   3.540
  277    HA   LEU  35           HA       LEU  35  -5.873  -0.891   4.527
  278   1HB   LEU  35          1HB       LEU  35  -3.799  -1.224   3.086
  279   2HB   LEU  35          2HB       LEU  35  -2.945  -0.112   4.199
  280    HG   LEU  35           HG       LEU  35  -3.545  -1.596   6.102
  281   1HD1  LEU  35          1HD2      LEU  35  -5.611  -2.562   5.102
  282   2HD1  LEU  35          2HD2      LEU  35  -4.610  -3.426   3.909
  283   3HD1  LEU  35          3HD2      LEU  35  -4.482  -3.833   5.633
  284   1HD2  LEU  35          1HD1      LEU  35  -1.387  -1.951   4.916
  285   2HD2  LEU  35          2HD1      LEU  35  -2.062  -3.472   5.541
  286   3HD2  LEU  35          3HD1      LEU  35  -2.194  -3.086   3.812
  287    H    GLU  36           H        GLU  36  -6.195  -0.638   6.693
  288    HA   GLU  36           HA       GLU  36  -5.079   1.856   7.935
  289   1HB   GLU  36          1HB       GLU  36  -7.507   0.302   8.869
  290   2HB   GLU  36          2HB       GLU  36  -7.007   1.958   9.308
  291   1HG   GLU  36          1HG       GLU  36  -7.485   2.744   7.066
  292   2HG   GLU  36          2HG       GLU  36  -7.863   1.136   6.501
  293    H    LYS  37           H        LYS  37  -3.208   1.070   8.971
  294    HA   LYS  37           HA       LYS  37  -3.149  -1.509  10.333
  295   1HB   LYS  37          1HB       LYS  37  -1.322   0.933  10.315
  296   2HB   LYS  37          2HB       LYS  37  -1.066  -0.461  11.373
  297   1HG   LYS  37          1HG       LYS  37  -0.972  -1.993   9.504
  298   2HG   LYS  37          2HG       LYS  37  -1.145  -0.620   8.394
  299   1HD   LYS  37          1HD       LYS  37   1.274  -1.294   8.783
  300   2HD   LYS  37          2HD       LYS  37   0.934   0.376   9.310
  301   1HE   LYS  37          1HE       LYS  37   0.511  -0.512  11.636
  302   2HE   LYS  37          2HE       LYS  37   1.052  -2.109  11.083
  303   1HZ   LYS  37          1HZ       LYS  37   2.673   0.344  11.015
  304   2HZ   LYS  37          2HZ       LYS  37   2.801  -0.864  12.132
  305   3HZ   LYS  37          3HZ       LYS  37   3.152  -1.162  10.546
  306    H    ASP  38           H        ASP  38  -5.111  -1.275  11.544
  307    HA   ASP  38           HA       ASP  38  -6.287  -0.868  13.509
  308   1HB   ASP  38          1HB       ASP  38  -3.509  -0.124  14.464
  309   2HB   ASP  38          2HB       ASP  38  -4.920  -0.311  15.528
  310    H    GLY  39           H        GLY  39  -5.955   1.249  11.480
  311   1HA   GLY  39          1HA       GLY  39  -7.177   3.439  11.918
  312   2HA   GLY  39          2HA       GLY  39  -6.037   3.623  13.277
  313    H    LYS  40           H        LYS  40  -3.767   2.403  11.620
  314    HA   LYS  40           HA       LYS  40  -2.849   4.886  10.432
  315   1HB   LYS  40          1HB       LYS  40  -1.702   2.070  10.289
  316   2HB   LYS  40          2HB       LYS  40  -0.841   3.592   9.976
  317   1HG   LYS  40          1HG       LYS  40  -1.379   4.227  12.401
  318   2HG   LYS  40          2HG       LYS  40  -1.908   2.533  12.627
  319   1HD   LYS  40          1HD       LYS  40   0.491   2.885  13.272
  320   2HD   LYS  40          2HD       LYS  40   0.309   1.733  11.931
  321   1HE   LYS  40          1HE       LYS  40   0.858   3.471  10.299
  322   2HE   LYS  40          2HE       LYS  40   0.904   4.704  11.572
  323   1HZ   LYS  40          1HZ       LYS  40   2.755   3.528  12.545
  324   2HZ   LYS  40          2HZ       LYS  40   2.720   2.405  11.339
  325   3HZ   LYS  40          3HZ       LYS  40   3.095   3.974  10.999
  326    H    LYS  41           H        LYS  41  -4.825   4.940   8.983
  327    HA   LYS  41           HA       LYS  41  -4.749   3.023   6.765
  328   1HB   LYS  41          1HB       LYS  41  -6.865   3.336   7.606
  329   2HB   LYS  41          2HB       LYS  41  -6.646   5.061   7.816
  330   1HG   LYS  41          1HG       LYS  41  -6.608   3.939   5.029
  331   2HG   LYS  41          2HG       LYS  41  -8.169   4.148   5.833
  332   1HD   LYS  41          1HD       LYS  41  -7.844   6.459   6.273
  333   2HD   LYS  41          2HD       LYS  41  -6.124   6.406   5.852
  334   1HE   LYS  41          1HE       LYS  41  -8.285   5.829   3.781
  335   2HE   LYS  41          2HE       LYS  41  -7.723   7.473   4.157
  336   1HZ   LYS  41          1HZ       LYS  41  -5.504   6.784   3.656
  337   2HZ   LYS  41          2HZ       LYS  41  -6.033   5.273   3.251
  338   3HZ   LYS  41          3HZ       LYS  41  -6.504   6.576   2.361
  339    H    VAL  42           H        VAL  42  -4.230   3.267   4.868
  340    HA   VAL  42           HA       VAL  42  -3.483   5.883   3.637
  341    HB   VAL  42           HB       VAL  42  -1.311   4.852   2.997
  342   1HG1  VAL  42          1HG2      VAL  42  -1.567   6.045   5.217
  343   2HG1  VAL  42          2HG2      VAL  42  -1.916   4.461   5.952
  344   3HG1  VAL  42          3HG2      VAL  42  -0.308   4.769   5.252
  345   1HG2  VAL  42          1HG1      VAL  42  -2.301   2.508   4.688
  346   2HG2  VAL  42          2HG1      VAL  42  -2.130   2.507   2.918
  347   3HG2  VAL  42          3HG1      VAL  42  -0.684   2.645   3.950
  348    H    ASN  43           H        ASN  43  -2.816   5.508   1.238
  349    HA   ASN  43           HA       ASN  43  -4.854   3.963  -0.079
  350   1HB   ASN  43          1HB       ASN  43  -2.249   5.240  -1.011
  351   2HB   ASN  43          2HB       ASN  43  -3.382   4.408  -2.089
  352   1HD2  ASN  43          2HD2      ASN  43  -3.034   6.550  -3.086
  353   2HD2  ASN  43          1HD2      ASN  43  -4.173   7.839  -2.640
  354    H    ALA  44           H        ALA  44  -4.880   2.031   0.270
  355    HA   ALA  44           HA       ALA  44  -2.947   0.069   0.705
  356   1HB   ALA  44          1HB       ALA  44  -5.574  -0.025  -0.854
  357   2HB   ALA  44          2HB       ALA  44  -4.729  -1.475  -0.271
  358   3HB   ALA  44          3HB       ALA  44  -5.404  -0.296   0.888
  359    H    LYS  45           H        LYS  45  -4.344   1.292  -2.307
  360    HA   LYS  45           HA       LYS  45  -2.726  -0.492  -3.983
  361   1HB   LYS  45          1HB       LYS  45  -3.790   0.754  -5.845
  362   2HB   LYS  45          2HB       LYS  45  -4.959   0.007  -4.736
  363   1HG   LYS  45          1HG       LYS  45  -5.538   2.105  -3.754
  364   2HG   LYS  45          2HG       LYS  45  -4.058   2.872  -4.373
  365   1HD   LYS  45          1HD       LYS  45  -5.950   3.588  -5.762
  366   2HD   LYS  45          2HD       LYS  45  -4.838   2.554  -6.693
  367   1HE   LYS  45          1HE       LYS  45  -6.352   0.602  -6.218
  368   2HE   LYS  45          2HE       LYS  45  -7.491   1.706  -5.421
  369   1HZ   LYS  45          1HZ       LYS  45  -6.650   1.875  -8.226
  370   2HZ   LYS  45          2HZ       LYS  45  -8.088   1.297  -7.668
  371   3HZ   LYS  45          3HZ       LYS  45  -7.711   2.886  -7.458
  372    H    SER  46           H        SER  46  -2.030   2.344  -2.325
  373    HA   SER  46           HA       SER  46  -0.055   3.208  -4.353
  374   1HB   SER  46          1HB       SER  46  -1.089   4.691  -1.904
  375   2HB   SER  46          2HB       SER  46   0.012   5.338  -3.136
  376    HG   SER  46           HG       SER  46  -1.795   4.844  -4.652
  377    H    ILE  47           H        ILE  47   1.974   4.099  -3.287
  378    HA   ILE  47           HA       ILE  47   3.508   2.173  -2.056
  379    HB   ILE  47           HB       ILE  47   4.404   4.232  -3.093
  380   1HG1  ILE  47          1HG1      ILE  47   5.151   2.886  -0.723
  381   2HG1  ILE  47          2HG1      ILE  47   6.284   3.698  -1.778
  382   1HG2  ILE  47          1HG2      ILE  47   2.609   5.746  -2.126
  383   2HG2  ILE  47          2HG2      ILE  47   3.384   5.587  -0.551
  384   3HG2  ILE  47          3HG2      ILE  47   4.245   6.410  -1.868
  385   1HD1  ILE  47          1HD1      ILE  47   4.728   4.982   0.512
  386   2HD1  ILE  47          2HD1      ILE  47   6.433   4.485   0.578
  387   3HD1  ILE  47          3HD1      ILE  47   5.937   5.813  -0.500
  388    H    MET  48           H        MET  48   1.758   4.836  -0.411
  389    HA   MET  48           HA       MET  48   2.916   4.143   2.084
  390   1HB   MET  48          1HB       MET  48   2.125   6.394   1.554
  391   2HB   MET  48          2HB       MET  48   0.476   5.809   1.328
  392   1HG   MET  48          1HG       MET  48   0.486   5.131   3.771
  393   2HG   MET  48          2HG       MET  48   2.106   5.833   3.915
  394   1HE   MET  48          1HE       MET  48   2.598   8.332   3.227
  395   2HE   MET  48          2HE       MET  48   1.493   8.401   1.833
  396   3HE   MET  48          3HE       MET  48   1.370   9.619   3.126
  397    H    GLY  49           H        GLY  49   0.227   2.760   0.351
  398   1HA   GLY  49          1HA       GLY  49  -0.713   1.341   2.728
  399   2HA   GLY  49          2HA       GLY  49  -1.188   1.034   1.016
  400    H    LEU  50           H        LEU  50   0.706   0.229  -0.431
  401    HA   LEU  50           HA       LEU  50   1.615  -2.249   0.300
  402   1HB   LEU  50          1HB       LEU  50   1.617  -1.439  -1.955
  403   2HB   LEU  50          2HB       LEU  50   2.684  -0.093  -1.521
  404    HG   LEU  50           HG       LEU  50   4.562  -1.581  -1.172
  405   1HD1  LEU  50          1HD2      LEU  50   2.681  -3.827  -2.035
  406   2HD1  LEU  50          2HD2      LEU  50   4.437  -3.972  -1.791
  407   3HD1  LEU  50          3HD2      LEU  50   3.371  -3.613  -0.417
  408   1HD2  LEU  50          1HD1      LEU  50   3.060  -2.022  -3.784
  409   2HD2  LEU  50          2HD1      LEU  50   4.124  -0.652  -3.406
  410   3HD2  LEU  50          3HD1      LEU  50   4.806  -2.290  -3.558
  411    H    MET  51           H        MET  51   3.844   0.605   0.219
  412    HA   MET  51           HA       MET  51   5.798  -1.162   1.406
  413   1HB   MET  51          1HB       MET  51   7.396   0.484   0.592
  414   2HB   MET  51          2HB       MET  51   6.015   0.682  -0.474
  415   1HG   MET  51          1HG       MET  51   6.564   2.818   0.064
  416   2HG   MET  51          2HG       MET  51   5.275   2.506   1.230
  417   1HE   MET  51          1HE       MET  51   7.675   0.515   2.845
  418   2HE   MET  51          2HE       MET  51   8.958   1.051   1.724
  419   3HE   MET  51          3HE       MET  51   9.028   1.502   3.444
  420    H    SER  52           H        SER  52   3.795   1.632   2.380
  421    HA   SER  52           HA       SER  52   5.252   1.855   4.869
  422   1HB   SER  52          1HB       SER  52   2.607   3.172   4.217
  423   2HB   SER  52          2HB       SER  52   3.836   3.693   5.390
  424    HG   SER  52           HG       SER  52   5.265   3.876   3.497
  425    H    LEU  53           H        LEU  53   1.667   1.570   4.706
  426    HA   LEU  53           HA       LEU  53   1.633   0.507   7.394
  427   1HB   LEU  53          1HB       LEU  53  -0.483   0.914   5.310
  428   2HB   LEU  53          2HB       LEU  53  -0.795   0.174   6.896
  429    HG   LEU  53           HG       LEU  53  -1.222   2.510   7.066
  430   1HD1  LEU  53          1HD1      LEU  53  -0.154   1.429   9.003
  431   2HD1  LEU  53          2HD1      LEU  53   1.446   1.925   8.382
  432   3HD1  LEU  53          3HD1      LEU  53   0.258   3.154   8.882
  433   1HD2  LEU  53          1HD2      LEU  53   0.221   3.191   5.143
  434   2HD2  LEU  53          2HD2      LEU  53   0.454   4.233   6.581
  435   3HD2  LEU  53          3HD2      LEU  53   1.646   2.969   6.181
  436    H    ALA  54           H        ALA  54   0.705  -0.807   4.271
  437    HA   ALA  54           HA       ALA  54  -0.034  -3.424   5.017
  438   1HB   ALA  54          1HB       ALA  54  -0.795  -2.272   2.985
  439   2HB   ALA  54          2HB       ALA  54   0.872  -2.261   2.367
  440   3HB   ALA  54          3HB       ALA  54   0.015  -3.802   2.576
  441    H    VAL  55           H        VAL  55   3.187  -2.067   4.587
  442    HA   VAL  55           HA       VAL  55   4.394  -4.612   3.980
  443    HB   VAL  55           HB       VAL  55   5.299  -2.198   3.660
  444   1HG1  VAL  55          1HG2      VAL  55   5.025  -1.548   6.062
  445   2HG1  VAL  55          2HG2      VAL  55   6.257  -2.757   6.507
  446   3HG1  VAL  55          3HG2      VAL  55   6.696  -1.360   5.489
  447   1HG2  VAL  55          1HG1      VAL  55   6.516  -4.286   3.143
  448   2HG2  VAL  55          2HG1      VAL  55   7.606  -3.028   3.780
  449   3HG2  VAL  55          3HG1      VAL  55   7.079  -4.370   4.830
  450    H    SER  56           H        SER  56   2.879  -3.442   6.833
  451    HA   SER  56           HA       SER  56   4.724  -4.762   8.617
  452   1HB   SER  56          1HB       SER  56   1.914  -3.786   9.223
  453   2HB   SER  56          2HB       SER  56   3.239  -3.992  10.374
  454    HG   SER  56           HG       SER  56   3.040  -2.098   8.248
  455    H    THR  57           H        THR  57   4.470  -6.815   7.204
  456    HA   THR  57           HA       THR  57   2.534  -8.620   7.241
  457    HB   THR  57           HB       THR  57   5.246  -9.415   8.281
  458    HG1  THR  57           HG1      THR  57   5.800  -9.239   5.957
  459   1HG2  THR  57          1HG2      THR  57   3.298 -10.459   6.176
  460   2HG2  THR  57          2HG2      THR  57   4.827 -11.249   6.645
  461   3HG2  THR  57          3HG2      THR  57   3.497 -11.108   7.822
  462    H    GLY  58           H        GLY  58   1.088  -9.247   8.661
  463   1HA   GLY  58          1HA       GLY  58   0.527 -10.621  10.578
  464   2HA   GLY  58          2HA       GLY  58   1.942  -9.973  11.417
  465    H    THR  59           H        THR  59   0.700  -7.222  10.085
  466    HA   THR  59           HA       THR  59  -0.547  -6.576  12.673
  467    HB   THR  59           HB       THR  59  -0.353  -4.766  10.245
  468    HG1  THR  59           HG1      THR  59   1.721  -5.600  10.841
  469   1HG2  THR  59          1HG2      THR  59  -0.332  -2.997  11.971
  470   2HG2  THR  59          2HG2      THR  59  -1.792  -4.004  12.112
  471   3HG2  THR  59          3HG2      THR  59  -0.435  -4.240  13.239
  472    H    GLU  60           H        GLU  60  -2.731  -6.595  13.050
  473    HA   GLU  60           HA       GLU  60  -4.558  -7.361  10.931
  474   1HB   GLU  60          1HB       GLU  60  -5.243  -6.201  13.643
  475   2HB   GLU  60          2HB       GLU  60  -6.247  -7.253  12.602
  476   1HG   GLU  60          1HG       GLU  60  -3.588  -8.200  13.711
  477   2HG   GLU  60          2HG       GLU  60  -5.104  -8.369  14.613
  478    H    VAL  61           H        VAL  61  -4.535  -5.872   9.320
  479    HA   VAL  61           HA       VAL  61  -5.259  -3.076  10.056
  480    HB   VAL  61           HB       VAL  61  -3.985  -2.331   8.057
  481   1HG1  VAL  61          1HG1      VAL  61  -2.851  -2.575  10.287
  482   2HG1  VAL  61          2HG1      VAL  61  -2.423  -4.247   9.863
  483   3HG1  VAL  61          3HG1      VAL  61  -1.737  -2.898   8.928
  484   1HG2  VAL  61          1HG2      VAL  61  -4.240  -4.375   6.705
  485   2HG2  VAL  61          2HG2      VAL  61  -2.527  -3.905   6.890
  486   3HG2  VAL  61          3HG2      VAL  61  -3.188  -5.256   7.851
  487    H    THR  62           H        THR  62  -6.735  -1.981   8.725
  488    HA   THR  62           HA       THR  62  -8.732  -3.718   7.578
  489    HB   THR  62           HB       THR  62  -8.707  -0.744   7.240
  490    HG1  THR  62           HG1      THR  62  -9.375  -0.471   9.357
  491   1HG2  THR  62          1HG2      THR  62 -10.811  -2.734   8.233
  492   2HG2  THR  62          2HG2      THR  62 -11.101  -1.077   7.672
  493   3HG2  THR  62          3HG2      THR  62 -10.579  -2.307   6.521
  494    H    LEU  63           H        LEU  63  -8.812  -4.345   5.402
  495    HA   LEU  63           HA       LEU  63  -7.415  -2.548   3.503
  496   1HB   LEU  63          1HB       LEU  63  -8.295  -5.402   3.384
  497   2HB   LEU  63          2HB       LEU  63  -8.252  -4.456   1.864
  498    HG   LEU  63           HG       LEU  63  -5.990  -4.425   3.900
  499   1HD1  LEU  63          1HD1      LEU  63  -6.181  -6.009   1.312
  500   2HD1  LEU  63          2HD1      LEU  63  -4.735  -5.838   2.329
  501   3HD1  LEU  63          3HD1      LEU  63  -6.167  -6.691   2.952
  502   1HD2  LEU  63          1HD2      LEU  63  -6.198  -2.468   2.358
  503   2HD2  LEU  63          2HD2      LEU  63  -4.733  -3.425   2.020
  504   3HD2  LEU  63          3HD2      LEU  63  -6.162  -3.585   0.973
  505    H    ILE  64           H        ILE  64  -8.377  -0.989   2.864
  506    HA   ILE  64           HA       ILE  64 -11.318  -0.681   2.901
  507    HB   ILE  64           HB       ILE  64  -9.114   1.349   2.370
  508   1HG1  ILE  64          1HG1      ILE  64 -10.342   0.663   5.046
  509   2HG1  ILE  64          2HG1      ILE  64  -8.609   0.712   4.618
  510   1HG2  ILE  64          1HG2      ILE  64 -12.017   1.602   3.214
  511   2HG2  ILE  64          2HG2      ILE  64 -10.883   2.960   3.030
  512   3HG2  ILE  64          3HG2      ILE  64 -11.334   1.982   1.613
  513   1HD1  ILE  64          1HD1      ILE  64 -10.597   3.029   4.496
  514   2HD1  ILE  64          2HD1      ILE  64  -9.415   2.812   5.803
  515   3HD1  ILE  64          3HD1      ILE  64  -8.867   3.165   4.135
  516    H    ALA  65           H        ALA  65 -12.307   0.379   1.111
  517    HA   ALA  65           HA       ALA  65 -10.776   0.978  -1.234
  518   1HB   ALA  65          1HB       ALA  65 -13.095  -1.014  -1.367
  519   2HB   ALA  65          2HB       ALA  65 -12.307  -0.247  -2.769
  520   3HB   ALA  65          3HB       ALA  65 -11.395  -1.386  -1.747
