data_LACS

         #################################
         #    LACS Output Information    #
         #################################

############################################################
#              LACS Designator Definition                  #
#                                                          #
#   Index Value                    Definition              #
#                                                          #
#        0                          Outliers               #
#        1                        Normal points            #
#                                                          # 
############################################################            



save_LACS_CACB_CA_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr6682_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CA 
    _LACS_plot.Line_1_terminator_val_x_1  -7.20 
    _LACS_plot.Line_1_terminator_val_y_1  -2.15 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  1.18 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  -1.00 
    _LACS_plot.Line_2_terminator_val_x_2  6.60 
    _LACS_plot.Line_2_terminator_val_y_2  5.21 
    _LACS_plot.Y_axis_chem_shift_offset   -0.45 

    loop_
        _LACS.Comp_index_ID 
        _LACS.Comp_ID 
        _LACS.X_coord_val 
        _LACS.Y_coord_val 
        _LACS.Designator 

         58 ARG -7.20 -1.90 0 
         36 ASP -0.70  0.10 1 
         38 ASN  0.10  0.60 1 
         39 ALA -0.10  0.40 1 
         40 GLU -0.80  0.00 1 
         41 PHE -0.60  0.30 1 
         42 ASP -2.30 -1.20 1 
         44 ASP  0.50  0.60 1 
         45 LEU -1.70 -0.60 1 
         50 LEU  0.60  0.80 1 
         51 HIS -1.40 -0.30 1 
         52 ARG -5.00 -1.30 1 
         54 LEU  3.50  2.90 1 
         55 ALA  3.10  3.30 1 
         57 ALA  3.00  0.40 1 
         59 TYR -2.50 -0.20 1 
         60 PHE -4.40 -0.80 1 
         61 ILE  2.30  2.90 1 
         62 ASP -3.30 -1.60 1 
         63 SER  3.30  2.80 1 
         64 THR  6.10  4.90 1 
         65 ASN  3.20  3.80 1 
         66 LEU  3.50  2.90 1 
         67 LYS  5.30  4.40 1 
         68 THR  5.80  4.80 1 
         69 HIS  6.60  5.10 1 
         70 PHE  1.60 -0.80 1 
         71 ARG  0.50  0.40 1 
         72 SER -1.90  0.60 1 
         73 LYS  4.30  3.70 1 
         74 ASP  3.60  3.10 1 
         75 HIS  3.30  5.00 1 
         76 LYS  4.90  4.20 1 
         77 LYS  4.10  3.10 1 
         78 ARG  2.80  1.40 1 
         79 LEU  3.30  2.40 1 
         80 LYS  3.50  2.70 1 
         81 GLN  2.90  2.30 1 
         82 LEU  0.60  0.80 1 
         83 SER  0.90  1.00 1 
         84 VAL -0.20  0.20 1 
         85 GLU  0.20  0.60 1 
         87 TYR  0.00  0.00 1 
         88 SER -1.00 -0.30 1 
         89 GLN  1.50  1.60 1 
         90 GLU  1.60  2.10 1 
         91 GLU  1.00  1.40 1 
         92 ALA  1.30  1.30 1 
         93 GLU  1.20  1.60 1 
         94 ARG  1.60  1.30 1 
         95 ALA  0.90  1.00 1 
         96 ALA  1.00  1.00 1 
         98 MET  0.40  0.50 1 
        100 SER -0.60  0.30 1 
        101 TYR  0.10  0.70 1 
        102 VAL -3.60 -2.90 1 
    stop_

save_


save_LACS_CACB_CB_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr6682_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CB 
    _LACS_plot.Line_1_terminator_val_x_1  -7.20 
    _LACS_plot.Line_1_terminator_val_y_1  5.05 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -0.82 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  1.00 
    _LACS_plot.Line_2_terminator_val_x_2  6.60 
    _LACS_plot.Line_2_terminator_val_y_2  -1.39 
    _LACS_plot.Y_axis_chem_shift_offset   -0.45 

    loop_
        _LACS.Comp_index_ID 
        _LACS.Comp_ID 
        _LACS.X_coord_val 
        _LACS.Y_coord_val 
        _LACS.Designator 

         58 ARG -7.20  5.30 0 
         36 ASP -0.70  0.80 1 
         38 ASN  0.10  0.50 1 
         39 ALA -0.10  0.50 1 
         40 GLU -0.80  0.80 1 
         41 PHE -0.60  0.90 1 
         42 ASP -2.30  1.10 1 
         44 ASP  0.50  0.10 1 
         45 LEU -1.70  1.10 1 
         50 LEU  0.60  0.20 1 
         51 HIS -1.40  1.10 1 
         52 ARG -5.00  3.70 1 
         54 LEU  3.50 -0.60 1 
         55 ALA  3.10  0.20 1 
         57 ALA  3.00 -2.60 1 
         59 TYR -2.50  2.30 1 
         60 PHE -4.40  3.60 1 
         61 ILE  2.30  0.60 1 
         62 ASP -3.30  1.70 1 
         63 SER  3.30 -0.50 1 
         64 THR  6.10 -1.20 1 
         65 ASN  3.20  0.60 1 
         66 LEU  3.50 -0.60 1 
         67 LYS  5.30 -0.90 1 
         68 THR  5.80 -1.00 1 
         69 HIS  6.60 -1.50 1 
         70 PHE  1.60 -2.40 1 
         71 ARG  0.50 -0.10 1 
         72 SER -1.90  2.50 1 
         73 LYS  4.30 -0.60 1 
         74 ASP  3.60 -0.50 1 
         75 HIS  3.30  1.70 1 
         76 LYS  4.90 -0.70 1 
         77 LYS  4.10 -1.00 1 
         78 ARG  2.80 -1.40 1 
         79 LEU  3.30 -0.90 1 
         80 LYS  3.50 -0.80 1 
         81 GLN  2.90 -0.60 1 
         82 LEU  0.60  0.20 1 
         83 SER  0.90  0.10 1 
         84 VAL -0.20  0.40 1 
         85 GLU  0.20  0.40 1 
         87 TYR  0.00  0.00 1 
         88 SER -1.00  0.70 1 
         89 GLN  1.50  0.10 1 
         90 GLU  1.60  0.50 1 
         91 GLU  1.00  0.40 1 
         92 ALA  1.30  0.00 1 
         93 GLU  1.20  0.40 1 
         94 ARG  1.60 -0.30 1 
         95 ALA  0.90  0.10 1 
         96 ALA  1.00  0.00 1 
         98 MET  0.40  0.10 1 
        100 SER -0.60  0.90 1 
        101 TYR  0.10  0.60 1 
        102 VAL -3.60  0.70 1 
    stop_

save_


save_LACS_CACB_HA_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr6682_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               HA 
    _LACS_plot.Line_1_