  521    H    GLN  66           H        GLN  66 -11.390   2.894  -1.663
  522    HA   GLN  66           HA       GLN  66 -14.165   3.667  -0.971
  523   1HB   GLN  66          1HB       GLN  66 -12.218   4.582   0.411
  524   2HB   GLN  66          2HB       GLN  66 -11.541   5.286  -1.060
  525   1HG   GLN  66          1HG       GLN  66 -13.791   6.476  -1.320
  526   2HG   GLN  66          2HG       GLN  66 -14.147   5.878   0.316
  527   1HE2  GLN  66          2HE2      GLN  66 -11.820   7.952  -1.564
  528   2HE2  GLN  66          1HE2      GLN  66 -11.346   8.887  -0.154
  529    H    GLY  67           H        GLY  67 -14.307   2.508  -3.112
  530   1HA   GLY  67          1HA       GLY  67 -14.060   4.486  -5.343
  531   2HA   GLY  67          2HA       GLY  67 -13.367   2.881  -5.439
  532    H    GLU  68           H        GLU  68 -14.699   3.066  -7.315
  533    HA   GLU  68           HA       GLU  68 -17.467   2.657  -7.465
  534   1HB   GLU  68          1HB       GLU  68 -15.204   1.507  -9.159
  535   2HB   GLU  68          2HB       GLU  68 -16.893   1.720  -9.666
  536   1HG   GLU  68          1HG       GLU  68 -14.899   3.919  -8.964
  537   2HG   GLU  68          2HG       GLU  68 -15.558   3.541 -10.571
  538    H    ASP  69           H        ASP  69 -14.812   0.452  -6.515
  539    HA   ASP  69           HA       ASP  69 -16.779  -1.824  -6.541
  540   1HB   ASP  69          1HB       ASP  69 -13.775  -1.943  -6.478
  541   2HB   ASP  69          2HB       ASP  69 -14.907  -3.290  -6.551
  542    H    GLU  70           H        GLU  70 -16.035   0.518  -4.439
  543    HA   GLU  70           HA       GLU  70 -14.383   0.119  -2.535
  544   1HB   GLU  70          1HB       GLU  70 -16.107   1.819  -2.450
  545   2HB   GLU  70          2HB       GLU  70 -17.345   0.563  -2.428
  546   1HG   GLU  70          1HG       GLU  70 -16.142  -0.065  -0.107
  547   2HG   GLU  70          2HG       GLU  70 -15.774   1.676  -0.163
  548    H    GLN  71           H        GLN  71 -17.513  -1.282  -1.498
  549    HA   GLN  71           HA       GLN  71 -16.573  -2.962   0.423
  550   1HB   GLN  71          1HB       GLN  71 -18.926  -2.508  -0.031
  551   2HB   GLN  71          2HB       GLN  71 -18.846  -3.448  -1.538
  552   1HG   GLN  71          1HG       GLN  71 -19.922  -4.726   0.248
  553   2HG   GLN  71          2HG       GLN  71 -18.401  -5.505  -0.236
  554   1HE2  GLN  71          2HE2      GLN  71 -16.494  -5.137   1.157
  555   2HE2  GLN  71          1HE2      GLN  71 -16.765  -4.864   2.878
  556    H    GLU  72           H        GLU  72 -16.624  -3.682  -3.042
  557    HA   GLU  72           HA       GLU  72 -16.030  -6.510  -2.871
  558   1HB   GLU  72          1HB       GLU  72 -17.174  -5.693  -4.805
  559   2HB   GLU  72          2HB       GLU  72 -16.072  -4.303  -4.941
  560   1HG   GLU  72          1HG       GLU  72 -15.636  -5.847  -6.720
  561   2HG   GLU  72          2HG       GLU  72 -14.248  -5.761  -5.630
  562    H    ALA  73           H        ALA  73 -14.218  -3.560  -3.662
  563    HA   ALA  73           HA       ALA  73 -11.667  -4.589  -4.278
  564   1HB   ALA  73          1HB       ALA  73 -12.762  -2.003  -3.100
  565   2HB   ALA  73          2HB       ALA  73 -11.108  -2.162  -3.747
  566   3HB   ALA  73          3HB       ALA  73 -12.528  -2.355  -4.816
  567    H    LEU  74           H        LEU  74 -12.988  -3.186  -1.288
  568    HA   LEU  74           HA       LEU  74 -10.664  -3.665   0.279
  569   1HB   LEU  74          1HB       LEU  74 -12.128  -2.990   2.158
  570   2HB   LEU  74          2HB       LEU  74 -12.204  -1.930   0.727
  571    HG   LEU  74           HG       LEU  74 -14.263  -3.621   0.177
  572   1HD1  LEU  74          1HD2      LEU  74 -14.185  -3.049   3.164
  573   2HD1  LEU  74          2HD2      LEU  74 -15.601  -3.649   2.257
  574   3HD1  LEU  74          3HD2      LEU  74 -14.142  -4.665   2.394
  575   1HD2  LEU  74          1HD1      LEU  74 -14.270  -0.993   1.729
  576   2HD2  LEU  74          2HD1      LEU  74 -14.185  -1.183  -0.034
  577   3HD2  LEU  74          3HD1      LEU  74 -15.652  -1.665   0.826
  578    H    GLU  75           H        GLU  75 -13.691  -5.604  -0.090
  579    HA   GLU  75           HA       GLU  75 -12.998  -7.634   1.770
  580   1HB   GLU  75          1HB       GLU  75 -14.551  -7.740  -0.852
  581   2HB   GLU  75          2HB       GLU  75 -14.411  -9.105   0.276
  582   1HG   GLU  75          1HG       GLU  75 -15.370  -7.701   2.089
  583   2HG   GLU  75          2HG       GLU  75 -15.532  -6.365   0.923
  584    H    LYS  76           H        LYS  76 -12.317  -7.401  -1.726
  585    HA   LYS  76           HA       LYS  76 -10.951  -9.820  -2.151
  586   1HB   LYS  76          1HB       LYS  76 -10.360  -7.060  -3.288
  587   2HB   LYS  76          2HB       LYS  76  -9.876  -8.592  -4.042
  588   1HG   LYS  76          1HG       LYS  76 -12.737  -7.849  -3.363
  589   2HG   LYS  76          2HG       LYS  76 -12.015  -7.448  -4.924
  590   1HD   LYS  76          1HD       LYS  76 -12.270 -10.290  -3.831
  591   2HD   LYS  76          2HD       LYS  76 -13.300  -9.552  -5.089
  592   1HE   LYS  76          1HE       LYS  76 -11.389  -9.219  -6.547
  593   2HE   LYS  76          2HE       LYS  76 -10.266  -9.752  -5.282
  594   1HZ   LYS  76          1HZ       LYS  76 -12.356 -11.430  -6.490
  595   2HZ   LYS  76          2HZ       LYS  76 -10.751 -11.484  -6.875
  596   3HZ   LYS  76          3HZ       LYS  76 -11.254 -11.904  -5.361
  597    H    LEU  77           H        LEU  77  -9.576  -6.606  -1.435
  598    HA   LEU  77           HA       LEU  77  -6.898  -7.459  -1.150
  599   1HB   LEU  77          1HB       LEU  77  -8.553  -5.120  -0.393
  600   2HB   LEU  77          2HB       LEU  77  -6.975  -5.275   0.420
  601    HG   LEU  77           HG       LEU  77  -7.124  -4.012  -1.926
  602   1HD1  LEU  77          1HD1      LEU  77  -5.086  -4.528  -0.588
  603   2HD1  LEU  77          2HD1      LEU  77  -5.084  -6.167  -1.298
  604   3HD1  LEU  77          3HD1      LEU  77  -4.826  -4.749  -2.343
  605   1HD2  LEU  77          1HD2      LEU  77  -8.108  -6.005  -3.176
  606   2HD2  LEU  77          2HD2      LEU  77  -6.488  -5.536  -3.776
  607   3HD2  LEU  77          3HD2      LEU  77  -6.663  -6.928  -2.700
  608    H    ALA  78           H        ALA  78  -9.302  -6.882   1.538
  609    HA   ALA  78           HA       ALA  78  -7.433  -7.749   3.524
  610   1HB   ALA  78          1HB       ALA  78 -10.463  -7.684   3.614
  611   2HB   ALA  78          2HB       ALA  78  -9.382  -7.937   5.008
  612   3HB   ALA  78          3HB       ALA  78  -9.349  -6.396   4.138
  613    H    ALA  79           H        ALA  79  -9.656  -9.571   1.440
  614    HA   ALA  79           HA       ALA  79  -9.451 -12.105   2.742
  615   1HB   ALA  79          1HB       ALA  79 -10.955 -11.451   0.788
  616   2HB   ALA  79          2HB       ALA  79  -9.482 -11.439  -0.228
  617   3HB   ALA  79          3HB       ALA  79 -10.039 -12.960   0.513
  618    H    TYR  80           H        TYR  80  -7.571 -10.543   0.103
  619    HA   TYR  80           HA       TYR  80  -5.822 -12.736  -0.278
  620   1HB   TYR  80          1HB       TYR  80  -6.405 -10.989  -1.890
  621   2HB   TYR  80          2HB       TYR  80  -5.553  -9.784  -0.914
  622    HD1  TYR  80           HD1      TYR  80  -3.357  -9.245  -1.503
  623    HD2  TYR  80           HD2      TYR  80  -4.878 -13.176  -2.374
  624    HE1  TYR  80           HE1      TYR  80  -1.114  -9.931  -2.328
  625    HE2  TYR  80           HE2      TYR  80  -2.655 -13.855  -3.231
  626    HH   TYR  80           HH       TYR  80  -0.481 -13.220  -3.593
  627    H    VAL  81           H        VAL  81  -5.349  -9.699   1.533
  628    HA   VAL  81           HA       VAL  81  -2.585 -10.046   2.013
  629    HB   VAL  81           HB       VAL  81  -2.922  -8.259   3.683
  630   1HG1  VAL  81          1HG2      VAL  81  -2.992  -7.914   1.220
  631   2HG1  VAL  81          2HG2      VAL  81  -4.760  -8.098   1.265
  632   3HG1  VAL  81          3HG2      VAL  81  -3.994  -6.716   2.094
  633   1HG2  VAL  81          1HG1      VAL  81  -4.973  -9.258   4.730
  634   2HG2  VAL  81          2HG1      VAL  81  -5.255  -7.566   4.267
  635   3HG2  VAL  81          3HG1      VAL  81  -5.893  -8.893   3.263
  636    H    GLN  82           H        GLN  82  -5.298 -11.227   3.909
  637    HA   GLN  82           HA       GLN  82  -3.513 -11.884   6.164
  638   1HB   GLN  82          1HB       GLN  82  -5.729 -12.531   7.170
  639   2HB   GLN  82          2HB       GLN  82  -5.761 -10.865   6.527
  640   1HG   GLN  82          1HG       GLN  82  -6.910 -11.612   4.555
  641   2HG   GLN  82          2HG       GLN  82  -6.354 -13.217   4.793
  642   1HE2  GLN  82          2HE2      GLN  82  -8.924 -11.554   4.700
  643   2HE2  GLN  82          1HE2      GLN  82 -10.050 -12.445   5.755
  644    H    GLU  83           H        GLU  83  -5.043 -13.415   3.474
  645    HA   GLU  83           HA       GLU  83  -6.057 -15.729   4.270
  646   1HB   GLU  83          1HB       GLU  83  -6.007 -16.294   1.952
  647   2HB   GLU  83          2HB       GLU  83  -6.131 -14.509   2.170
  648   1HG   GLU  83          1HG       GLU  83  -3.737 -14.269   1.709
  649   2HG   GLU  83          2HG       GLU  83  -3.543 -16.040   1.599
  650    H    GLU  84           H        GLU  84  -2.555 -15.636   3.342
  651    HA   GLU  84           HA       GLU  84  -2.380 -18.241   4.776
  652   1HB   GLU  84          1HB       GLU  84  -0.752 -18.961   2.964
  653   2HB   GLU  84          2HB       GLU  84  -2.461 -18.833   2.517
  654   1HG   GLU  84          1HG       GLU  84  -2.001 -16.478   1.701
  655   2HG   GLU  84          2HG       GLU  84  -0.274 -16.864   1.806
  656    H    VAL  85           H        VAL  85   0.440 -17.223   3.249
  657    HA   VAL  85           HA       VAL  85   1.532 -15.455   5.342
  658    HB   VAL  85           HB       VAL  85   3.531 -17.010   5.684
  659   1HG1  VAL  85          1HG1      VAL  85   0.926 -18.217   6.856
  660   2HG1  VAL  85          2HG1      VAL  85   2.579 -18.562   7.422
  661   3HG1  VAL  85          3HG1      VAL  85   1.922 -16.945   7.603
  662   1HG2  VAL  85          1HG2      VAL  85   3.151 -18.625   3.768
  663   2HG2  VAL  85          2HG2      VAL  85   3.357 -19.460   5.311
  664   3HG2  VAL  85          3HG2      VAL  85   1.729 -19.290   4.606
  Start of MODEL   17
    1   1H    VAL   2          1H        VAL   2 -16.891   7.214  -0.428
    2   2H    VAL   2          2H        VAL   2 -16.619   6.766  -2.026
    3   3H    VAL   2          3H        VAL   2 -18.076   7.484  -1.590
    4    HA   VAL   2           HA       VAL   2 -18.649   5.609  -0.228
    5    HB   VAL   2           HB       VAL   2 -17.772   4.866  -3.048
    6   1HG1  VAL   2          1HG1      VAL   2 -18.440   2.930  -1.672
    7   2HG1  VAL   2          2HG1      VAL   2 -19.983   3.733  -1.286
    8   3HG1  VAL   2          3HG1      VAL   2 -19.620   3.251  -2.964
    9   1HG2  VAL   2          1HG2      VAL   2 -19.154   6.915  -3.022
   10   2HG2  VAL   2          2HG2      VAL   2 -20.048   5.543  -3.718
   11   3HG2  VAL   2          3HG2      VAL   2 -20.387   6.072  -2.053
   12    H    GLN   3           H        GLN   3 -16.798   5.462   1.298
   13    HA   GLN   3           HA       GLN   3 -14.724   3.515   0.433
   14   1HB   GLN   3          1HB       GLN   3 -14.131   5.874   1.270
   15   2HB   GLN   3          2HB       GLN   3 -14.677   5.331   2.874
   16   1HG   GLN   3          1HG       GLN   3 -13.014   3.491   2.791
   17   2HG   GLN   3          2HG       GLN   3 -12.460   4.051   1.205
   18   1HE2  GLN   3          2HE2      GLN   3 -12.424   6.889   1.566
   19   2HE2  GLN   3          1HE2      GLN   3 -11.218   7.206   2.798
   20    H    GLN   4           H        GLN   4 -14.537   1.553   1.367
   21    HA   GLN   4           HA       GLN   4 -15.694   1.249   4.072
   22   1HB   GLN   4          1HB       GLN   4 -17.139   0.364   1.868
   23   2HB   GLN   4          2HB       GLN   4 -16.283  -1.100   2.397
   24   1HG   GLN   4          1HG       GLN   4 -18.012   0.714   4.137
   25   2HG   GLN   4          2HG       GLN   4 -18.458  -0.906   3.541
   26   1HE2  GLN   4          2HE2      GLN   4 -17.276  -2.759   4.341
   27   2HE2  GLN   4          1HE2      GLN   4 -16.206  -2.642   5.761
   28    H    LYS   5           H        LYS   5 -14.697  -0.648   5.257
   29    HA   LYS   5           HA       LYS   5 -12.535  -2.033   3.844
   30   1HB   LYS   5          1HB       LYS   5 -11.151  -1.414   6.008
   31   2HB   LYS   5          2HB       LYS   5 -11.189  -0.379   4.575
   32   1HG   LYS   5          1HG       LYS   5 -11.456   1.040   6.495
   33   2HG   LYS   5          2HG       LYS   5 -12.993   0.983   5.590
   34   1HD   LYS   5          1HD       LYS   5 -13.743  -0.837   7.225
   35   2HD   LYS   5          2HD       LYS   5 -12.255  -0.476   8.141
   36   1HE   LYS   5          1HE       LYS   5 -14.190   0.755   9.066
   37   2HE   LYS   5          2HE       LYS   5 -12.962   1.865   8.424
   38   1HZ   LYS   5          1HZ       LYS   5 -15.399   1.018   7.004
   39   2HZ   LYS   5          2HZ       LYS   5 -15.194   2.462   7.772
   40   3HZ   LYS   5          3HZ       LYS   5 -14.281   2.094   6.453
   41    H    VAL   6           H        VAL   6 -11.636  -3.721   5.081
   42    HA   VAL   6           HA       VAL   6 -13.084  -4.681   7.468
   43    HB   VAL   6           HB       VAL   6 -13.075  -7.009   6.372
   44   1HG1  VAL   6          1HG2      VAL   6 -14.913  -4.809   5.351
   45   2HG1  VAL   6          2HG2      VAL   6 -15.272  -6.552   5.294
   46   3HG1  VAL   6          3HG2      VAL   6 -15.108  -5.726   6.863
   47   1HG2  VAL   6          1HG1      VAL   6 -11.696  -6.395   4.383
   48   2HG2  VAL   6          2HG1      VAL   6 -13.292  -7.031   3.913
   49   3HG2  VAL   6          3HG1      VAL   6 -12.976  -5.279   3.860
   50    H    GLU   7           H        GLU   7 -11.567  -5.400   8.946
   51    HA   GLU   7           HA       GLU   7  -8.797  -5.311   7.939
   52   1HB   GLU   7          1HB       GLU   7  -9.429  -3.893   9.892
   53   2HB   GLU   7          2HB       GLU   7  -9.934  -5.343  10.787
   54   1HG   GLU   7          1HG       GLU   7  -7.690  -6.149  10.947
   55   2HG   GLU   7          2HG       GLU   7  -7.111  -4.967   9.762
   56    H    VAL   8           H        VAL   8  -7.195  -6.655   8.531
   57    HA   VAL   8           HA       VAL   8  -7.717  -9.348   9.522
   58    HB   VAL   8           HB       VAL   8  -6.622 -10.261   7.318
   59   1HG1  VAL   8          1HG1      VAL   8  -9.474  -9.243   7.406
   60   2HG1  VAL   8          2HG1      VAL   8  -8.817 -10.485   6.291
   61   3HG1  VAL   8          3HG1      VAL   8  -8.853 -10.798   8.041
   62   1HG2  VAL   8          1HG2      VAL   8  -7.827  -7.626   6.346
   63   2HG2  VAL   8          2HG2      VAL   8  -6.107  -8.087   6.273
   64   3HG2  VAL   8          3HG2      VAL   8  -7.297  -8.981   5.301
   65    H    ARG   9           H        ARG   9  -5.441 -10.561   9.373
   66    HA   ARG   9           HA       ARG   9  -3.516  -8.478  10.210
   67   1HB   ARG   9          1HB       ARG   9  -3.406 -10.390  11.610
   68   2HB   ARG   9          2HB       ARG   9  -3.239 -11.512  10.220
   69   1HG   ARG   9          1HG       ARG   9  -1.237  -9.323  10.653
   70   2HG   ARG   9          2HG       ARG   9  -1.141 -10.805  11.617
   71   1HD   ARG   9          1HD       ARG   9  -1.259 -10.842   8.565
   72   2HD   ARG   9          2HD       ARG   9   0.238 -10.872   9.509
   73    HE   ARG   9           HE       ARG   9  -0.215 -13.021  10.255
   74   1HH1  ARG   9          2HH1      ARG   9  -2.904 -11.833   8.234
   75   2HH1  ARG   9          1HH1      ARG   9  -3.487 -13.447   7.900
   76   1HH2  ARG   9          1HH2      ARG   9  -1.020 -15.105   9.758
   77   2HH2  ARG   9          2HH2      ARG   9  -2.423 -15.282   8.736
   78    H    LEU  10           H        LEU  10  -2.005  -7.707   9.030
   79    HA   LEU  10           HA       LEU  10  -1.913  -8.023   6.227
   80   1HB   LEU  10          1HB       LEU  10  -1.385  -5.998   7.569
   81   2HB   LEU  10          2HB       LEU  10  -0.031  -6.853   8.324
   82    HG   LEU  10           HG       LEU  10   1.113  -6.991   6.140
   83   1HD1  LEU  10          1HD2      LEU  10  -1.244  -5.264   5.225
   84   2HD1  LEU  10          2HD2      LEU  10   0.239  -5.585   4.289
   85   3HD1  LEU  10          3HD2      LEU  10  -0.882  -6.915   4.660
   86   1HD2  LEU  10          1HD1      LEU  10   1.308  -5.168   7.876
   87   2HD2  LEU  10          2HD1      LEU  10   1.765  -4.698   6.228
   88   3HD2  LEU  10          3HD1      LEU  10   0.183  -4.187   6.899
   89    H    LYS  11           H        LYS  11  -1.727 -10.379   6.191
   90    HA   LYS  11           HA       LYS  11   0.659 -11.776   7.047
   91   1HB   LYS  11          1HB       LYS  11  -1.462 -12.904   6.965
   92   2HB   LYS  11          2HB       LYS  11  -1.774 -12.352   5.316
   93   1HG   LYS  11          1HG       LYS  11   0.589 -14.133   5.886
   94   2HG   LYS  11          2HG       LYS  11  -1.043 -14.798   5.639
   95   1HD   LYS  11          1HD       LYS  11   0.526 -13.048   3.710
   96   2HD   LYS  11          2HD       LYS  11  -0.034 -14.718   3.452
   97   1HE   LYS  11          1HE       LYS  11  -2.396 -13.945   3.597
   98   2HE   LYS  11          2HE       LYS  11  -1.844 -12.312   3.976
   99   1HZ   LYS  11          1HZ       LYS  11  -1.303 -13.661   1.426
  100   2HZ   LYS  11          2HZ       LYS  11  -2.443 -12.506   1.696
  101   3HZ   LYS  11          3HZ       LYS  11  -0.843 -12.142   1.856
  102    H    THR  12           H        THR  12  -0.393 -10.028   4.176
  103    HA   THR  12           HA       THR  12   1.515 -10.998   2.298
  104    HB   THR  12           HB       THR  12   1.091  -8.677   1.282
  105    HG1  THR  12           HG1      THR  12  -0.585  -7.504   2.343
  106   1HG2  THR  12          1HG2      THR  12  -1.326 -10.331   2.119
  107   2HG2  THR  12          2HG2      THR  12  -1.279  -9.180   0.758
  108   3HG2  THR  12          3HG2      THR  12  -0.287 -10.652   0.708
  109    H    GLY  13           H        GLY  13   1.518  -7.949   4.061
  110   1HA   GLY  13          1HA       GLY  13   3.073  -6.752   5.189
  111   2HA   GLY  13          2HA       GLY  13   4.296  -8.010   5.049
  112    H    LEU  14           H        LEU  14   2.573  -6.780   2.346
  113    HA   LEU  14           HA       LEU  14   3.337  -5.793   0.336
  114   1HB   LEU  14          1HB       LEU  14   3.064  -3.929   2.631
  115   2HB   LEU  14          2HB       LEU  14   3.508  -3.302   1.042
  116    HG   LEU  14           HG       LEU  14   1.045  -3.286   1.506
  117   1HD1  LEU  14          1HD2      LEU  14   1.950  -4.958  -0.845
  118   2HD1  LEU  14          2HD2      LEU  14   0.370  -4.158  -0.685
  119   3HD1  LEU  14          3HD2      LEU  14   1.857  -3.187  -0.769
  120   1HD2  LEU  14          1HD1      LEU  14   0.889  -5.453   2.704
  121   2HD2  LEU  14          2HD1      LEU  14  -0.238  -5.350   1.327
  122   3HD2  LEU  14          3HD1      LEU  14   1.261  -6.302   1.183
  123    H    GLN  15           H        GLN  15   5.641  -7.091   0.823
  124    HA   GLN  15           HA       GLN  15   7.741  -4.998   0.664
  125   1HB   GLN  15          1HB       GLN  15   8.557  -7.824   0.308
  126   2HB   GLN  15          2HB       GLN  15   9.294  -6.541   1.279
  127   1HG   GLN  15          1HG       GLN  15   8.628  -8.226   2.806
  128   2HG   GLN  15          2HG       GLN  15   7.389  -6.959   2.960
  129   1HE2  GLN  15          2HE2      GLN  15   6.681  -9.432   3.905
  130   2HE2  GLN  15          1HE2      GLN  15   5.383  -9.933   2.855
  131    H    ALA  16           H        ALA  16   6.751  -8.034  -0.973
  132    HA   ALA  16           HA       ALA  16   7.187  -6.598  -3.535
  133   1HB   ALA  16          1HB       ALA  16   9.290  -7.736  -3.044
  134   2HB   ALA  16          2HB       ALA  16   8.436  -9.287  -2.858
  135   3HB   ALA  16          3HB       ALA  16   8.490  -8.484  -4.446
  136    H    ARG  17           H        ARG  17   6.636 -10.053  -2.910
  137    HA   ARG  17           HA       ARG  17   4.759 -10.057  -5.067
  138   1HB   ARG  17          1HB       ARG  17   6.421 -11.902  -4.178
  139   2HB   ARG  17          2HB       ARG  17   4.956 -12.484  -3.342
  140   1HG   ARG  17          1HG       ARG  17   5.153 -11.780  -6.307
  141   2HG   ARG  17          2HG       ARG  17   5.288 -13.432  -5.670
  142   1HD   ARG  17          1HD       ARG  17   2.863 -11.629  -5.246
  143   2HD   ARG  17          2HD       ARG  17   2.999 -12.844  -6.529
  144    HE   ARG  17           HE       ARG  17   3.403 -14.513  -4.656
  145   1HH1  ARG  17          2HH1      ARG  17   1.413 -11.620  -4.199
  146   2HH1  ARG  17          1HH1      ARG  17   0.334 -12.374  -3.056
  147   1HH2  ARG  17          1HH2      ARG  17   2.016 -15.512  -3.187
  148   2HH2  ARG  17          2HH2      ARG  17   0.688 -14.656  -2.461
  149    HA   PRO  18           HA       PRO  18   1.289 -11.177  -1.914
  150   1HB   PRO  18          1HB       PRO  18   1.662 -10.342   0.695
  151   2HB   PRO  18          2HB       PRO  18   2.259 -11.941   0.151
  152   1HG   PRO  18          1HG       PRO  18   3.830  -9.341   0.237
  153   2HG   PRO  18          2HG       PRO  18   4.296 -10.866   1.007
  154   1HD   PRO  18          1HD       PRO  18   5.258 -10.274  -1.430
  155   2HD   PRO  18          2HD       PRO  18   4.611 -11.924  -1.162
  156    H    ALA  19           H        ALA  19   3.382  -8.574  -1.154
  157    HA   ALA  19           HA       ALA  19   1.788  -6.365  -0.628
  158   1HB   ALA  19          1HB       ALA  19   4.269  -6.759  -0.492
  159   2HB   ALA  19          2HB       ALA  19   4.297  -6.857  -2.270
  160   3HB   ALA  19          3HB       ALA  19   3.903  -5.300  -1.469
  161    H    ALA  20           H        ALA  20   3.146  -7.616  -3.688
  162    HA   ALA  20           HA       ALA  20   2.059  -5.610  -5.407
  163   1HB   ALA  20          1HB       ALA  20   4.020  -7.034  -5.961
  164   2HB   ALA  20          2HB       ALA  20   2.956  -8.460  -6.004
  165   3HB   ALA  20          3HB       ALA  20   2.741  -7.155  -7.197
  166    H    LEU  21           H        LEU  21   1.005  -8.863  -4.398
  167    HA   LEU  21           HA       LEU  21  -1.260  -8.956  -6.154
  168   1HB   LEU  21          1HB       LEU  21  -0.185 -10.815  -4.740
  169   2HB   LEU  21          2HB       LEU  21  -1.225 -10.250  -3.413
  170    HG   LEU  21           HG       LEU  21  -2.182 -11.033  -6.207
  171   1HD1  LEU  21          1HD1      LEU  21  -1.187 -12.948  -4.985
  172   2HD1  LEU  21          2HD1      LEU  21  -2.271 -12.618  -3.611
  173   3HD1  LEU  21          3HD1      LEU  21  -2.948 -13.126  -5.176
  174   1HD2  LEU  21          1HD2      LEU  21  -3.703  -9.496  -4.982
  175   2HD2  LEU  21          2HD2      LEU  21  -4.411 -11.119  -5.156
  176   3HD2  LEU  21          3HD2      LEU  21  -3.706 -10.620  -3.600
  177    H    PHE  22           H        PHE  22  -0.968  -7.954  -2.761
  178    HA   PHE  22           HA       PHE  22  -3.558  -7.077  -2.080
  179   1HB   PHE  22          1HB       PHE  22  -1.635  -7.301  -0.552
  180   2HB   PHE  22          2HB       PHE  22  -0.724  -6.125  -1.493
  181    HD1  PHE  22           HD1      PHE  22  -1.420  -3.696  -1.516
  182    HD2  PHE  22           HD2      PHE  22  -2.883  -6.565   1.343
  183    HE1  PHE  22           HE1      PHE  22  -1.952  -1.864   0.023
  184    HE2  PHE  22           HE2      PHE  22  -3.475  -4.719   2.886
  185    HZ   PHE  22           HZ       PHE  22  -3.018  -2.361   2.240
  186    H    VAL  23           H        VAL  23  -0.844  -5.025  -3.113
  187    HA   VAL  23           HA       VAL  23  -2.284  -2.649  -3.495
  188    HB   VAL  23           HB       VAL  23   0.338  -3.781  -4.486
  189   1HG1  VAL  23          1HG2      VAL  23  -0.701  -0.973  -5.022
  190   2HG1  VAL  23          2HG2      VAL  23   0.954  -1.553  -5.315
  191   3HG1  VAL  23          3HG2      VAL  23  -0.401  -2.231  -6.246
  192   1HG2  VAL  23          1HG1      VAL  23  -0.481  -1.550  -2.569
  193   2HG2  VAL  23          2HG1      VAL  23   0.146  -3.153  -2.116
  194   3HG2  VAL  23          3HG1      VAL  23   1.196  -1.992  -2.963
  195    H    GLN  24           H        GLN  24  -1.425  -5.210  -5.876
  196    HA   GLN  24           HA       GLN  24  -2.461  -3.773  -8.114
  197   1HB   GLN  24          1HB       GLN  24  -0.819  -5.308  -8.594
  198   2HB   GLN  24          2HB       GLN  24  -1.486  -6.541  -7.515
  199   1HG   GLN  24          1HG       GLN  24  -3.381  -5.904  -9.620
  200   2HG   GLN  24          2HG       GLN  24  -1.819  -6.408 -10.294
  201   1HE2  GLN  24          2HE2      GLN  24  -2.999  -7.606  -7.071
  202   2HE2  GLN  24          1HE2      GLN  24  -3.364  -9.201  -7.708
  203    H    GLU  25           H        GLU  25  -4.036  -6.046  -5.825
  204    HA   GLU  25           HA       GLU  25  -6.317  -6.314  -7.603
  205   1HB   GLU  25          1HB       GLU  25  -6.031  -6.886  -4.600
  206   2HB   GLU  25          2HB       GLU  25  -7.393  -7.408  -5.616
  207   1HG   GLU  25          1HG       GLU  25  -4.503  -8.217  -6.011
  208   2HG   GLU  25          2HG       GLU  25  -5.727  -9.218  -5.204
  209    H    ALA  26           H        ALA  26  -5.575  -4.672  -4.557
  210    HA   ALA  26           HA       ALA  26  -7.838  -3.080  -4.122
  211   1HB   ALA  26          1HB       ALA  26  -4.876  -2.361  -4.041
  212   2HB   ALA  26          2HB       ALA  26  -6.165  -1.452  -3.215
  213   3HB   ALA  26          3HB       ALA  26  -5.782  -3.121  -2.708
  214    H    ASN  27           H        ASN  27  -5.031  -2.517  -6.154
  215    HA   ASN  27           HA       ASN  27  -5.692  -0.140  -7.469
  216   1HB   ASN  27          1HB       ASN  27  -3.835  -2.391  -7.590
  217   2HB   ASN  27          2HB       ASN  27  -4.246  -1.839  -9.211
  218   1HD2  ASN  27          2HD2      ASN  27  -2.206  -1.391  -6.677
  219   2HD2  ASN  27          1HD2      ASN  27  -1.629   0.252  -6.889
  220    H    ARG  28           H        ARG  28  -6.627  -3.496  -8.260
  221    HA   ARG  28           HA       ARG  28  -7.042  -2.993 -11.139
  222   1HB   ARG  28          1HB       ARG  28  -8.087  -5.089  -9.185
  223   2HB   ARG  28          2HB       ARG  28  -8.506  -5.051 -10.907
  224   1HG   ARG  28          1HG       ARG  28  -6.109  -5.254 -11.519
  225   2HG   ARG  28          2HG       ARG  28  -5.669  -5.288  -9.800
  226   1HD   ARG  28          1HD       ARG  28  -6.910  -7.381  -9.482
  227   2HD   ARG  28          2HD       ARG  28  -7.524  -7.311 -11.143
  228    HE   ARG  28           HE       ARG  28  -4.945  -8.275 -10.284
  229   1HH1  ARG  28          1HH2      ARG  28  -6.671  -6.744 -12.946
  230   2HH1  ARG  28          2HH2      ARG  28  -5.513  -7.212 -14.164
  231   1HH2  ARG  28          2HH1      ARG  28  -3.376  -8.787 -11.792
  232   2HH2  ARG  28          1HH1      ARG  28  -3.588  -8.440 -13.497
  233    H    PHE  29           H        PHE  29  -8.838  -3.305  -8.193
  234    HA   PHE  29           HA       PHE  29 -11.426  -2.524  -9.162
  235   1HB   PHE  29          1HB       PHE  29  -9.938  -2.846  -6.574
  236   2HB   PHE  29          2HB       PHE  29 -11.529  -2.150  -6.582
  237    HD1  PHE  29           HD1      PHE  29 -12.050  -4.332  -5.158
  238    HD2  PHE  29           HD2      PHE  29 -11.140  -4.373  -9.351
  239    HE1  PHE  29           HE1      PHE  29 -12.853  -6.671  -5.302
  240    HE2  PHE  29           HE2      PHE  29 -12.165  -6.630  -9.553
  241    HZ   PHE  29           HZ       PHE  29 -13.014  -7.792  -7.520
  242    H    THR  30           H        THR  30 -12.088  -0.641  -9.642
  243    HA   THR  30           HA       THR  30 -10.200   1.622  -9.546
  244    HB   THR  30           HB       THR  30 -11.264   1.288 -11.583
  245    HG1  THR  30           HG1      THR  30 -12.451   3.488 -10.247
  246   1HG2  THR  30          1HG2      THR  30 -13.696   1.401 -11.937
  247   2HG2  THR  30          2HG2      THR  30 -13.281   0.070 -10.832
  248   3HG2  THR  30          3HG2      THR  30 -13.942   1.596 -10.186
  249    H    SER  31           H        SER  31 -10.362   1.256  -7.210
  250    HA   SER  31           HA       SER  31 -12.250   3.130  -5.914
  251   1HB   SER  31          1HB       SER  31 -11.002   0.586  -4.802
  252   2HB   SER  31          2HB       SER  31 -12.291   1.556  -4.054
  253    HG   SER  31           HG       SER  31 -12.930  -0.423  -5.204
  254    H    ASP  32           H        ASP  32 -11.494   4.393  -4.295
  255    HA   ASP  32           HA       ASP  32  -8.609   4.830  -4.052
  256   1HB   ASP  32          1HB       ASP  32 -10.290   6.649  -3.943
  257   2HB   ASP  32          2HB       ASP  32 -11.011   5.848  -2.522
  258    H    VAL  33           H        VAL  33  -8.045   2.770  -3.495
  259    HA   VAL  33           HA       VAL  33  -9.208   1.344  -1.272
  260    HB   VAL  33           HB       VAL  33  -6.760   0.830  -3.000
  261   1HG1  VAL  33          1HG1      VAL  33  -8.335  -1.032  -1.173
  262   2HG1  VAL  33          2HG1      VAL  33  -7.023  -1.520  -2.275
  263   3HG1  VAL  33          3HG1      VAL  33  -6.676  -0.444  -0.901
  264   1HG2  VAL  33          1HG2      VAL  33  -8.916   1.052  -4.196
  265   2HG2  VAL  33          2HG2      VAL  33  -8.343  -0.630  -4.233
  266   3HG2  VAL  33          3HG2      VAL  33  -9.646  -0.153  -3.111
  267    H    PHE  34           H        PHE  34  -8.076   0.535   0.592
  268    HA   PHE  34           HA       PHE  34  -5.789   2.166   1.457
  269   1HB   PHE  34          1HB       PHE  34  -8.399   2.143   3.011
  270   2HB   PHE  34          2HB       PHE  34  -6.848   2.736   3.595
  271    HD1  PHE  34           HD1      PHE  34  -9.769   3.510   1.548
  272    HD2  PHE  34           HD2      PHE  34  -5.741   4.669   2.475
  273    HE1  PHE  34           HE1      PHE  34 -10.178   5.738   0.536
  274    HE2  PHE  34           HE2      PHE  34  -6.150   6.917   1.470
  275    HZ   PHE  34           HZ       PHE  34  -8.384   7.441   0.501
  276    H    LEU  35           H        LEU  35  -4.930   1.491   3.505
  277    HA   LEU  35           HA       LEU  35  -5.858  -1.066   4.611
  278   1HB   LEU  35          1HB       LEU  35  -4.087  -1.729   2.957
  279   2HB   LEU  35          2HB       LEU  35  -2.938  -0.671   3.833
  280    HG   LEU  35           HG       LEU  35  -3.589  -1.924   5.951
  281   1HD1  LEU  35          1HD1      LEU  35  -4.896  -3.776   3.913
  282   2HD1  LEU  35          2HD1      LEU  35  -4.704  -4.121   5.649
  283   3HD1  LEU  35          3HD1      LEU  35  -5.748  -2.780   5.116
  284   1HD2  LEU  35          1HD2      LEU  35  -2.365  -3.586   3.718
  285   2HD2  LEU  35          2HD2      LEU  35  -1.501  -2.449   4.777
  286   3HD2  LEU  35          3HD2      LEU  35  -2.230  -3.922   5.461
  287    H    GLU  36           H        GLU  36  -5.823  -0.826   6.786
  288    HA   GLU  36           HA       GLU  36  -4.211   1.494   7.790
  289   1HB   GLU  36          1HB       GLU  36  -6.569   0.984   9.346
  290   2HB   GLU  36          2HB       GLU  36  -6.060   2.491   8.592
  291   1HG   GLU  36          1HG       GLU  36  -7.366   2.104   6.700
  292   2HG   GLU  36          2HG       GLU  36  -7.253   0.352   6.854
  293    H    LYS  37           H        LYS  37  -2.727   0.821   9.234
  294    HA   LYS  37           HA       LYS  37  -2.833  -1.797  10.525
  295   1HB   LYS  37          1HB       LYS  37  -1.068   0.644  10.970
  296   2HB   LYS  37          2HB       LYS  37  -0.842  -0.937  11.753
  297   1HG   LYS  37          1HG       LYS  37  -0.627  -2.013   9.520
  298   2HG   LYS  37          2HG       LYS  37  -0.792  -0.424   8.749
  299   1HD   LYS  37          1HD       LYS  37   1.605  -1.126   8.986
  300   2HD   LYS  37          2HD       LYS  37   1.238   0.373   9.871
  301   1HE   LYS  37          1HE       LYS  37   0.919  -0.981  11.956
  302   2HE   LYS  37          2HE       LYS  37   1.439  -2.432  11.069
  303   1HZ   LYS  37          1HZ       LYS  37   3.510  -1.319  10.629
  304   2HZ   LYS  37          2HZ       LYS  37   3.035  -0.001  11.497
  305   3HZ   LYS  37          3HZ       LYS  37   3.239  -1.454  12.253
  306    H    ASP  38           H        ASP  38  -4.566  -2.058  11.807
  307    HA   ASP  38           HA       ASP  38  -6.167  -1.685  13.379
  308   1HB   ASP  38          1HB       ASP  38  -3.791  -0.382  14.744
  309   2HB   ASP  38          2HB       ASP  38  -5.346  -0.727  15.528
  310    H    GLY  39           H        GLY  39  -6.059   0.224  11.206
  311   1HA   GLY  39          1HA       GLY  39  -7.707   2.085  11.135
  312   2HA   GLY  39          2HA       GLY  39  -7.064   2.588  12.717
  313    H    LYS  40           H        LYS  40  -4.182   1.987  11.609
  314    HA   LYS  40           HA       LYS  40  -3.720   4.686  10.650
  315   1HB   LYS  40          1HB       LYS  40  -1.839   2.300  10.726
  316   2HB   LYS  40          2HB       LYS  40  -1.388   4.017  10.652
  317   1HG   LYS  40          1HG       LYS  40  -2.746   2.534  12.937
  318   2HG   LYS  40          2HG       LYS  40  -1.108   3.214  12.945
  319   1HD   LYS  40          1HD       LYS  40  -3.702   4.803  12.697
  320   2HD   LYS  40          2HD       LYS  40  -2.692   4.696  14.155
  321   1HE   LYS  40          1HE       LYS  40  -0.802   5.727  12.945
  322   2HE   LYS  40          2HE       LYS  40  -1.773   5.793  11.460
  323   1HZ   LYS  40          1HZ       LYS  40  -2.389   7.193  13.970
  324   2HZ   LYS  40          2HZ       LYS  40  -1.766   7.880  12.609
  325   3HZ   LYS  40          3HZ       LYS  40  -3.290   7.253  12.590
  326    H    LYS  41           H        LYS  41  -5.193   4.517   8.811
  327    HA   LYS  41           HA       LYS  41  -4.463   2.615   6.770
  328   1HB   LYS  41          1HB       LYS  41  -6.544   2.694   6.294
  329   2HB   LYS  41          2HB       LYS  41  -6.792   3.901   7.550
  330   1HG   LYS  41          1HG       LYS  41  -6.194   4.421   4.596
  331   2HG   LYS  41          2HG       LYS  41  -7.800   4.495   5.334
  332   1HD   LYS  41          1HD       LYS  41  -7.111   6.362   6.771
  333   2HD   LYS  41          2HD       LYS  41  -5.437   6.244   6.164
  334   1HE   LYS  41          1HE       LYS  41  -6.219   6.719   3.869
  335   2HE   LYS  41          2HE       LYS  41  -7.888   6.821   4.440
  336   1HZ   LYS  41          1HZ       LYS  41  -5.679   8.571   5.279
  337   2HZ   LYS  41          2HZ       LYS  41  -6.884   8.976   4.231
  338   3HZ   LYS  41          3HZ       LYS  41  -7.235   8.673   5.812
  339    H    VAL  42           H        VAL  42  -4.032   2.951   4.677
  340    HA   VAL  42           HA       VAL  42  -3.264   5.605   3.603
  341    HB   VAL  42           HB       VAL  42  -1.165   4.470   2.645
  342   1HG1  VAL  42          1HG1      VAL  42  -1.376   4.866   5.647
  343   2HG1  VAL  42          2HG1      VAL  42   0.134   4.860   4.700
  344   3HG1  VAL  42          3HG1      VAL  42  -1.077   6.138   4.432
  345   1HG2  VAL  42          1HG2      VAL  42  -1.885   2.145   3.144
  346   2HG2  VAL  42          2HG2      VAL  42  -0.314   2.518   3.903
  347   3HG2  VAL  42          3HG2      VAL  42  -1.803   2.500   4.884
  348    H    ASN  43           H        ASN  43  -2.770   5.356   1.172
  349    HA   ASN  43           HA       ASN  43  -4.996   3.939  -0.019
  350   1HB   ASN  43          1HB       ASN  43  -4.191   6.058  -0.975
  351   2HB   ASN  43          2HB       ASN  43  -2.579   5.355  -1.218
  352   1HD2  ASN  43          2HD2      ASN  43  -5.921   4.074  -1.936
  353   2HD2  ASN  43          1HD2      ASN  43  -5.598   3.929  -3.662
  354    H    ALA  44           H        ALA  44  -4.961   1.970   0.194
  355    HA   ALA  44           HA       ALA  44  -3.000   0.120   0.654
  356   1HB   ALA  44          1HB       ALA  44  -5.464  -0.297   0.753
  357   2HB   ALA  44          2HB       ALA  44  -5.510  -0.259  -1.021
  358   3HB   ALA  44          3HB       ALA  44  -4.635  -1.564  -0.193
  359    H    LYS  45           H        LYS  45  -4.175   1.180  -2.495
  360    HA   LYS  45           HA       LYS  45  -2.562  -0.795  -3.951
  361   1HB   LYS  45          1HB       LYS  45  -3.496   0.348  -5.934
  362   2HB   LYS  45          2HB       LYS  45  -4.759  -0.202  -4.813
  363   1HG   LYS  45          1HG       LYS  45  -5.091   2.041  -3.971
  364   2HG   LYS  45          2HG       LYS  45  -3.608   2.613  -4.764
  365   1HD   LYS  45          1HD       LYS  45  -5.448   3.310  -6.156
  366   2HD   LYS  45          2HD       LYS  45  -4.591   1.994  -6.989
  367   1HE   LYS  45          1HE       LYS  45  -6.295   0.373  -6.010
  368   2HE   LYS  45          2HE       LYS  45  -7.228   1.778  -5.450
  369   1HZ   LYS  45          1HZ       LYS  45  -6.524   1.223  -8.248
  370   2HZ   LYS  45          2HZ       LYS  45  -7.981   0.944  -7.539
  371   3HZ   LYS  45          3HZ       LYS  45  -7.428   2.490  -7.692
  372    H    SER  46           H        SER  46  -1.901   2.193  -2.501
  373    HA   SER  46           HA       SER  46   0.155   2.820  -4.529
  374   1HB   SER  46          1HB       SER  46  -1.551   4.549  -3.849
  375   2HB   SER  46          2HB       SER  46  -0.777   4.575  -2.252
  376    HG   SER  46           HG       SER  46  -0.004   6.160  -3.891
  377    H    ILE  47           H        ILE  47   1.870   4.097  -3.496
  378    HA   ILE  47           HA       ILE  47   3.920   2.555  -2.465
  379    HB   ILE  47           HB       ILE  47   4.010   4.757  -3.635
  380   1HG1  ILE  47          1HG1      ILE  47   5.989   3.774  -2.474
  381   2HG1  ILE  47          2HG1      ILE  47   6.021   5.540  -2.651
  382   1HG2  ILE  47          1HG2      ILE  47   2.290   5.932  -2.284
  383   2HG2  ILE  47          2HG2      ILE  47   3.376   5.904  -0.888
  384   3HG2  ILE  47          3HG2      ILE  47   3.814   6.856  -2.322
  385   1HD1  ILE  47          1HD1      ILE  47   5.284   5.813  -0.320
  386   2HD1  ILE  47          2HD1      ILE  47   5.244   4.044  -0.122
  387   3HD1  ILE  47          3HD1      ILE  47   6.792   4.870  -0.418
  388    H    MET  48           H        MET  48   1.878   4.862  -0.597
  389    HA   MET  48           HA       MET  48   3.242   4.234   1.856
  390   1HB   MET  48          1HB       MET  48   2.288   6.415   1.310
  391   2HB   MET  48          2HB       MET  48   0.655   5.738   1.326
  392   1HG   MET  48          1HG       MET  48   0.950   5.152   3.714
  393   2HG   MET  48          2HG       MET  48   2.649   5.640   3.639
  394   1HE   MET  48          1HE       MET  48  -0.146   7.599   1.813
  395   2HE   MET  48          2HE       MET  48  -1.045   6.948   3.209
  396   3HE   MET  48          3HE       MET  48  -0.756   8.700   3.074
  397    H    GLY  49           H        GLY  49   0.666   2.661   0.106
  398   1HA   GLY  49          1HA       GLY  49  -0.355   1.360   2.518
  399   2HA   GLY  49          2HA       GLY  49  -0.791   0.957   0.816
  400    H    LEU  50           H        LEU  50   1.434   0.343  -0.488
  401    HA   LEU  50           HA       LEU  50   2.401  -2.127   0.381
  402   1HB   LEU  50          1HB       LEU  50   3.086  -0.050  -1.595
  403   2HB   LEU  50          2HB       LEU  50   4.503  -0.953  -1.018
  404    HG   LEU  50           HG       LEU  50   2.003  -2.362  -2.005
  405   1HD1  LEU  50          1HD1      LEU  50   2.825  -0.850  -3.783
  406   2HD1  LEU  50          2HD1      LEU  50   4.461  -1.530  -3.601
  407   3HD1  LEU  50          3HD1      LEU  50   3.131  -2.556  -4.192
  408   1HD2  LEU  50          1HD2      LEU  50   4.944  -3.181  -1.817
  409   2HD2  LEU  50          2HD2      LEU  50   3.655  -3.699  -0.708
  410   3HD2  LEU  50          3HD2      LEU  50   3.613  -4.197  -2.412
  411    H    MET  51           H        MET  51   4.437   0.797   0.251
  412    HA   MET  51           HA       MET  51   6.513  -0.468   1.704
  413   1HB   MET  51          1HB       MET  51   6.820   1.283  -0.054
  414   2HB   MET  51          2HB       MET  51   6.039   2.458   1.025
  415   1HG   MET  51          1HG       MET  51   7.858   1.836   2.738
  416   2HG   MET  51          2HG       MET  51   8.707   1.071   1.386
  417   1HE   MET  51          1HE       MET  51   6.451   4.237   1.567
  418   2HE   MET  51          2HE       MET  51   7.441   4.352   3.046
  419   3HE   MET  51          3HE       MET  51   7.648   5.547   1.742
  420    H    SER  52           H        SER  52   4.052   1.997   2.613
  421    HA   SER  52           HA       SER  52   5.342   2.348   5.183
  422   1HB   SER  52          1HB       SER  52   2.644   3.401   4.305
  423   2HB   SER  52          2HB       SER  52   3.680   4.032   5.606
  424    HG   SER  52           HG       SER  52   5.262   4.433   3.899
  425    H    LEU  53           H        LEU  53   1.866   1.568   4.605
  426    HA   LEU  53           HA       LEU  53   1.764   0.584   7.351
  427   1HB   LEU  53          1HB       LEU  53  -0.320   0.941   5.221
  428   2HB   LEU  53          2HB       LEU  53  -0.632   0.179   6.796
  429    HG   LEU  53           HG       LEU  53  -1.125   2.501   7.027
  430   1HD1  LEU  53          1HD1      LEU  53   0.014   1.452   8.936
  431   2HD1  LEU  53          2HD1      LEU  53   1.593   1.917   8.253
  432   3HD1  LEU  53          3HD1      LEU  53   0.454   3.171   8.800
  433   1HD2  LEU  53          1HD2      LEU  53   0.287   3.195   5.054
  434   2HD2  LEU  53          2HD2      LEU  53   0.451   4.277   6.473
  435   3HD2  LEU  53          3HD2      LEU  53   1.715   3.073   6.107
  436    H    ALA  54           H        ALA  54   0.786  -0.829   4.260
  437    HA   ALA  54           HA       ALA  54   0.170  -3.431   5.202
  438   1HB   ALA  54          1HB       ALA  54  -0.832  -2.403   3.219
  439   2HB   ALA  54          2HB       ALA  54   0.762  -2.345   2.435
  440   3HB   ALA  54          3HB       ALA  54   0.002  -3.914   2.786
  441    H    VAL  55           H        VAL  55   3.275  -1.997   4.442
  442    HA   VAL  55           HA       VAL  55   4.643  -4.422   3.864
  443    HB   VAL  55           HB       VAL  55   5.446  -2.041   3.552
  444   1HG1  VAL  55          1HG2      VAL  55   4.859  -1.223   5.833
  445   2HG1  VAL  55          2HG2      VAL  55   6.076  -2.321   6.527
  446   3HG1  VAL  55          3HG2      VAL  55   6.579  -0.981   5.465
  447   1HG2  VAL  55          1HG1      VAL  55   6.919  -3.996   3.313
  448   2HG2  VAL  55          2HG1      VAL  55   7.798  -2.625   4.035
  449   3HG2  VAL  55          3HG1      VAL  55   7.247  -3.974   5.062
  450    H    SER  56           H        SER  56   3.186  -3.267   6.828
  451    HA   SER  56           HA       SER  56   5.119  -4.705   8.426
  452   1HB   SER  56          1HB       SER  56   2.474  -3.565   9.412
  453   2HB   SER  56          2HB       SER  56   3.983  -3.730  10.317
  454    HG   SER  56           HG       SER  56   3.399  -1.916   8.187
  455    H    THR  57           H        THR  57   4.649  -6.746   7.183
  456    HA   THR  57           HA       THR  57   2.540  -8.374   7.431
  457    HB   THR  57           HB       THR  57   5.168  -9.553   8.218
  458    HG1  THR  57           HG1      THR  57   5.982  -9.098   6.150
  459   1HG2  THR  57          1HG2      THR  57   3.191 -10.002   5.931
  460   2HG2  THR  57          2HG2      THR  57   4.528 -11.082   6.435
  461   3HG2  THR  57          3HG2      THR  57   3.128 -10.831   7.509
  462    H    GLY  58           H        GLY  58   1.266  -9.032   8.994
  463   1HA   GLY  58          1HA       GLY  58   0.933 -10.261  11.078
  464   2HA   GLY  58          2HA       GLY  58   2.382  -9.476  11.726
  465    H    THR  59           H        THR  59   1.033  -6.885  10.261
  466    HA   THR  59           HA       THR  59  -0.179  -6.054  12.820
  467    HB   THR  59           HB       THR  59  -0.071  -4.482  10.227
  468    HG1  THR  59           HG1      THR  59   2.033  -5.158  10.875
  469   1HG2  THR  59          1HG2      THR  59  -0.139  -3.614  13.147
  470   2HG2  THR  59          2HG2      THR  59  -0.190  -2.542  11.727
  471   3HG2  THR  59          3HG2      THR  59  -1.544  -3.649  12.056
  472    H    GLU  60           H        GLU  60  -2.416  -6.095  13.190
  473    HA   GLU  60           HA       GLU  60  -4.152  -7.048  11.058
  474   1HB   GLU  60          1HB       GLU  60  -4.969  -5.629  13.618
  475   2HB   GLU  60          2HB       GLU  60  -5.933  -6.755  12.615
  476   1HG   GLU  60          1HG       GLU  60  -3.352  -7.643  13.927
  477   2HG   GLU  60          2HG       GLU  60  -4.908  -7.710  14.772
  478    H    VAL  61           H        VAL  61  -4.573  -5.795   9.343
  479    HA   VAL  61           HA       VAL  61  -4.890  -2.875   9.795
  480    HB   VAL  61           HB       VAL  61  -3.854  -2.570   7.519
  481   1HG1  VAL  61          1HG1      VAL  61  -2.163  -4.030   9.595
  482   2HG1  VAL  61          2HG1      VAL  61  -1.528  -3.015   8.275
  483   3HG1  VAL  61          3HG1      VAL  61  -2.504  -2.281   9.570
  484   1HG2  VAL  61          1HG2      VAL  61  -4.200  -4.897   6.693
  485   2HG2  VAL  61          2HG2      VAL  61  -2.477  -4.413   6.643
  486   3HG2  VAL  61          3HG2      VAL  61  -3.063  -5.482   7.944
  487    H    THR  62           H        THR  62  -6.604  -1.935   8.820
  488    HA   THR  62           HA       THR  62  -8.584  -3.850   7.776
  489    HB   THR  62           HB       THR  62  -8.922  -0.856   8.161
  490    HG1  THR  62           HG1      THR  62  -8.382  -2.139  10.133
  491   1HG2  THR  62          1HG2      THR  62 -11.314  -1.481   8.270
  492   2HG2  THR  62          2HG2      THR  62 -10.605  -2.001   6.727
  493   3HG2  THR  62          3HG2      THR  62 -10.883  -3.186   8.026
  494    H    LEU  63           H        LEU  63  -8.894  -4.258   5.692
  495    HA   LEU  63           HA       LEU  63  -7.491  -2.661   3.690
  496   1HB   LEU  63          1HB       LEU  63  -7.549  -5.212   3.883
  497   2HB   LEU  63          2HB       LEU  63  -9.234  -5.125   3.328
  498    HG   LEU  63           HG       LEU  63  -7.546  -5.562   1.551
  499   1HD1  LEU  63          1HD2      LEU  63  -9.721  -4.529   1.008
  500   2HD1  LEU  63          2HD2      LEU  63  -9.012  -2.910   1.241
  501   3HD1  LEU  63          3HD2      LEU  63  -8.438  -3.952  -0.082
  502   1HD2  LEU  63          1HD1      LEU  63  -5.722  -4.159   2.460
  503   2HD2  LEU  63          2HD1      LEU  63  -6.098  -3.714   0.779
  504   3HD2  LEU  63          3HD1      LEU  63  -6.677  -2.695   2.116
  505    H    ILE  64           H        ILE  64  -8.451  -0.990   2.909
  506    HA   ILE  64           HA       ILE  64 -11.412  -0.702   2.876
  507    HB   ILE  64           HB       ILE  64  -9.202   1.375   2.509
  508   1HG1  ILE  64          1HG1      ILE  64 -10.831   0.703   4.964
  509   2HG1  ILE  64          2HG1      ILE  64  -9.067   0.529   4.804
  510   1HG2  ILE  64          1HG2      ILE  64 -12.183   1.636   3.052
  511   2HG2  ILE  64          2HG2      ILE  64 -11.030   2.991   2.973
  512   3HG2  ILE  64          3HG2      ILE  64 -11.358   2.011   1.521
  513   1HD1  ILE  64          1HD1      ILE  64 -10.651   3.138   4.634
  514   2HD1  ILE  64          2HD1      ILE  64  -9.786   2.549   6.075
  515   3HD1  ILE  64          3HD1      ILE  64  -8.874   2.989   4.601
  516    H    ALA  65           H        ALA  65 -12.356   0.208   0.977
  517    HA   ALA  65           HA       ALA  65 -10.769   0.887  -1.308
  518   1HB   ALA  65          1HB       ALA  65 -12.855  -1.341  -1.541
  519   2HB   ALA  65          2HB       ALA  65 -12.052  -0.530  -2.897
  520   3HB   ALA  65          3HB       ALA  65 -11.104  -1.560  -1.802
  521    H    GLN  66           H        GLN  66 -11.607   2.647  -1.964
  522    HA   GLN  66           HA       GLN  66 -14.514   3.101  -1.508
  523   1HB   GLN  66          1HB       GLN  66 -13.097   4.165   0.209
  524   2HB   GLN  66          2HB       GLN  66 -12.064   4.851  -1.053
  525   1HG   GLN  66          1HG       GLN  66 -14.563   5.641  -1.848
  526   2HG   GLN  66          2HG       GLN  66 -14.723   5.668  -0.071
  527   1HE2  GLN  66          2HE2      GLN  66 -12.617   6.659  -2.752
  528   2HE2  GLN  66          1HE2      GLN  66 -11.912   8.085  -1.980
  529    H    GLY  67           H        GLY  67 -14.407   2.160  -3.669
  530   1HA   GLY  67          1HA       GLY  67 -14.074   4.210  -5.798
  531   2HA   GLY  67          2HA       GLY  67 -13.263   2.664  -5.903
  532    H    GLU  68           H        GLU  68 -14.523   2.545  -7.841
  533    HA   GLU  68           HA       GLU  68 -17.288   1.950  -7.926
  534   1HB   GLU  68          1HB       GLU  68 -14.955   0.790  -9.511
  535   2HB   GLU  68          2HB       GLU  68 -16.659   0.759 -10.017
  536   1HG   GLU  68          1HG       GLU  68 -14.988   3.270  -9.529
  537   2HG   GLU  68          2HG       GLU  68 -15.429   2.616 -11.122
  538    H    ASP  69           H        ASP  69 -14.445  -0.038  -6.963
  539    HA   ASP  69           HA       ASP  69 -16.333  -2.276  -6.360
  540   1HB   ASP  69          1HB       ASP  69 -13.353  -2.545  -6.516
  541   2HB   ASP  69          2HB       ASP  69 -14.571  -3.806  -6.621
  542    H    GLU  70           H        GLU  70 -16.524  -0.213  -4.651
  543    HA   GLU  70           HA       GLU  70 -14.477   0.162  -2.763
  544   1HB   GLU  70          1HB       GLU  70 -16.463   1.622  -3.033
  545   2HB   GLU  70          2HB       GLU  70 -17.522   0.264  -2.615
  546   1HG   GLU  70          1HG       GLU  70 -15.781   0.424  -0.438
  547   2HG   GLU  70          2HG       GLU  70 -16.135   2.110  -0.855
  548    H    GLN  71           H        GLN  71 -17.484  -1.344  -1.698
  549    HA   GLN  71           HA       GLN  71 -16.517  -3.040   0.213
  550   1HB   GLN  71          1HB       GLN  71 -18.911  -2.991  -1.583
  551   2HB   GLN  71          2HB       GLN  71 -18.593  -4.503  -0.702
  552   1HG   GLN  71          1HG       GLN  71 -18.730  -1.762   0.606
  553   2HG   GLN  71          2HG       GLN  71 -20.043  -2.955   0.592
  554   1HE2  GLN  71          2HE2      GLN  71 -17.711  -5.126   0.727
  555   2HE2  GLN  71          1HE2      GLN  71 -17.442  -5.178   2.461
  556    H    GLU  72           H        GLU  72 -16.568  -3.666  -3.276
  557    HA   GLU  72           HA       GLU  72 -16.073  -6.467  -3.066
  558   1HB   GLU  72          1HB       GLU  72 -17.034  -5.342  -5.068
  559   2HB   GLU  72          2HB       GLU  72 -15.522  -4.423  -5.274
  560   1HG   GLU  72          1HG       GLU  72 -15.507  -6.237  -6.835
  561   2HG   GLU  72          2HG       GLU  72 -14.314  -6.576  -5.576
  562    H    ALA  73           H        ALA  73 -13.950  -3.590  -3.588
  563    HA   ALA  73           HA       ALA  73 -11.527  -5.090  -3.891
  564   1HB   ALA  73          1HB       ALA  73 -12.249  -2.247  -3.129
  565   2HB   ALA  73          2HB       ALA  73 -10.594  -2.739  -3.601
  566   3HB   ALA  73          3HB       ALA  73 -11.965  -2.827  -4.754
  567    H    LEU  74           H        LEU  74 -12.987  -3.264  -1.199
  568    HA   LEU  74           HA       LEU  74 -10.914  -3.776   0.667
  569   1HB   LEU  74          1HB       LEU  74 -12.573  -3.008   2.336
  570   2HB   LEU  74          2HB       LEU  74 -12.505  -1.999   0.871
  571    HG   LEU  74           HG       LEU  74 -14.424  -3.645   0.052
  572   1HD1  LEU  74          1HD1      LEU  74 -14.400  -4.969   2.141
  573   2HD1  LEU  74          2HD1      LEU  74 -14.767  -3.491   3.076
  574   3HD1  LEU  74          3HD1      LEU  74 -15.956  -4.129   1.911
  575   1HD2  LEU  74          1HD2      LEU  74 -14.499  -1.189   0.186
  576   2HD2  LEU  74          2HD2      LEU  74 -16.022  -1.921   0.728
  577   3HD2  LEU  74          3HD2      LEU  74 -14.862  -1.290   1.922
  578    H    GLU  75           H        GLU  75 -13.992  -5.628   0.081
  579    HA   GLU  75           HA       GLU  75 -13.418  -7.546   2.111
  580   1HB   GLU  75          1HB       GLU  75 -15.072  -7.828  -0.424
  581   2HB   GLU  75          2HB       GLU  75 -15.053  -8.969   0.940
  582   1HG   GLU  75          1HG       GLU  75 -15.886  -6.055   1.059
  583   2HG   GLU  75          2HG       GLU  75 -16.978  -7.452   1.100
  584    H    LYS  76           H        LYS  76 -12.903  -7.775  -1.499
  585    HA   LYS  76           HA       LYS  76 -11.810 -10.374  -1.357
  586   1HB   LYS  76          1HB       LYS  76 -10.749  -9.943  -3.458
  587   2HB   LYS  76          2HB       LYS  76 -12.421  -9.346  -3.511
  588   1HG   LYS  76          1HG       LYS  76 -11.671  -7.080  -3.487
  589   2HG   LYS  76          2HG       LYS  76 -10.046  -7.544  -2.904
  590   1HD   LYS  76          1HD       LYS  76  -9.715  -8.883  -5.019
  591   2HD   LYS  76          2HD       LYS  76 -11.231  -8.190  -5.634
  592   1HE   LYS  76          1HE       LYS  76 -10.272  -5.913  -5.364
  593   2HE   LYS  76          2HE       LYS  76  -8.730  -6.628  -4.839
  594   1HZ   LYS  76          1HZ       LYS  76 -10.065  -7.058  -7.429
  595   2HZ   LYS  76          2HZ       LYS  76  -8.803  -6.039  -7.171
  596   3HZ   LYS  76          3HZ       LYS  76  -8.590  -7.669  -7.012
  597    H    LEU  77           H        LEU  77 -10.137  -7.166  -1.073
  598    HA   LEU  77           HA       LEU  77  -7.657  -8.489  -0.805
  599   1HB   LEU  77          1HB       LEU  77  -8.429  -5.913  -1.269
  600   2HB   LEU  77          2HB       LEU  77  -7.759  -5.857   0.406
  601    HG   LEU  77           HG       LEU  77  -5.972  -7.525  -0.563
  602   1HD1  LEU  77          1HD2      LEU  77  -7.268  -6.248  -3.020
  603   2HD1  LEU  77          2HD2      LEU  77  -5.751  -7.196  -3.058
  604   3HD1  LEU  77          3HD2      LEU  77  -7.302  -7.985  -2.627
  605   1HD2  LEU  77          1HD1      LEU  77  -6.464  -4.706  -1.441
  606   2HD2  LEU  77          2HD1      LEU  77  -5.758  -5.251   0.119
  607   3HD2  LEU  77          3HD1      LEU  77  -4.836  -5.513  -1.426
  608    H    ALA  78           H        ALA  78  -9.879  -7.222   1.787
  609    HA   ALA  78           HA       ALA  78  -8.033  -7.938   3.862
  610   1HB   ALA  78          1HB       ALA  78 -11.071  -7.954   3.996
  611   2HB   ALA  78          2HB       ALA  78  -9.949  -8.049   5.374
  612   3HB   ALA  78          3HB       ALA  78  -9.998  -6.583   4.384
  613    H    ALA  79           H        ALA  79 -10.139  -9.885   1.774
  614    HA   ALA  79           HA       ALA  79  -9.904 -12.348   3.228
  615   1HB   ALA  79          1HB       ALA  79 -11.464 -11.906   1.292
  616   2HB   ALA  79          2HB       ALA  79 -10.024 -11.804   0.234
  617   3HB   ALA  79          3HB       ALA  79 -10.432 -13.340   1.035
  618    H    TYR  80           H        TYR  80  -8.023 -10.815   0.545
  619    HA   TYR  80           HA       TYR  80  -6.188 -12.973   0.285
  620   1HB   TYR  80          1HB       TYR  80  -6.831 -11.381  -1.443
  621   2HB   TYR  80          2HB       TYR  80  -6.091 -10.060  -0.536
  622    HD1  TYR  80           HD1      TYR  80  -4.888 -13.514  -1.403
  623    HD2  TYR  80           HD2      TYR  80  -4.047  -9.293  -1.291
  624    HE1  TYR  80           HE1      TYR  80  -2.461 -13.995  -1.523
  625    HE2  TYR  80           HE2      TYR  80  -1.608  -9.779  -1.472
  626    HH   TYR  80           HH       TYR  80  -0.391 -13.113  -1.190
  627    H    VAL  81           H        VAL  81  -5.643  -9.703   1.542
  628    HA   VAL  81           HA       VAL  81  -2.966  -9.704   2.035
  629    HB   VAL  81           HB       VAL  81  -3.410  -7.877   3.582
  630   1HG1  VAL  81          1HG1      VAL  81  -3.814  -7.609   1.109
  631   2HG1  VAL  81          2HG1      VAL  81  -5.519  -8.020   1.389
  632   3HG1  VAL  81          3HG1      VAL  81  -4.844  -6.536   2.099
  633   1HG2  VAL  81          1HG2      VAL  81  -5.218  -8.994   4.886
  634   2HG2  VAL  81          2HG2      VAL  81  -5.744  -7.399   4.296
  635   3HG2  VAL  81          3HG2      VAL  81  -6.291  -8.882   3.475
  636    H    GLN  82           H        GLN  82  -5.383 -11.133   4.151
  637    HA   GLN  82           HA       GLN  82  -3.406 -11.709   6.286
  638   1HB   GLN  82          1HB       GLN  82  -5.573 -12.344   7.469
  639   2HB   GLN  82          2HB       GLN  82  -5.679 -10.701   6.779
  640   1HG   GLN  82          1HG       GLN  82  -7.061 -11.485   5.034
  641   2HG   GLN  82          2HG       GLN  82  -6.325 -13.066   5.093
  642   1HE2  GLN  82          2HE2      GLN  82  -9.065 -11.885   5.306
  643   2HE2  GLN  82          1HE2      GLN  82  -9.868 -12.802   6.597
  644    H    GLU  83           H        GLU  83  -4.590 -13.176   3.534
  645    HA   GLU  83           HA       GLU  83  -5.831 -15.550   4.445
  646   1HB   GLU  83          1HB       GLU  83  -6.264 -14.146   2.501
  647   2HB   GLU  83          2HB       GLU  83  -4.777 -14.717   1.720
  648   1HG   GLU  83          1HG       GLU  83  -5.698 -17.029   1.693
  649   2HG   GLU  83          2HG       GLU  83  -7.176 -16.432   2.487
  650    H    GLU  84           H        GLU  84  -2.738 -15.242   2.608
  651    HA   GLU  84           HA       GLU  84  -2.243 -18.074   3.340
  652   1HB   GLU  84          1HB       GLU  84  -0.327 -17.851   1.690
  653   2HB   GLU  84          2HB       GLU  84  -1.940 -17.620   0.999
  654   1HG   GLU  84          1HG       GLU  84  -1.698 -15.199   1.079
  655   2HG   GLU  84          2HG       GLU  84  -0.115 -15.343   1.869
  656    H    VAL  85           H        VAL  85   0.718 -16.792   2.834
  657    HA   VAL  85           HA       VAL  85   1.340 -15.319   5.261
  658    HB   VAL  85           HB       VAL  85   3.064 -17.099   5.983
  659   1HG1  VAL  85          1HG1      VAL  85   0.137 -17.935   6.570
  660   2HG1  VAL  85          2HG1      VAL  85   1.576 -18.487   7.464
  661   3HG1  VAL  85          3HG1      VAL  85   1.115 -16.795   7.526
  662   1HG2  VAL  85          1HG2      VAL  85   2.882 -18.677   4.007
  663   2HG2  VAL  85          2HG2      VAL  85   2.651 -19.510   5.548
  664   3HG2  VAL  85          3HG2      VAL  85   1.242 -19.137   4.522
  Start of MODEL   18
    1   1H    VAL   2          1H        VAL   2 -15.988   6.277  -2.877
    2   2H    VAL   2          2H        VAL   2 -16.561   4.982  -3.783
    3   3H    VAL   2          3H        VAL   2 -17.532   6.333  -3.541
    4    HA   VAL   2           HA       VAL   2 -17.660   5.918  -1.231
    5    HB   VAL   2           HB       VAL   2 -18.981   3.835  -1.310
    6   1HG1  VAL   2          1HG2      VAL   2 -19.943   5.965  -2.109
    7   2HG1  VAL   2          2HG2      VAL   2 -19.316   5.641  -3.742
    8   3HG1  VAL   2          3HG2      VAL   2 -20.571   4.589  -3.048
    9   1HG2  VAL   2          1HG1      VAL   2 -17.901   3.604  -4.153
   10   2HG2  VAL   2          2HG1      VAL   2 -17.540   2.510  -2.802
   11   3HG2  VAL   2          3HG1      VAL   2 -19.197   2.607  -3.446
   12    H    GLN   3           H        GLN   3 -16.713   5.135   0.596
   13    HA   GLN   3           HA       GLN   3 -14.426   3.283   0.150
   14   1HB   GLN   3          1HB       GLN   3 -13.947   5.745   0.748
   15   2HB   GLN   3          2HB       GLN   3 -14.738   5.400   2.303
   16   1HG   GLN   3          1HG       GLN   3 -13.031   3.423   2.487
   17   2HG   GLN   3          2HG       GLN   3 -12.166   4.251   1.192
   18   1HE2  GLN   3          2HE2      GLN   3 -12.337   3.933   4.507
   19   2HE2  GLN   3          1HE2      GLN   3 -11.675   5.494   4.957
   20    H    GLN   4           H        GLN   4 -14.362   1.473   1.333
   21    HA   GLN   4           HA       GLN   4 -15.581   1.423   3.997
   22   1HB   GLN   4          1HB       GLN   4 -17.061   0.356   1.870
   23   2HB   GLN   4          2HB       GLN   4 -16.231  -1.057   2.547
   24   1HG   GLN   4          1HG       GLN   4 -17.900   0.951   4.125
   25   2HG   GLN   4          2HG       GLN   4 -18.424  -0.680   3.636
   26   1HE2  GLN   4          2HE2      GLN   4 -17.292  -2.529   4.531
   27   2HE2  GLN   4          1HE2      GLN   4 -16.207  -2.385   5.928
   28    H    LYS   5           H        LYS   5 -14.706  -0.658   5.192
   29    HA   LYS   5           HA       LYS   5 -12.460  -1.923   3.807
   30   1HB   LYS   5          1HB       LYS   5 -11.001  -1.438   5.750
   31   2HB   LYS   5          2HB       LYS   5 -11.420   0.003   4.811
   32   1HG   LYS   5          1HG       LYS   5 -13.031  -0.770   7.251
   33   2HG   LYS   5          2HG       LYS   5 -11.501   0.129   7.409
   34   1HD   LYS   5          1HD       LYS   5 -12.315   1.926   6.016
   35   2HD   LYS   5          2HD       LYS   5 -13.820   1.042   5.671
   36   1HE   LYS   5          1HE       LYS   5 -12.909   1.974   8.429
   37   2HE   LYS   5          2HE       LYS   5 -14.138   2.770   7.427
   38   1HZ   LYS   5          1HZ       LYS   5 -15.413   0.733   7.500
   39   2HZ   LYS   5          2HZ       LYS   5 -14.299   0.040   8.497
   40   3HZ   LYS   5          3HZ       LYS   5 -15.161   1.347   9.011
   41    H    VAL   6           H        VAL   6 -11.716  -3.779   4.843
   42    HA   VAL   6           HA       VAL   6 -13.311  -4.884   7.094
   43    HB   VAL   6           HB       VAL   6 -13.250  -7.100   5.901
   44   1HG1  VAL   6          1HG1      VAL   6 -15.280  -5.689   5.946
   45   2HG1  VAL   6          2HG1      VAL   6 -14.722  -4.840   4.485
   46   3HG1  VAL   6          3HG1      VAL   6 -15.145  -6.569   4.402
   47   1HG2  VAL   6          1HG2      VAL   6 -11.452  -6.557   4.272
   48   2HG2  VAL   6          2HG2      VAL   6 -12.938  -7.103   3.453
   49   3HG2  VAL   6          3HG2      VAL   6 -12.525  -5.373   3.492
   50    H    GLU   7           H        GLU   7 -11.843  -5.406   8.714
   51    HA   GLU   7           HA       GLU   7  -9.020  -5.358   7.901
   52   1HB   GLU   7          1HB       GLU   7  -9.779  -4.025   9.867
   53   2HB   GLU   7          2HB       GLU   7 -10.288  -5.525  10.681
   54   1HG   GLU   7          1HG       GLU   7  -8.031  -6.291  10.879
   55   2HG   GLU   7          2HG       GLU   7  -7.447  -5.067   9.740
   56    H    VAL   8           H        VAL   8  -7.465  -6.762   8.489
   57    HA   VAL   8           HA       VAL   8  -8.073  -9.496   9.336
   58    HB   VAL   8           HB       VAL   8  -6.864 -10.280   7.156
   59   1HG1  VAL   8          1HG1      VAL   8  -9.721  -9.256   7.203
   60   2HG1  VAL   8          2HG1      VAL   8  -9.037 -10.390   5.994
   61   3HG1  VAL   8          3HG1      VAL   8  -9.119 -10.869   7.704
   62   1HG2  VAL   8          1HG2      VAL   8  -8.016  -7.597   6.251
   63   2HG2  VAL   8          2HG2      VAL   8  -6.288  -8.024   6.311
   64   3HG2  VAL   8          3HG2      VAL   8  -7.365  -8.874   5.178
   65    H    ARG   9           H        ARG   9  -5.757 -10.759   8.951
   66    HA   ARG   9           HA       ARG   9  -3.857  -8.721   9.987
   67   1HB   ARG   9          1HB       ARG   9  -3.856 -10.670  11.373
   68   2HB   ARG   9          2HB       ARG   9  -3.555 -11.755   9.983
   69   1HG   ARG   9          1HG       ARG   9  -1.625  -9.495  10.383
   70   2HG   ARG   9          2HG       ARG   9  -1.569 -10.781  11.572
   71   1HD   ARG   9          1HD       ARG   9  -1.475 -11.185   8.523
   72   2HD   ARG   9          2HD       ARG   9  -0.070 -11.205   9.595
   73    HE   ARG   9           HE       ARG   9  -0.756 -13.260  10.507
   74   1HH1  ARG   9          1HH2      ARG   9  -3.066 -12.121   8.039
   75   2HH1  ARG   9          2HH2      ARG   9  -3.538 -13.739   7.592
   76   1HH2  ARG   9          2HH1      ARG   9  -1.509 -15.357   9.966
   77   2HH2  ARG   9          1HH1      ARG   9  -2.730 -15.560   8.737
   78    H    LEU  10           H        LEU  10  -2.459  -7.861   8.810
   79    HA   LEU  10           HA       LEU  10  -2.185  -8.189   6.003
   80   1HB   LEU  10          1HB       LEU  10  -1.938  -6.104   7.317
   81   2HB   LEU  10          2HB       LEU  10  -0.588  -6.815   8.209
   82    HG   LEU  10           HG       LEU  10   0.795  -6.820   6.168
   83   1HD1  LEU  10          1HD1      LEU  10  -1.640  -5.458   4.926
   84   2HD1  LEU  10          2HD1      LEU  10  -0.032  -5.619   4.177
   85   3HD1  LEU  10          3HD1      LEU  10  -1.014  -7.070   4.489
   86   1HD2  LEU  10          1HD2      LEU  10   0.706  -4.980   7.784
   87   2HD2  LEU  10          2HD2      LEU  10   1.034  -4.391   6.135
   88   3HD2  LEU  10          3HD2      LEU  10  -0.594  -4.197   6.842
   89    H    LYS  11           H        LYS  11  -1.793 -10.614   6.256
   90    HA   LYS  11           HA       LYS  11   0.787 -11.547   7.217
   91   1HB   LYS  11          1HB       LYS  11  -0.915 -13.070   7.457
   92   2HB   LYS  11          2HB       LYS  11  -1.694 -12.686   5.920
   93   1HG   LYS  11          1HG       LYS  11   0.992 -14.103   6.116
   94   2HG   LYS  11          2HG       LYS  11  -0.580 -14.937   6.020
   95   1HD   LYS  11          1HD       LYS  11   0.600 -13.073   3.921
   96   2HD   LYS  11          2HD       LYS  11   0.216 -14.803   3.776
   97   1HE   LYS  11          1HE       LYS  11  -2.168 -14.325   4.160
   98   2HE   LYS  11          2HE       LYS  11  -1.770 -12.576   4.261
   99   1HZ   LYS  11          1HZ       LYS  11  -1.298 -14.259   1.911
  100   2HZ   LYS  11          2HZ       LYS  11  -2.529 -13.173   2.090
  101   3HZ   LYS  11          3HZ       LYS  11  -0.976 -12.651   2.068
  102    H    THR  12           H        THR  12  -0.545 -10.326   4.162
  103    HA   THR  12           HA       THR  12   1.566 -11.171   2.443
  104    HB   THR  12           HB       THR  12   1.014  -8.855   1.356
  105    HG1  THR  12           HG1      THR  12  -0.965  -8.005   2.100
  106   1HG2  THR  12          1HG2      THR  12  -1.267 -10.854   1.666
  107   2HG2  THR  12          2HG2      THR  12  -0.985  -9.731   0.306
  108   3HG2  THR  12          3HG2      THR  12   0.136 -11.077   0.596
  109    H    GLY  13           H        GLY  13   1.075  -8.455   4.680
  110   1HA   GLY  13          1HA       GLY  13   2.374  -6.765   5.468
  111   2HA   GLY  13          2HA       GLY  13   3.662  -7.967   5.611
  112    H    LEU  14           H        LEU  14   2.165  -7.068   2.654
  113    HA   LEU  14           HA       LEU  14   3.112  -6.385   0.617
  114   1HB   LEU  14          1HB       LEU  14   2.935  -4.089   2.506
  115   2HB   LEU  14          2HB       LEU  14   3.070  -3.907   0.754
  116    HG   LEU  14           HG       LEU  14   0.703  -4.366   2.299
  117   1HD1  LEU  14          1HD1      LEU  14   1.049  -2.860   0.360
  118   2HD1  LEU  14          2HD1      LEU  14   1.135  -4.281  -0.711
  119   3HD1  LEU  14          3HD1      LEU  14  -0.371  -3.916   0.165
  120   1HD2  LEU  14          1HD2      LEU  14   1.218  -6.602   0.307
  121   2HD2  LEU  14          2HD2      LEU  14   0.857  -6.760   2.044
  122   3HD2  LEU  14          3HD2      LEU  14  -0.381  -6.134   0.933
  123    H    GLN  15           H        GLN  15   5.101  -7.653   1.015
  124    HA   GLN  15           HA       GLN  15   7.481  -5.962   1.590
  125   1HB   GLN  15          1HB       GLN  15   7.110  -8.945   1.190
  126   2HB   GLN  15          2HB       GLN  15   8.691  -8.173   1.491
  127   1HG   GLN  15          1HG       GLN  15   8.058  -7.452   3.659
  128   2HG   GLN  15          2HG       GLN  15   6.328  -7.568   3.282
  129   1HE2  GLN  15          1HE2      GLN  15   5.200  -9.450   3.653
  130   2HE2  GLN  15          2HE2      GLN  15   5.936 -10.944   4.130
  131    H    ALA  16           H        ALA  16   5.821  -7.769  -0.994
  132    HA   ALA  16           HA       ALA  16   6.696  -5.905  -2.946
  133   1HB   ALA  16          1HB       ALA  16   8.902  -6.916  -2.619
  134   2HB   ALA  16          2HB       ALA  16   8.233  -8.522  -2.999
  135   3HB   ALA  16          3HB       ALA  16   8.276  -7.256  -4.251
  136    H    ARG  17           H        ARG  17   6.110  -9.460  -2.741
  137    HA   ARG  17           HA       ARG  17   4.998  -9.407  -5.434
  138   1HB   ARG  17          1HB       ARG  17   4.962 -11.721  -3.464
  139   2HB   ARG  17          2HB       ARG  17   4.706 -11.770  -5.222
  140   1HG   ARG  17          1HG       ARG  17   6.948 -12.271  -5.264
  141   2HG   ARG  17          2HG       ARG  17   7.112 -10.503  -5.119
  142   1HD   ARG  17          1HD       ARG  17   6.951 -10.944  -2.545
  143   2HD   ARG  17          2HD       ARG  17   7.309 -12.623  -2.944
  144    HE   ARG  17           HE       ARG  17   9.383 -11.666  -4.117
  145   1HH1  ARG  17          2HH1      ARG  17   7.787 -10.115  -1.358
  146   2HH1  ARG  17          1HH1      ARG  17   9.231  -9.302  -0.802
  147   1HH2  ARG  17          1HH2      ARG  17  11.278 -10.596  -3.396
  148   2HH2  ARG  17          2HH2      ARG  17  11.246  -9.582  -1.979
  149    HA   PRO  18           HA       PRO  18   0.793 -10.133  -3.474
  150   1HB   PRO  18          1HB       PRO  18   0.464 -10.546  -0.799
  151   2HB   PRO  18          2HB       PRO  18   0.970 -11.897  -1.874
  152   1HG   PRO  18          1HG       PRO  18   2.820 -10.026  -0.313
  153   2HG   PRO  18          2HG       PRO  18   2.746 -11.819  -0.240
  154   1HD   PRO  18          1HD       PRO  18   4.506 -10.593  -1.882
  155   2HD   PRO  18          2HD       PRO  18   3.581 -12.008  -2.482
  156    H    ALA  19           H        ALA  19   3.191  -8.284  -1.710
  157    HA   ALA  19           HA       ALA  19   1.617  -6.268  -0.601
  158   1HB   ALA  19          1HB       ALA  19   4.113  -6.633  -0.591
  159   2HB   ALA  19          2HB       ALA  19   4.127  -6.071  -2.287
  160   3HB   ALA  19          3HB       ALA  19   3.652  -4.949  -0.970
  161    H    ALA  20           H        ALA  20   3.041  -6.361  -3.885
  162    HA   ALA  20           HA       ALA  20   1.431  -4.013  -4.755
  163   1HB   ALA  20          1HB       ALA  20   3.317  -5.910  -6.262
  164   2HB   ALA  20          2HB       ALA  20   2.609  -4.413  -6.910
  165   3HB   ALA  20          3HB       ALA  20   3.778  -4.337  -5.569
  166    H    LEU  21           H        LEU  21   1.380  -7.584  -5.032
  167    HA   LEU  21           HA       LEU  21  -0.644  -7.670  -7.023
  168   1HB   LEU  21          1HB       LEU  21   0.720  -9.582  -6.037
  169   2HB   LEU  21          2HB       LEU  21  -0.470  -9.644  -4.719
  170    HG   LEU  21           HG       LEU  21  -1.197  -9.709  -7.683
  171   1HD1  LEU  21          1HD1      LEU  21  -0.778 -12.029  -5.762
  172   2HD1  LEU  21          2HD1      LEU  21  -1.448 -12.159  -7.405
  173   3HD1  LEU  21          3HD1      LEU  21   0.236 -11.632  -7.170
  174   1HD2  LEU  21          1HD2      LEU  21  -3.012  -9.074  -6.113
  175   2HD2  LEU  21          2HD2      LEU  21  -3.317 -10.656  -6.864
  176   3HD2  LEU  21          3HD2      LEU  21  -2.726 -10.566  -5.186
  177    H    PHE  22           H        PHE  22  -0.849  -7.480  -3.481
  178    HA   PHE  22           HA       PHE  22  -3.564  -7.175  -2.906
  179   1HB   PHE  22          1HB       PHE  22  -1.825  -7.243  -1.208
  180   2HB   PHE  22          2HB       PHE  22  -0.973  -5.915  -1.971
  181    HD1  PHE  22           HD1      PHE  22  -1.309  -3.685  -1.477
  182    HD2  PHE  22           HD2      PHE  22  -4.045  -6.651   0.020
  183    HE1  PHE  22           HE1      PHE  22  -2.329  -1.981  -0.016
  184    HE2  PHE  22           HE2      PHE  22  -5.085  -4.942   1.484
  185    HZ   PHE  22           HZ       PHE  22  -4.224  -2.611   1.499
  186    H    VAL  23           H        VAL  23  -1.237  -4.484  -3.470
  187    HA   VAL  23           HA       VAL  23  -3.123  -2.466  -3.642
  188    HB   VAL  23           HB       VAL  23  -1.418  -1.105  -4.395
  189   1HG1  VAL  23          1HG1      VAL  23  -0.675  -2.080  -2.351
  190   2HG1  VAL  23          2HG1      VAL  23   0.180  -3.367  -3.240
  191   3HG1  VAL  23          3HG1      VAL  23   0.673  -1.663  -3.410
  192   1HG2  VAL  23          1HG2      VAL  23  -1.317  -2.030  -6.557
  193   2HG2  VAL  23          2HG2      VAL  23   0.304  -1.632  -5.943
  194   3HG2  VAL  23          3HG2      VAL  23  -0.270  -3.339  -5.993
  195    H    GLN  24           H        GLN  24  -1.961  -4.621  -6.157
  196    HA   GLN  24           HA       GLN  24  -3.100  -3.396  -8.457
  197   1HB   GLN  24          1HB       GLN  24  -1.070  -4.627  -8.538
  198   2HB   GLN  24          2HB       GLN  24  -1.796  -6.047  -7.770
  199   1HG   GLN  24          1HG       GLN  24  -3.038  -5.138 -10.310
  200   2HG   GLN  24          2HG       GLN  24  -1.410  -5.856 -10.421
  201   1HE2  GLN  24          2HE2      GLN  24  -4.790  -6.497  -9.760
  202   2HE2  GLN  24          1HE2      GLN  24  -4.593  -8.223  -9.431
  203    H    GLU  25           H        GLU  25  -4.237  -5.853  -6.159
  204    HA   GLU  25           HA       GLU  25  -6.460  -6.710  -7.834
  205   1HB   GLU  25          1HB       GLU  25  -5.929  -6.823  -4.814
  206   2HB   GLU  25          2HB       GLU  25  -7.254  -7.694  -5.630
  207   1HG   GLU  25          1HG       GLU  25  -4.333  -8.020  -6.358
  208   2HG   GLU  25          2HG       GLU  25  -5.150  -9.052  -5.158
  209    H    ALA  26           H        ALA  26  -5.937  -4.543  -5.105
  210    HA   ALA  26           HA       ALA  26  -8.507  -3.358  -4.875
  211   1HB   ALA  26          1HB       ALA  26  -5.712  -2.158  -4.664
  212   2HB   ALA  26          2HB       ALA  26  -7.184  -1.430  -3.984
  213   3HB   ALA  26          3HB       ALA  26  -6.584  -2.983  -3.346
  214    H    ASN  27           H        ASN  27  -5.650  -2.378  -6.683
  215    HA   ASN  27           HA       ASN  27  -6.341  -0.264  -8.223
  216   1HB   ASN  27          1HB       ASN  27  -4.555  -2.653  -8.336
  217   2HB   ASN  27          2HB       ASN  27  -5.030  -2.156  -9.930
  218   1HD2  ASN  27          2HD2      ASN  27  -3.725  -0.749  -6.878
  219   2HD2  ASN  27          1HD2      ASN  27  -2.724   0.480  -7.640
  220    H    ARG  28           H        ARG  28  -6.578  -3.655  -8.988
  221    HA   ARG  28           HA       ARG  28  -7.434  -3.725 -11.597
  222   1HB   ARG  28          1HB       ARG  28  -6.730  -5.379  -9.568
  223   2HB   ARG  28          2HB       ARG  28  -8.439  -5.818  -9.727
  224   1HG   ARG  28          1HG       ARG  28  -6.919  -5.504 -12.280
  225   2HG   ARG  28          2HG       ARG  28  -6.357  -6.784 -11.185
  226   1HD   ARG  28          1HD       ARG  28  -9.172  -6.367 -12.294
  227   2HD   ARG  28          2HD       ARG  28  -8.138  -7.782 -12.584
  228    HE   ARG  28           HE       ARG  28  -9.939  -7.348 -10.404
  229   1HH1  ARG  28          2HH1      ARG  28  -6.755  -8.682 -11.068
  230   2HH1  ARG  28          1HH1      ARG  28  -6.601  -9.510  -9.536
  231   1HH2  ARG  28          1HH2      ARG  28  -9.804  -8.441  -8.409
  232   2HH2  ARG  28          2HH2      ARG  28  -8.393  -9.408  -8.019
  233    H    PHE  29           H        PHE  29  -9.305  -2.823  -8.789
  234    HA   PHE  29           HA       PHE  29 -11.808  -3.233 -10.302
  235   1HB   PHE  29          1HB       PHE  29 -11.112  -2.442  -7.461
  236   2HB   PHE  29          2HB       PHE  29 -12.767  -2.369  -8.104
  237    HD1  PHE  29           HD1      PHE  29 -12.102  -4.080  -5.757
  238    HD2  PHE  29           HD2      PHE  29 -11.787  -4.934  -9.963
  239    HE1  PHE  29           HE1      PHE  29 -12.351  -6.514  -5.291
  240    HE2  PHE  29           HE2      PHE  29 -12.134  -7.351  -9.505
  241    HZ   PHE  29           HZ       PHE  29 -12.425  -8.138  -7.157
  242    H    THR  30           H        THR  30 -11.049  -0.500  -8.186
  243    HA   THR  30           HA       THR  30 -10.667   1.428 -10.292
  244    HB   THR  30           HB       THR  30 -12.791   2.723  -9.601
  245    HG1  THR  30           HG1      THR  30 -13.721   0.100  -9.012
  246   1HG2  THR  30          1HG2      THR  30 -14.238   1.532 -11.249
  247   2HG2  THR  30          2HG2      THR  30 -12.585   1.828 -11.839
  248   3HG2  THR  30          3HG2      THR  30 -13.041   0.207 -11.282
  249    H    SER  31           H        SER  31 -12.239   1.026  -7.231
  250    HA   SER  31           HA       SER  31 -12.042   2.931  -5.595
  251   1HB   SER  31          1HB       SER  31 -10.874   0.239  -4.885
  252   2HB   SER  31          2HB       SER  31 -11.825   1.320  -3.833
  253    HG   SER  31           HG       SER  31 -13.047  -0.434  -4.851
  254    H    ASP  32           H        ASP  32 -10.953   4.284  -4.520
  255    HA   ASP  32           HA       ASP  32  -8.028   4.351  -4.659
  256   1HB   ASP  32          1HB       ASP  32  -9.626   6.358  -4.621
  257   2HB   ASP  32          2HB       ASP  32  -9.938   5.917  -2.918
  258    H    VAL  33           H        VAL  33  -7.614   2.367  -3.812
  259    HA   VAL  33           HA       VAL  33  -8.922   1.318  -1.493
  260    HB   VAL  33           HB       VAL  33  -6.503   0.406  -3.074
  261   1HG1  VAL  33          1HG1      VAL  33  -8.295  -1.131  -1.147
  262   2HG1  VAL  33          2HG1      VAL  33  -7.002  -1.832  -2.156
  263   3HG1  VAL  33          3HG1      VAL  33  -6.597  -0.680  -0.861
  264   1HG2  VAL  33          1HG2      VAL  33  -9.503  -0.166  -3.201
  265   2HG2  VAL  33          2HG2      VAL  33  -8.563   0.813  -4.335
  266   3HG2  VAL  33          3HG2      VAL  33  -8.266  -0.934  -4.243
  267    H    PHE  34           H        PHE  34  -8.075   0.703   0.510
  268    HA   PHE  34           HA       PHE  34  -5.701   2.231   1.394
  269   1HB   PHE  34          1HB       PHE  34  -8.297   2.244   2.964
  270   2HB   PHE  34          2HB       PHE  34  -6.750   2.954   3.410
  271    HD1  PHE  34           HD1      PHE  34  -9.238   4.477   3.564
  272    HD2  PHE  34           HD2      PHE  34  -6.570   3.940   0.225
  273    HE1  PHE  34           HE1      PHE  34 -10.018   6.619   2.593
  274    HE2  PHE  34           HE2      PHE  34  -7.443   6.033  -0.795
  275    HZ   PHE  34           HZ       PHE  34  -9.074   7.428   0.438
  276    H    LEU  35           H        LEU  35  -4.910   1.512   3.494
  277    HA   LEU  35           HA       LEU  35  -5.869  -1.112   4.459
  278   1HB   LEU  35          1HB       LEU  35  -4.102  -1.579   2.781
  279   2HB   LEU  35          2HB       LEU  35  -2.962  -0.563   3.692
  280    HG   LEU  35           HG       LEU  35  -4.418  -2.894   4.986
  281   1HD1  LEU  35          1HD2      LEU  35  -1.762  -2.946   3.499
  282   2HD1  LEU  35          2HD2      LEU  35  -2.446  -4.282   4.460
  283   3HD1  LEU  35          3HD2      LEU  35  -3.265  -3.740   2.977
  284   1HD2  LEU  35          1HD1      LEU  35  -1.756  -1.484   5.504
  285   2HD2  LEU  35          2HD1      LEU  35  -3.250  -1.249   6.443
  286   3HD2  LEU  35          3HD1      LEU  35  -2.425  -2.825   6.471
  287    H    GLU  36           H        GLU  36  -6.019  -0.911   6.671
  288    HA   GLU  36           HA       GLU  36  -4.461   1.366   7.849
  289   1HB   GLU  36          1HB       GLU  36  -6.954   0.802   9.203
  290   2HB   GLU  36          2HB       GLU  36  -6.337   2.322   8.576
  291   1HG   GLU  36          1HG       GLU  36  -7.242   1.893   6.405
  292   2HG   GLU  36          2HG       GLU  36  -7.523   0.199   6.759
  293    H    LYS  37           H        LYS  37  -2.990   0.564   9.286
  294    HA   LYS  37           HA       LYS  37  -3.171  -2.078  10.493
  295   1HB   LYS  37          1HB       LYS  37  -1.445   0.351  11.095
  296   2HB   LYS  37          2HB       LYS  37  -1.248  -1.243  11.848
  297   1HG   LYS  37          1HG       LYS  37  -0.890  -2.250   9.583
  298   2HG   LYS  37          2HG       LYS  37  -0.956  -0.618   8.880
  299   1HD   LYS  37          1HD       LYS  37   1.415  -1.347   9.373
  300   2HD   LYS  37          2HD       LYS  37   0.933   0.105  10.275
  301   1HE   LYS  37          1HE       LYS  37   0.432  -1.307  12.258
  302   2HE   LYS  37          2HE       LYS  37   0.913  -2.756  11.342
  303   1HZ   LYS  37          1HZ       LYS  37   3.072  -1.760  11.071
  304   2HZ   LYS  37          2HZ       LYS  37   2.643  -0.489  12.030
  305   3HZ   LYS  37          3HZ       LYS  37   2.704  -2.012  12.664
  306    H    ASP  38           H        ASP  38  -4.995  -2.338  11.719
  307    HA   ASP  38           HA       ASP  38  -6.574  -2.001  13.322
  308   1HB   ASP  38          1HB       ASP  38  -4.186  -0.834  14.779
  309   2HB   ASP  38          2HB       ASP  38  -5.690  -1.390  15.542
  310    H    GLY  39           H        GLY  39  -6.240   0.137  11.315
  311   1HA   GLY  39          1HA       GLY  39  -7.843   2.102  11.495
  312   2HA   GLY  39          2HA       GLY  39  -7.022   2.446  13.033
  313    H    LYS  40           H        LYS  40  -4.303   1.683  11.769
  314    HA   LYS  40           HA       LYS  40  -3.667   4.366  10.885
  315   1HB   LYS  40          1HB       LYS  40  -1.945   1.872  10.719
  316   2HB   LYS  40          2HB       LYS  40  -1.412   3.563  10.787
  317   1HG   LYS  40          1HG       LYS  40  -2.584   3.640  13.111
  318   2HG   LYS  40          2HG       LYS  40  -2.670   1.866  12.982
  319   1HD   LYS  40          1HD       LYS  40  -0.657   2.426  14.215
  320   2HD   LYS  40          2HD       LYS  40  -0.166   1.850  12.605
  321   1HE   LYS  40          1HE       LYS  40   0.000   4.220  11.838
  322   2HE   LYS  40          2HE       LYS  40  -0.473   4.767  13.459
  323   1HZ   LYS  40          1HZ       LYS  40   1.500   3.692  14.313
  324   2HZ   LYS  40          2HZ       LYS  40   1.947   3.237  12.791
  325   3HZ   LYS  40          3HZ       LYS  40   1.877   4.834  13.189
  326    H    LYS  41           H        LYS  41  -5.251   4.327   9.085
  327    HA   LYS  41           HA       LYS  41  -4.627   2.506   6.924
  328   1HB   LYS  41          1HB       LYS  41  -6.705   2.703   6.567
  329   2HB   LYS  41          2HB       LYS  41  -6.890   3.971   7.751
  330   1HG   LYS  41          1HG       LYS  41  -6.164   4.291   4.771
  331   2HG   LYS  41          2HG       LYS  41  -7.804   4.436   5.412
  332   1HD   LYS  41          1HD       LYS  41  -7.142   6.414   6.713
  333   2HD   LYS  41          2HD       LYS  41  -5.444   6.211   6.216
  334   1HE   LYS  41          1HE       LYS  41  -7.794   6.636   4.320
  335   2HE   LYS  41          2HE       LYS  41  -6.645   7.904   4.814
  336   1HZ   LYS  41          1HZ       LYS  41  -5.992   5.441   3.343
  337   2HZ   LYS  41          2HZ       LYS  41  -6.090   6.950   2.703
  338   3HZ   LYS  41          3HZ       LYS  41  -4.908   6.600   3.804
  339    H    VAL  42           H        VAL  42  -4.158   2.892   4.906
  340    HA   VAL  42           HA       VAL  42  -3.101   5.494   3.989
  341    HB   VAL  42           HB       VAL  42  -1.256   4.314   5.078
  342   1HG1  VAL  42          1HG2      VAL  42  -2.180   2.042   4.893
  343   2HG1  VAL  42          2HG2      VAL  42  -1.935   2.067   3.134
  344   3HG1  VAL  42          3HG2      VAL  42  -0.526   2.079   4.232
  345   1HG2  VAL  42          1HG1      VAL  42  -0.713   5.642   3.139
  346   2HG2  VAL  42          2HG1      VAL  42   0.356   4.219   3.271
  347   3HG2  VAL  42          3HG1      VAL  42  -0.973   4.223   2.085
  348    H    ASN  43           H        ASN  43  -2.328   5.101   1.630
  349    HA   ASN  43           HA       ASN  43  -4.689   4.011   0.252
  350   1HB   ASN  43          1HB       ASN  43  -3.532   6.235  -0.316
  351   2HB   ASN  43          2HB       ASN  43  -2.208   5.254  -0.994
  352   1HD2  ASN  43          2HD2      ASN  43  -5.043   6.872  -1.700
  353   2HD2  ASN  43          1HD2      ASN  43  -5.488   6.047  -3.174
  354    H    ALA  44           H        ALA  44  -4.699   1.996   0.378
  355    HA   ALA  44           HA       ALA  44  -2.665   0.107   0.554
  356   1HB   ALA  44          1HB       ALA  44  -5.464  -0.092  -0.630
  357   2HB   ALA  44          2HB       ALA  44  -4.476  -1.489  -0.167
  358   3HB   ALA  44          3HB       ALA  44  -5.037  -0.344   1.078
  359    H    LYS  45           H        LYS  45  -4.285   1.443  -2.299
  360    HA   LYS  45           HA       LYS  45  -3.007  -0.518  -4.087
  361   1HB   LYS  45          1HB       LYS  45  -4.156   0.802  -5.866
  362   2HB   LYS  45          2HB       LYS  45  -5.255   0.119  -4.649
  363   1HG   LYS  45          1HG       LYS  45  -5.512   2.262  -3.561
  364   2HG   LYS  45          2HG       LYS  45  -4.158   2.947  -4.449
  365   1HD   LYS  45          1HD       LYS  45  -6.851   2.119  -5.654
  366   2HD   LYS  45          2HD       LYS  45  -6.187   3.760  -5.476
  367   1HE   LYS  45          1HE       LYS  45  -4.995   1.523  -7.172
  368   2HE   LYS  45          2HE       LYS  45  -5.911   2.917  -7.782
  369   1HZ   LYS  45          1HZ       LYS  45  -4.197   4.336  -6.882
  370   2HZ   LYS  45          2HZ       LYS  45  -3.344   3.028  -6.350
  371   3HZ   LYS  45          3HZ       LYS  45  -3.570   3.264  -7.962
  372    H    SER  46           H        SER  46  -2.072   2.389  -2.629
  373    HA   SER  46           HA       SER  46  -0.241   3.136  -4.836
  374   1HB   SER  46          1HB       SER  46  -1.169   4.548  -2.316
  375   2HB   SER  46          2HB       SER  46   0.095   5.169  -3.394
  376    HG   SER  46           HG       SER  46  -2.622   4.611  -4.039
  377    H    ILE  47           H        ILE  47   1.868   3.778  -4.328
  378    HA   ILE  47           HA       ILE  47   3.615   2.077  -3.261
  379    HB   ILE  47           HB       ILE  47   4.069   4.082  -4.604
  380   1HG1  ILE  47          1HG1      ILE  47   5.864   2.760  -3.399
  381   2HG1  ILE  47          2HG1      ILE  47   6.289   4.414  -3.888
  382   1HG2  ILE  47          1HG2      ILE  47   2.787   5.740  -3.275
  383   2HG2  ILE  47          2HG2      ILE  47   3.965   5.584  -1.959
  384   3HG2  ILE  47          3HG2      ILE  47   4.471   6.269  -3.519
  385   1HD1  ILE  47          1HD1      ILE  47   5.855   5.220  -1.599
  386   2HD1  ILE  47          2HD1      ILE  47   5.445   3.564  -1.094
  387   3HD1  ILE  47          3HD1      ILE  47   7.100   3.950  -1.620
  388    H    MET  48           H        MET  48   2.524   4.905  -1.268
  389    HA   MET  48           HA       MET  48   3.938   3.871   1.031
  390   1HB   MET  48          1HB       MET  48   3.727   6.241   0.602
  391   2HB   MET  48          2HB       MET  48   1.958   6.146   0.697
  392   1HG   MET  48          1HG       MET  48   2.114   5.454   3.049
  393   2HG   MET  48          2HG       MET  48   3.874   5.322   2.920
  394   1HE   MET  48          1HE       MET  48   5.534   7.214   2.903
  395   2HE   MET  48          2HE       MET  48   4.790   7.850   1.413
  396   3HE   MET  48          3HE       MET  48   5.118   8.943   2.782
  397    H    GLY  49           H        GLY  49   0.741   3.287  -0.277
  398   1HA   GLY  49          1HA       GLY  49  -0.458   2.603   2.299
  399   2HA   GLY  49          2HA       GLY  49  -1.104   2.247   0.674
  400    H    LEU  50           H        LEU  50   0.932   0.976  -0.550
  401    HA   LEU  50           HA       LEU  50   0.858  -1.666   0.509
  402   1HB   LEU  50          1HB       LEU  50   0.869  -1.698  -1.745
  403   2HB   LEU  50          2HB       LEU  50   1.678  -0.129  -1.852
  404    HG   LEU  50           HG       LEU  50   3.856  -1.138  -1.584
  405   1HD1  LEU  50          1HD2      LEU  50   2.321  -3.753  -1.412
  406   2HD1  LEU  50          2HD2      LEU  50   4.100  -3.591  -1.484
  407   3HD1  LEU  50          3HD2      LEU  50   3.200  -2.968  -0.078
  408   1HD2  LEU  50          1HD1      LEU  50   2.810  -1.039  -3.852
  409   2HD2  LEU  50          2HD1      LEU  50   3.930  -2.412  -3.682
  410   3HD2  LEU  50          3HD1      LEU  50   2.172  -2.684  -3.600
  411    H    MET  51           H        MET  51   3.743   0.340  -0.281
  412    HA   MET  51           HA       MET  51   5.457  -1.505   1.093
  413   1HB   MET  51          1HB       MET  51   6.169  -0.339  -0.885
  414   2HB   MET  51          2HB       MET  51   5.882   1.249  -0.153
  415   1HG   MET  51          1HG       MET  51   7.809  -0.685   1.135
  416   2HG   MET  51          2HG       MET  51   8.306   0.238  -0.288
  417   1HE   MET  51          1HE       MET  51   8.536   2.769  -0.456
  418   2HE   MET  51          2HE       MET  51   6.846   2.985   0.069
  419   3HE   MET  51          3HE       MET  51   8.151   3.915   0.855
  420    H    SER  52           H        SER  52   4.017   1.649   2.005
  421    HA   SER  52           HA       SER  52   5.788   1.737   4.304
  422   1HB   SER  52          1HB       SER  52   3.366   3.461   3.729
  423   2HB   SER  52          2HB       SER  52   4.712   3.822   4.846
  424    HG   SER  52           HG       SER  52   6.003   3.425   2.753
  425    H    LEU  53           H        LEU  53   2.140   1.814   4.309
  426    HA   LEU  53           HA       LEU  53   2.315   0.773   7.022
  427   1HB   LEU  53          1HB       LEU  53  -0.034   1.443   5.220
  428   2HB   LEU  53          2HB       LEU  53  -0.173   0.896   6.903
  429    HG   LEU  53           HG       LEU  53   1.275   2.816   7.624
  430   1HD1  LEU  53          1HD2      LEU  53   0.796   3.772   4.764
  431   2HD1  LEU  53          2HD2      LEU  53   1.469   4.752   6.089
  432   3HD1  LEU  53          3HD2      LEU  53   2.377   3.351   5.468
  433   1HD2  LEU  53          1HD1      LEU  53  -1.256   3.395   6.064
  434   2HD2  LEU  53          2HD1      LEU  53  -1.162   2.860   7.767
  435   3HD2  LEU  53          3HD1      LEU  53  -0.546   4.475   7.296
  436    H    ALA  54           H        ALA  54   0.919  -0.447   3.972
  437    HA   ALA  54           HA       ALA  54  -0.027  -2.909   4.879
  438   1HB   ALA  54          1HB       ALA  54  -0.560  -1.793   2.697
  439   2HB   ALA  54          2HB       ALA  54   1.063  -2.224   2.129
  440   3HB   ALA  54          3HB       ALA  54  -0.103  -3.502   2.512
  441    H    VAL  55           H        VAL  55   3.305  -1.965   4.467
  442    HA   VAL  55           HA       VAL  55   4.313  -4.622   4.108
  443    HB   VAL  55           HB       VAL  55   5.459  -2.394   3.569
  444   1HG1  VAL  55          1HG1      VAL  55   5.151  -1.343   5.804
  445   2HG1  VAL  55          2HG1      VAL  55   6.159  -2.619   6.532
  446   3HG1  VAL  55          3HG1      VAL  55   6.869  -1.471   5.370
  447   1HG2  VAL  55          1HG2      VAL  55   6.926  -4.550   5.133
  448   2HG2  VAL  55          2HG2      VAL  55   6.543  -4.586   3.396
  449   3HG2  VAL  55          3HG2      VAL  55   7.689  -3.375   4.029
  450    H    SER  56           H        SER  56   2.707  -3.338   6.784
  451    HA   SER  56           HA       SER  56   4.463  -4.518   8.752
  452   1HB   SER  56          1HB       SER  56   1.580  -3.580   9.023
  453   2HB   SER  56          2HB       SER  56   2.728  -3.819  10.350
  454    HG   SER  56           HG       SER  56   2.913  -1.931   8.204
  455    H    THR  57           H        THR  57   4.405  -6.625   7.372
  456    HA   THR  57           HA       THR  57   2.432  -8.459   7.339
  457    HB   THR  57           HB       THR  57   5.147  -9.305   8.313
  458    HG1  THR  57           HG1      THR  57   5.724  -9.006   5.993
  459   1HG2  THR  57          1HG2      THR  57   4.740 -11.021   6.538
  460   2HG2  THR  57          2HG2      THR  57   3.404 -10.955   7.713
  461   3HG2  THR  57          3HG2      THR  57   3.218 -10.198   6.116
  462    H    GLY  58           H        GLY  58   1.036  -9.089   8.791
  463   1HA   GLY  58          1HA       GLY  58   0.559 -10.561  10.675
  464   2HA   GLY  58          2HA       GLY  58   2.002  -9.943  11.483
  465    H    THR  59           H        THR  59   0.641  -7.179  10.191
  466    HA   THR  59           HA       THR  59  -0.593  -6.712  12.820
  467    HB   THR  59           HB       THR  59  -0.415  -4.721  10.514
  468    HG1  THR  59           HG1      THR  59   1.663  -5.577  10.941
  469   1HG2  THR  59          1HG2      THR  59  -0.352  -3.049  12.341
  470   2HG2  THR  59          2HG2      THR  59  -1.786  -4.089  12.489
  471   3HG2  THR  59          3HG2      THR  59  -0.377  -4.360  13.542
  472    H    GLU  60           H        GLU  60  -2.836  -6.424  13.142
  473    HA   GLU  60           HA       GLU  60  -4.512  -7.300  10.924
  474   1HB   GLU  60          1HB       GLU  60  -5.507  -5.945  13.444
  475   2HB   GLU  60          2HB       GLU  60  -6.337  -7.117  12.373
  476   1HG   GLU  60          1HG       GLU  60  -3.899  -7.833  14.040
  477   2HG   GLU  60          2HG       GLU  60  -5.575  -8.081  14.574
  478    H    VAL  61           H        VAL  61  -4.820  -5.987   9.256
  479    HA   VAL  61           HA       VAL  61  -5.140  -3.076   9.785
  480    HB   VAL  61           HB       VAL  61  -4.075  -2.708   7.531
  481   1HG1  VAL  61          1HG1      VAL  61  -2.424  -4.280   9.560
  482   2HG1  VAL  61          2HG1      VAL  61  -1.755  -3.263   8.262
  483   3HG1  VAL  61          3HG1      VAL  61  -2.698  -2.521   9.573
  484   1HG2  VAL  61          1HG2      VAL  61  -4.485  -4.996   6.635
  485   2HG2  VAL  61          2HG2      VAL  61  -2.754  -4.538   6.577
  486   3HG2  VAL  61          3HG2      VAL  61  -3.341  -5.636   7.851
  487    H    THR  62           H        THR  62  -6.852  -2.117   8.795
  488    HA   THR  62           HA       THR  62  -8.832  -4.012   7.722
  489    HB   THR  62           HB       THR  62  -9.164  -1.018   8.133
  490    HG1  THR  62           HG1      THR  62  -8.578  -2.310  10.100
  491   1HG2  THR  62          1HG2      THR  62 -11.546  -1.670   8.332
  492   2HG2  THR  62          2HG2      THR  62 -10.892  -2.177   6.762
  493   3HG2  THR  62          3HG2      THR  62 -11.108  -3.373   8.065
  494    H    LEU  63           H        LEU  63  -9.094  -4.364   5.619
  495    HA   LEU  63           HA       LEU  63  -7.604  -2.716   3.707
  496   1HB   LEU  63          1HB       LEU  63  -8.451  -5.449   3.894
  497   2HB   LEU  63          2HB       LEU  63  -9.236  -4.731   2.465
  498    HG   LEU  63           HG       LEU  63  -6.986  -5.631   1.905
  499   1HD1  LEU  63          1HD1      LEU  63  -7.133  -2.576   1.935
  500   2HD1  LEU  63          2HD1      LEU  63  -6.095  -3.556   0.873
  501   3HD1  LEU  63          3HD1      LEU  63  -7.862  -3.642   0.711
  502   1HD2  LEU  63          1HD2      LEU  63  -6.008  -5.347   4.168
  503   2HD2  LEU  63          2HD2      LEU  63  -4.985  -4.563   2.944
  504   3HD2  LEU  63          3HD2      LEU  63  -6.058  -3.582   3.970
  505    H    ILE  64           H        ILE  64  -8.439  -0.991   2.966
  506    HA   ILE  64           HA       ILE  64 -11.392  -0.615   2.859
  507    HB   ILE  64           HB       ILE  64  -9.086   1.363   2.583
  508   1HG1  ILE  64          1HG1      ILE  64 -10.901   0.877   4.967
  509   2HG1  ILE  64          2HG1      ILE  64  -9.143   0.569   4.897
  510   1HG2  ILE  64          1HG2      ILE  64 -12.072   1.805   2.933
  511   2HG2  ILE  64          2HG2      ILE  64 -10.831   3.086   2.881
  512   3HG2  ILE  64          3HG2      ILE  64 -11.136   2.081   1.445
  513   1HD1  ILE  64          1HD1      ILE  64 -10.513   3.254   4.432
  514   2HD1  ILE  64          2HD1      ILE  64  -9.701   2.779   5.946
  515   3HD1  ILE  64          3HD1      ILE  64  -8.756   2.964   4.438
  516    H    ALA  65           H        ALA  65 -12.271   0.304   0.961
  517    HA   ALA  65           HA       ALA  65 -10.585   1.026  -1.268
  518   1HB   ALA  65          1HB       ALA  65 -12.738  -1.155  -1.568
  519   2HB   ALA  65          2HB       ALA  65 -11.822  -0.419  -2.903
  520   3HB   ALA  65          3HB       ALA  65 -10.990  -1.463  -1.724
  521    H    GLN  66           H        GLN  66 -11.090   2.694  -2.039
  522    HA   GLN  66           HA       GLN  66 -13.886   3.466  -1.602
  523   1HB   GLN  66          1HB       GLN  66 -13.147   5.064  -0.235
  524   2HB   GLN  66          2HB       GLN  66 -11.737   4.090  -0.123
  525   1HG   GLN  66          1HG       GLN  66 -10.484   5.818  -0.685
  526   2HG   GLN  66          2HG       GLN  66 -11.177   5.716  -2.315
  527   1HE2  GLN  66          2HE2      GLN  66 -12.009   7.082   0.986
  528   2HE2  GLN  66          1HE2      GLN  66 -12.733   8.524   0.312
  529    H    GLY  67           H        GLY  67 -13.986   2.554  -3.735
  530   1HA   GLY  67          1HA       GLY  67 -13.816   4.728  -5.723
  531   2HA   GLY  67          2HA       GLY  67 -13.022   3.182  -6.108
  532    H    GLU  68           H        GLU  68 -14.403   2.487  -7.766
  533    HA   GLU  68           HA       GLU  68 -17.289   2.587  -7.403
  534   1HB   GLU  68          1HB       GLU  68 -15.654   1.108  -9.489
  535   2HB   GLU  68          2HB       GLU  68 -17.378   1.547  -9.565
  536   1HG   GLU  68          1HG       GLU  68 -14.992   3.439  -9.573
  537   2HG   GLU  68          2HG       GLU  68 -16.097   3.122 -10.926
  538    H    ASP  69           H        ASP  69 -14.623   0.317  -6.666
  539    HA   ASP  69           HA       ASP  69 -16.691  -1.793  -6.138
  540   1HB   ASP  69          1HB       ASP  69 -13.757  -2.239  -6.590
  541   2HB   ASP  69          2HB       ASP  69 -15.040  -3.441  -6.481
  542    H    GLU  70           H        GLU  70 -16.592   0.184  -4.300
  543    HA   GLU  70           HA       GLU  70 -14.510   0.347  -2.478
  544   1HB   GLU  70          1HB       GLU  70 -16.461   1.791  -2.489
  545   2HB   GLU  70          2HB       GLU  70 -17.537   0.391  -2.257
  546   1HG   GLU  70          1HG       GLU  70 -16.102   0.084  -0.043
  547   2HG   GLU  70          2HG       GLU  70 -15.849   1.831  -0.258
  548    H    GLN  71           H        GLN  71 -17.467  -1.342  -1.538
  549    HA   GLN  71           HA       GLN  71 -16.424  -3.058   0.349
  550   1HB   GLN  71          1HB       GLN  71 -18.832  -3.080  -1.446
  551   2HB   GLN  71          2HB       GLN  71 -18.436  -4.562  -0.548
  552   1HG   GLN  71          1HG       GLN  71 -18.739  -1.814   0.715
  553   2HG   GLN  71          2HG       GLN  71 -19.945  -3.116   0.768
  554   1HE2  GLN  71          2HE2      GLN  71 -17.578  -5.167   0.925
  555   2HE2  GLN  71          1HE2      GLN  71 -17.161  -5.074   2.629
  556    H    GLU  72           H        GLU  72 -16.732  -3.697  -3.144
  557    HA   GLU  72           HA       GLU  72 -16.097  -6.439  -3.000
  558   1HB   GLU  72          1HB       GLU  72 -17.097  -5.574  -5.015
  559   2HB   GLU  72          2HB       GLU  72 -15.950  -4.219  -5.068
  560   1HG   GLU  72          1HG       GLU  72 -15.408  -5.669  -6.853
  561   2HG   GLU  72          2HG       GLU  72 -14.127  -5.794  -5.643
  562    H    ALA  73           H        ALA  73 -14.073  -3.566  -3.692
  563    HA   ALA  73           HA       ALA  73 -11.604  -4.896  -4.152
  564   1HB   ALA  73          1HB       ALA  73 -12.280  -2.609  -4.832
  565   2HB   ALA  73          2HB       ALA  73 -12.417  -2.163  -3.137
  566   3HB   ALA  73          3HB       ALA  73 -10.797  -2.532  -3.809
  567    H    LEU  74           H        LEU  74 -12.944  -3.174  -1.310
  568    HA   LEU  74           HA       LEU  74 -10.735  -3.607   0.394
  569   1HB   LEU  74          1HB       LEU  74 -12.284  -2.877   2.159
  570   2HB   LEU  74          2HB       LEU  74 -12.421  -1.924   0.660
  571    HG   LEU  74           HG       LEU  74 -14.321  -3.607   0.059
  572   1HD1  LEU  74          1HD1      LEU  74 -14.058  -5.010   2.073
  573   2HD1  LEU  74          2HD1      LEU  74 -14.389  -3.583   3.103
  574   3HD1  LEU  74          3HD1      LEU  74 -15.655  -4.217   2.014
  575   1HD2  LEU  74          1HD2      LEU  74 -14.490  -1.175   0.295
  576   2HD2  LEU  74          2HD2      LEU  74 -15.915  -1.981   0.968
  577   3HD2  LEU  74          3HD2      LEU  74 -14.657  -1.344   2.055
  578    H    GLU  75           H        GLU  75 -13.714  -5.586  -0.040
  579    HA   GLU  75           HA       GLU  75 -13.136  -7.540   1.918
  580   1HB   GLU  75          1HB       GLU  75 -14.582  -7.724  -0.754
  581   2HB   GLU  75          2HB       GLU  75 -14.604  -9.000   0.478
  582   1HG   GLU  75          1HG       GLU  75 -15.682  -7.498   2.082
  583   2HG   GLU  75          2HG       GLU  75 -15.551  -6.153   0.916
  584    H    LYS  76           H        LYS  76 -12.554  -7.762  -1.657
  585    HA   LYS  76           HA       LYS  76 -11.172 -10.257  -1.313
  586   1HB   LYS  76          1HB       LYS  76 -10.306  -9.772  -3.670
  587   2HB   LYS  76          2HB       LYS  76 -12.032 -10.060  -3.389
  588   1HG   LYS  76          1HG       LYS  76 -12.028  -8.303  -4.898
  589   2HG   LYS  76          2HG       LYS  76 -12.344  -7.546  -3.335
  590   1HD   LYS  76          1HD       LYS  76 -10.779  -6.139  -4.410
  591   2HD   LYS  76          2HD       LYS  76  -9.805  -7.038  -3.239
  592   1HE   LYS  76          1HE       LYS  76 -10.179  -7.693  -6.208
  593   2HE   LYS  76          2HE       LYS  76  -8.780  -6.844  -5.543
  594   1HZ   LYS  76          1HZ       LYS  76  -8.338  -8.811  -4.196
  595   2HZ   LYS  76          2HZ       LYS  76  -9.591  -9.602  -4.917
  596   3HZ   LYS  76          3HZ       LYS  76  -8.285  -9.155  -5.809
  597    H    LEU  77           H        LEU  77  -9.969  -6.912  -1.360
  598    HA   LEU  77           HA       LEU  77  -7.205  -7.566  -1.355
  599   1HB   LEU  77          1HB       LEU  77  -8.933  -5.265  -0.546
  600   2HB   LEU  77          2HB       LEU  77  -7.237  -5.319   0.026
  601    HG   LEU  77           HG       LEU  77  -7.819  -4.207  -2.343
  602   1HD1  LEU  77          1HD1      LEU  77  -5.747  -4.356  -1.016
  603   2HD1  LEU  77          2HD1      LEU  77  -5.529  -6.033  -1.580
  604   3HD1  LEU  77          3HD1      LEU  77  -5.439  -4.690  -2.753
  605   1HD2  LEU  77          1HD2      LEU  77  -7.054  -7.118  -2.934
  606   2HD2  LEU  77          2HD2      LEU  77  -8.572  -6.346  -3.463
  607   3HD2  LEU  77          3HD2      LEU  77  -7.006  -5.784  -4.098
  608    H    ALA  78           H        ALA  78  -9.437  -6.978   1.500
  609    HA   ALA  78           HA       ALA  78  -7.424  -7.618   3.408
  610   1HB   ALA  78          1HB       ALA  78  -9.506  -6.465   4.022
  611   2HB   ALA  78          2HB       ALA  78 -10.441  -7.926   3.617
  612   3HB   ALA  78          3HB       ALA  78  -9.289  -7.943   4.973
  613    H    ALA  79           H        ALA  79  -9.652  -9.687   1.527
  614    HA   ALA  79           HA       ALA  79  -9.125 -12.177   2.799
  615   1HB   ALA  79          1HB       ALA  79 -10.744 -11.755   0.911
  616   2HB   ALA  79          2HB       ALA  79  -9.332 -11.545  -0.171
  617   3HB   ALA  79          3HB       ALA  79  -9.644 -13.125   0.595
  618    H    TYR  80           H        TYR  80  -7.533 -10.595   0.031
  619    HA   TYR  80           HA       TYR  80  -5.499 -12.453  -0.449
  620   1HB   TYR  80          1HB       TYR  80  -6.401 -10.604  -1.848
  621   2HB   TYR  80          2HB       TYR  80  -5.480  -9.458  -0.863
  622    HD1  TYR  80           HD1      TYR  80  -3.303  -8.888  -1.463
  623    HD2  TYR  80           HD2      TYR  80  -4.931 -12.638  -2.808
  624    HE1  TYR  80           HE1      TYR  80  -1.124  -9.458  -2.508
  625    HE2  TYR  80           HE2      TYR  80  -2.756 -13.212  -3.856
  626    HH   TYR  80           HH       TYR  80  -0.561 -12.606  -4.108
  627    H    VAL  81           H        VAL  81  -5.381  -9.483   1.559
  628    HA   VAL  81           HA       VAL  81  -2.621  -9.610   2.183
  629    HB   VAL  81           HB       VAL  81  -3.113  -8.059   3.955
  630   1HG1  VAL  81          1HG2      VAL  81  -5.152  -7.763   1.727
  631   2HG1  VAL  81          2HG2      VAL  81  -4.602  -6.454   2.802
  632   3HG1  VAL  81          3HG2      VAL  81  -3.458  -7.222   1.660
  633   1HG2  VAL  81          1HG1      VAL  81  -4.919  -9.364   5.030
  634   2HG2  VAL  81          2HG1      VAL  81  -5.433  -7.681   4.766
  635   3HG2  VAL  81          3HG1      VAL  81  -6.006  -8.982   3.690
  636    H    GLN  82           H        GLN  82  -5.389 -11.223   3.740
  637    HA   GLN  82           HA       GLN  82  -3.654 -11.893   6.012
  638   1HB   GLN  82          1HB       GLN  82  -5.773 -12.301   7.120
  639   2HB   GLN  82          2HB       GLN  82  -6.024 -10.865   6.093
  640   1HG   GLN  82          1HG       GLN  82  -6.866 -12.362   4.294
  641   2HG   GLN  82          2HG       GLN  82  -6.524 -13.739   5.335
  642   1HE2  GLN  82          2HE2      GLN  82  -8.731 -11.471   4.396
  643   2HE2  GLN  82          1HE2      GLN  82 -10.103 -11.984   5.406
  644    H    GLU  83           H        GLU  83  -5.195 -13.422   3.287
  645    HA   GLU  83           HA       GLU  83  -5.968 -15.826   4.255
  646   1HB   GLU  83          1HB       GLU  83  -5.829 -14.504   1.839
  647   2HB   GLU  83          2HB       GLU  83  -5.045 -16.086   1.516
  648   1HG   GLU  83          1HG       GLU  83  -7.486 -16.228   1.159
  649   2HG   GLU  83          2HG       GLU  83  -7.062 -17.173   2.603
  650    H    GLU  84           H        GLU  84  -2.793 -15.579   2.537
  651    HA   GLU  84           HA       GLU  84  -2.240 -18.274   3.675
  652   1HB   GLU  84          1HB       GLU  84  -0.456 -18.320   1.875
  653   2HB   GLU  84          2HB       GLU  84  -2.123 -18.271   1.281
  654   1HG   GLU  84          1HG       GLU  84  -1.970 -15.951   0.714
  655   2HG   GLU  84          2HG       GLU  84  -0.461 -15.753   1.631
  656    H    VAL  85           H        VAL  85   0.591 -16.925   2.610
  657    HA   VAL  85           HA       VAL  85   1.396 -15.337   4.978
  658    HB   VAL  85           HB       VAL  85   3.318 -16.609   5.510
  659   1HG1  VAL  85          1HG1      VAL  85   1.271 -18.901   5.098
  660   2HG1  VAL  85          2HG1      VAL  85   2.751 -18.993   6.085
  661   3HG1  VAL  85          3HG1      VAL  85   1.456 -17.910   6.565
  662   1HG2  VAL  85          1HG2      VAL  85   4.075 -17.163   3.155
  663   2HG2  VAL  85          2HG2      VAL  85   4.271 -18.531   4.256
  664   3HG2  VAL  85          3HG2      VAL  85   2.916 -18.513   3.098
  Start of MODEL   19
    1   1H    VAL   2          1H        VAL   2 -16.552   6.324  -1.960
    2   2H    VAL   2          2H        VAL   2 -16.946   5.106  -3.050
    3   3H    VAL   2          3H        VAL   2 -17.991   6.404  -2.826
    4    HA   VAL   2           HA       VAL   2 -18.407   5.755  -0.578
    5    HB   VAL   2           HB       VAL   2 -19.614   3.635  -1.076
    6   1HG1  VAL   2          1HG1      VAL   2 -20.587   5.812  -1.712
    7   2HG1  VAL   2          2HG1      VAL   2 -19.753   5.733  -3.282
    8   3HG1  VAL   2          3HG1      VAL   2 -21.023   4.550  -2.889
    9   1HG2  VAL   2          1HG2      VAL   2 -17.906   2.590  -2.526
   10   2HG2  VAL   2          2HG2      VAL   2 -19.486   2.669  -3.343
   11   3HG2  VAL   2          3HG2      VAL   2 -18.200   3.822  -3.772
   12    H    GLN   3           H        GLN   3 -17.671   4.641   1.293
   13    HA   GLN   3           HA       GLN   3 -15.250   3.069   0.653
   14   1HB   GLN   3          1HB       GLN   3 -15.255   5.329   2.088
   15   2HB   GLN   3          2HB       GLN   3 -15.612   4.170   3.403
   16   1HG   GLN   3          1HG       GLN   3 -13.717   2.747   2.205
   17   2HG   GLN   3          2HG       GLN   3 -13.289   4.261   1.471
   18   1HE2  GLN   3          2HE2      GLN   3 -14.331   3.571   4.873
   19   2HE2  GLN   3          1HE2      GLN   3 -12.867   4.245   5.570
   20    H    GLN   4           H        GLN   4 -14.933   1.079   1.307
   21    HA   GLN   4           HA       GLN   4 -16.323  -0.007   3.625
   22   1HB   GLN   4          1HB       GLN   4 -16.559  -1.302   0.868
   23   2HB   GLN   4          2HB       GLN   4 -16.798  -2.185   2.376
   24   1HG   GLN   4          1HG       GLN   4 -18.356   0.334   1.690
   25   2HG   GLN   4          2HG       GLN   4 -18.904  -1.309   1.295
   26   1HE2  GLN   4          2HE2      GLN   4 -18.313   0.991   3.899
   27   2HE2  GLN   4          1HE2      GLN   4 -19.105   0.041   5.157
   28    H    LYS   5           H        LYS   5 -15.009  -1.641   4.613
   29    HA   LYS   5           HA       LYS   5 -12.462  -2.343   3.341
   30   1HB   LYS   5          1HB       LYS   5 -11.287  -1.525   5.354
   31   2HB   LYS   5          2HB       LYS   5 -12.106  -0.243   4.437
   32   1HG   LYS   5          1HG       LYS   5 -14.084  -0.535   6.064
   33   2HG   LYS   5          2HG       LYS   5 -12.939  -1.438   7.085
   34   1HD   LYS   5          1HD       LYS   5 -11.344   0.576   6.746
   35   2HD   LYS   5          2HD       LYS   5 -12.739   1.439   6.081
   36   1HE   LYS   5          1HE       LYS   5 -12.575   2.020   8.412
   37   2HE   LYS   5          2HE       LYS   5 -13.983   0.952   8.240
   38   1HZ   LYS   5          1HZ       LYS   5 -11.297   0.172   9.161
   39   2HZ   LYS   5          2HZ       LYS   5 -12.627   0.363  10.112
   40   3HZ   LYS   5          3HZ       LYS   5 -12.573  -0.858   9.008
   41    H    VAL   6           H        VAL   6 -11.599  -4.234   4.247
   42    HA   VAL   6           HA       VAL   6 -13.315  -5.567   6.291
   43    HB   VAL   6           HB       VAL   6 -11.473  -6.939   4.301
   44   1HG1  VAL   6          1HG1      VAL   6 -13.673  -7.988   6.123
   45   2HG1  VAL   6          2HG1      VAL   6 -12.721  -8.963   4.980
   46   3HG1  VAL   6          3HG1      VAL   6 -11.920  -8.193   6.371
   47   1HG2  VAL   6          1HG2      VAL   6 -13.340  -5.855   3.091
   48   2HG2  VAL   6          2HG2      VAL   6 -13.524  -7.627   3.092
   49   3HG2  VAL   6          3HG2      VAL   6 -14.505  -6.630   4.194
   50    H    GLU   7           H        GLU   7 -11.829  -6.895   7.882
   51    HA   GLU   7           HA       GLU   7  -9.376  -5.248   8.017
   52   1HB   GLU   7          1HB       GLU   7 -10.484  -6.999  10.289
   53   2HB   GLU   7          2HB       GLU   7  -9.362  -5.634  10.460
   54   1HG   GLU   7          1HG       GLU   7 -12.277  -5.401   9.588
   55   2HG   GLU   7          2HG       GLU   7 -11.695  -5.144  11.245
   56    H    VAL   8           H        VAL   8  -7.297  -6.187   8.223
   57    HA   VAL   8           HA       VAL   8  -7.342  -9.149   8.043
   58    HB   VAL   8           HB       VAL   8  -6.386  -9.155   5.969
   59   1HG1  VAL   8          1HG2      VAL   8  -7.481  -6.315   5.992
   60   2HG1  VAL   8          2HG2      VAL   8  -7.094  -7.275   4.531
   61   3HG1  VAL   8          3HG2      VAL   8  -8.390  -7.803   5.631
   62   1HG2  VAL   8          1HG1      VAL   8  -5.046  -6.493   6.549
   63   2HG2  VAL   8          2HG1      VAL   8  -4.281  -8.098   6.646
   64   3HG2  VAL   8          3HG1      VAL   8  -4.828  -7.471   5.075
   65    H    ARG   9           H        ARG   9  -5.523 -10.211   8.963
   66    HA   ARG   9           HA       ARG   9  -3.475  -8.313  10.058
   67   1HB   ARG   9          1HB       ARG   9  -3.717 -10.168  11.576
   68   2HB   ARG   9          2HB       ARG   9  -3.645 -11.333  10.198
   69   1HG   ARG   9          1HG       ARG   9  -1.322 -10.021   9.832
   70   2HG   ARG   9          2HG       ARG   9  -1.440  -9.946  11.608
   71   1HD   ARG   9          1HD       ARG   9  -0.296 -12.025  10.851
   72   2HD   ARG   9          2HD       ARG   9  -1.862 -12.436  11.586
   73    HE   ARG   9           HE       ARG   9  -2.222 -12.062   8.779
   74   1HH1  ARG   9          1HH2      ARG   9  -0.644 -14.247  11.050
   75   2HH1  ARG   9          2HH2      ARG   9  -0.825 -15.669  10.054
   76   1HH2  ARG   9          2HH1      ARG   9  -2.533 -13.978   7.450
   77   2HH2  ARG   9          1HH1      ARG   9  -1.869 -15.490   7.955
   78    H    LEU  10           H        LEU  10  -2.467  -7.484   8.522
   79    HA   LEU  10           HA       LEU  10  -2.010  -8.117   5.875
   80   1HB   LEU  10          1HB       LEU  10  -1.778  -5.945   6.910
   81   2HB   LEU  10          2HB       LEU  10  -0.522  -6.549   7.998
   82    HG   LEU  10           HG       LEU  10   1.031  -6.808   6.119
   83   1HD1  LEU  10          1HD1      LEU  10  -1.241  -5.584   4.487
   84   2HD1  LEU  10          2HD1      LEU  10   0.432  -5.840   3.927
   85   3HD1  LEU  10          3HD1      LEU  10  -0.599  -7.239   4.308
   86   1HD2  LEU  10          1HD2      LEU  10   0.815  -4.775   7.506
   87   2HD2  LEU  10          2HD2      LEU  10   1.337  -4.400   5.850
   88   3HD2  LEU  10          3HD2      LEU  10  -0.353  -4.104   6.339
   89    H    LYS  11           H        LYS  11  -1.593 -10.529   6.346
   90    HA   LYS  11           HA       LYS  11   0.943 -11.422   7.274
   91   1HB   LYS  11          1HB       LYS  11  -0.676 -13.069   7.315
   92   2HB   LYS  11          2HB       LYS  11  -1.417 -12.504   5.802
   93   1HG   LYS  11          1HG       LYS  11   1.099 -13.321   4.945
   94   2HG   LYS  11          2HG       LYS  11   0.537 -14.583   6.109
   95   1HD   LYS  11          1HD       LYS  11  -0.534 -15.019   3.964
   96   2HD   LYS  11          2HD       LYS  11  -1.741 -14.350   5.099
   97   1HE   LYS  11          1HE       LYS  11  -1.519 -12.138   4.061
   98   2HE   LYS  11          2HE       LYS  11  -0.309 -12.805   2.926
   99   1HZ   LYS  11          1HZ       LYS  11  -3.055 -13.768   3.154
  100   2HZ   LYS  11          2HZ       LYS  11  -2.518 -12.732   1.999
  101   3HZ   LYS  11          3HZ       LYS  11  -1.918 -14.260   2.072
  102    H    THR  12           H        THR  12  -0.286 -10.603   4.042
  103    HA   THR  12           HA       THR  12   1.918 -11.294   2.439
  104    HB   THR  12           HB       THR  12   1.432  -9.061   1.252
  105    HG1  THR  12           HG1      THR  12  -0.828  -9.090   3.013
  106   1HG2  THR  12          1HG2      THR  12  -0.716  -9.783   0.332
  107   2HG2  THR  12          2HG2      THR  12   0.400 -11.149   0.511
  108   3HG2  THR  12          3HG2      THR  12  -0.927 -10.935   1.681
  109    H    GLY  13           H        GLY  13   1.386  -8.268   4.266
  110   1HA   GLY  13          1HA       GLY  13   2.796  -6.747   5.233
  111   2HA   GLY  13          2HA       GLY  13   4.012  -8.029   5.412
  112    H    LEU  14           H        LEU  14   2.684  -7.293   2.361
  113    HA   LEU  14           HA       LEU  14   3.709  -6.808   0.368
  114   1HB   LEU  14          1HB       LEU  14   3.713  -4.185   1.824
  115   2HB   LEU  14          2HB       LEU  14   3.629  -4.444   0.077
  116    HG   LEU  14           HG       LEU  14   1.541  -5.053   2.176
  117   1HD1  LEU  14          1HD1      LEU  14   1.394  -4.073  -0.717
  118   2HD1  LEU  14          2HD1      LEU  14   0.020  -4.203   0.408
  119   3HD1  LEU  14          3HD1      LEU  14   1.327  -3.038   0.734
  120   1HD2  LEU  14          1HD2      LEU  14   2.019  -7.222   0.936
  121   2HD2  LEU  14          2HD2      LEU  14   0.365  -6.588   0.753
  122   3HD2  LEU  14          3HD2      LEU  14   1.550  -6.367  -0.553
  123    H    GLN  15           H        GLN  15   5.432  -8.091   0.675
  124    HA   GLN  15           HA       GLN  15   8.086  -7.002   1.391
  125   1HB   GLN  15          1HB       GLN  15   7.137  -9.710   0.370
  126   2HB   GLN  15          2HB       GLN  15   8.813  -9.346   0.853
  127   1HG   GLN  15          1HG       GLN  15   8.141  -8.948   3.142
  128   2HG   GLN  15          2HG       GLN  15   6.424  -8.940   2.685
  129   1HE2  GLN  15          1HE2      GLN  15   5.446 -10.663   3.535
  130   2HE2  GLN  15          2HE2      GLN  15   5.975 -12.310   3.342
  131    H    ALA  16           H        ALA  16   6.180  -8.246  -1.413
  132    HA   ALA  16           HA       ALA  16   7.329  -6.223  -3.073
  133   1HB   ALA  16          1HB       ALA  16   9.373  -7.523  -2.858
  134   2HB   ALA  16          2HB       ALA  16   8.552  -8.968  -3.496
  135   3HB   ALA  16          3HB       ALA  16   8.789  -7.544  -4.541
  136    H    ARG  17           H        ARG  17   7.080  -9.374  -4.463
  137    HA   ARG  17           HA       ARG  17   5.424  -8.540  -6.561
  138   1HB   ARG  17          1HB       ARG  17   6.019 -11.328  -5.536
  139   2HB   ARG  17          2HB       ARG  17   5.366 -10.942  -7.148
  140   1HG   ARG  17          1HG       ARG  17   7.433 -10.427  -7.921
  141   2HG   ARG  17          2HG       ARG  17   7.713  -9.320  -6.559
  142   1HD   ARG  17          1HD       ARG  17   8.089 -12.347  -6.465
  143   2HD   ARG  17          2HD       ARG  17   9.381 -11.151  -6.613
  144    HE   ARG  17           HE       ARG  17   9.084 -10.493  -4.385
  145   1HH1  ARG  17          2HH1      ARG  17   6.883 -13.142  -5.295
  146   2HH1  ARG  17          1HH1      ARG  17   6.451 -13.480  -3.627
  147   1HH2  ARG  17          1HH2      ARG  17   8.378 -10.942  -2.204
  148   2HH2  ARG  17          2HH2      ARG  17   7.259 -12.267  -1.949
  149    HA   PRO  18           HA       PRO  18   1.694 -10.914  -4.754
  150   1HB   PRO  18          1HB       PRO  18   1.719 -11.765  -2.156
  151   2HB   PRO  18          2HB       PRO  18   2.583 -12.733  -3.405
  152   1HG   PRO  18          1HG       PRO  18   3.743 -10.475  -1.728
  153   2HG   PRO  18          2HG       PRO  18   4.351 -12.128  -1.697
  154   1HD   PRO  18          1HD       PRO  18   5.492 -10.368  -3.328
  155   2HD   PRO  18          2HD       PRO  18   5.023 -11.937  -4.055
  156    H    ALA  19           H        ALA  19   3.549  -9.002  -2.465
  157    HA   ALA  19           HA       ALA  19   1.650  -7.536  -1.144
  158   1HB   ALA  19          1HB       ALA  19   4.349  -6.989  -2.394
  159   2HB   ALA  19          2HB       ALA  19   3.665  -6.007  -1.038
  160   3HB   ALA  19          3HB       ALA  19   4.038  -7.748  -0.824
  161    H    ALA  20           H        ALA  20   3.277  -6.863  -4.249
  162    HA   ALA  20           HA       ALA  20   1.691  -4.426  -4.813
  163   1HB   ALA  20          1HB       ALA  20   3.458  -6.215  -6.572
  164   2HB   ALA  20          2HB       ALA  20   2.832  -4.612  -7.026
  165   3HB   ALA  20          3HB       ALA  20   4.022  -4.764  -5.707
  166    H    LEU  21           H        LEU  21   1.504  -7.924  -5.405
  167    HA   LEU  21           HA       LEU  21  -0.602  -7.931  -7.287
  168   1HB   LEU  21          1HB       LEU  21   0.724  -9.862  -6.207
  169   2HB   LEU  21          2HB       LEU  21  -0.479  -9.813  -4.913
  170    HG   LEU  21           HG       LEU  21  -1.155 -10.126  -7.873
  171   1HD1  LEU  21          1HD1      LEU  21  -0.966 -12.197  -5.647
  172   2HD1  LEU  21          2HD1      LEU  21  -1.552 -12.504  -7.300
  173   3HD1  LEU  21          3HD1      LEU  21   0.146 -12.046  -7.028
  174   1HD2  LEU  21          1HD2      LEU  21  -2.984  -9.199  -6.463
  175   2HD2  LEU  21          2HD2      LEU  21  -3.355 -10.851  -7.010
  176   3HD2  LEU  21          3HD2      LEU  21  -2.801 -10.571  -5.342
  177    H    PHE  22           H        PHE  22  -0.691  -7.929  -3.762
  178    HA   PHE  22           HA       PHE  22  -3.376  -7.428  -2.998
  179   1HB   PHE  22          1HB       PHE  22  -1.504  -7.832  -1.487
  180   2HB   PHE  22          2HB       PHE  22  -0.681  -6.390  -2.062
  181    HD1  PHE  22           HD1      PHE  22  -0.995  -7.158   0.763
  182    HD2  PHE  22           HD2      PHE  22  -3.343  -4.579  -1.777
  183    HE1  PHE  22           HE1      PHE  22  -1.489  -5.703   2.691
  184    HE2  PHE  22           HE2      PHE  22  -3.855  -3.142   0.163
  185    HZ   PHE  22           HZ       PHE  22  -2.951  -3.700   2.409
  186    H    VAL  23           H        VAL  23  -0.902  -4.836  -3.375
  187    HA   VAL  23           HA       VAL  23  -2.685  -2.717  -3.429
  188    HB   VAL  23           HB       VAL  23  -0.944  -1.410  -4.110
  189   1HG1  VAL  23          1HG1      VAL  23  -0.126  -2.579  -2.229
  190   2HG1  VAL  23          2HG1      VAL  23   0.586  -3.844  -3.271
  191   3HG1  VAL  23          3HG1      VAL  23   1.174  -2.163  -3.356
  192   1HG2  VAL  23          1HG2      VAL  23  -0.947  -2.099  -6.360
  193   2HG2  VAL  23          2HG2      VAL  23   0.715  -1.883  -5.772
  194   3HG2  VAL  23          3HG2      VAL  23   0.018  -3.533  -5.977
  195    H    GLN  24           H        GLN  24  -1.668  -4.792  -6.092
  196    HA   GLN  24           HA       GLN  24  -2.736  -3.246  -8.225
  197   1HB   GLN  24          1HB       GLN  24  -0.825  -4.625  -8.544
  198   2HB   GLN  24          2HB       GLN  24  -1.677  -6.080  -7.993
  199   1HG   GLN  24          1HG       GLN  24  -2.999  -4.617 -10.176
  200   2HG   GLN  24          2HG       GLN  24  -1.441  -5.371 -10.640
  201   1HE2  GLN  24          2HE2      GLN  24  -2.837  -7.173  -8.087
  202   2HE2  GLN  24          1HE2      GLN  24  -3.837  -8.191  -9.104
  203    H    GLU  25           H        GLU  25  -4.043  -5.912  -6.227
  204    HA   GLU  25           HA       GLU  25  -6.389  -6.240  -7.946
  205   1HB   GLU  25          1HB       GLU  25  -5.885  -6.911  -5.001
  206   2HB   GLU  25          2HB       GLU  25  -7.221  -7.560  -5.988
  207   1HG   GLU  25          1HG       GLU  25  -4.304  -7.913  -6.696
  208   2HG   GLU  25          2HG       GLU  25  -5.189  -9.058  -5.665
  209    H    ALA  26           H        ALA  26  -5.536  -4.494  -4.970
  210    HA   ALA  26           HA       ALA  26  -8.011  -3.145  -4.532
  211   1HB   ALA  26          1HB       ALA  26  -6.005  -3.007  -3.053
  212   2HB   ALA  26          2HB       ALA  26  -5.169  -2.071  -4.319
  213   3HB   ALA  26          3HB       ALA  26  -6.602  -1.391  -3.507
  214    H    ASN  27           H        ASN  27  -5.266  -2.409  -6.645
  215    HA   ASN  27           HA       ASN  27  -6.136  -0.051  -7.936
  216   1HB   ASN  27          1HB       ASN  27  -4.285  -2.382  -8.346
  217   2HB   ASN  27          2HB       ASN  27  -4.785  -1.605  -9.829
  218   1HD2  ASN  27          2HD2      ASN  27  -2.798  -1.367  -7.031
  219   2HD2  ASN  27          1HD2      ASN  27  -1.974   0.130  -7.390
  220    H    ARG  28           H        ARG  28  -6.489  -3.422  -8.610
  221    HA   ARG  28           HA       ARG  28  -7.156  -3.731 -11.212
  222   1HB   ARG  28          1HB       ARG  28  -7.543  -5.090  -8.626
  223   2HB   ARG  28          2HB       ARG  28  -8.524  -5.738  -9.918
  224   1HG   ARG  28          1HG       ARG  28  -5.557  -5.230 -10.222
  225   2HG   ARG  28          2HG       ARG  28  -6.173  -6.752  -9.584
  226   1HD   ARG  28          1HD       ARG  28  -5.740  -6.963 -11.991
  227   2HD   ARG  28          2HD       ARG  28  -7.484  -7.095 -11.684
  228    HE   ARG  28           HE       ARG  28  -7.835  -5.080 -12.795
  229   1HH1  ARG  28          2HH1      ARG  28  -4.393  -5.590 -12.201
  230   2HH1  ARG  28          1HH1      ARG  28  -3.884  -4.128 -13.008
  231   1HH2  ARG  28          1HH2      ARG  28  -7.208  -3.152 -13.827
  232   2HH2  ARG  28          2HH2      ARG  28  -5.528  -2.709 -13.965
  233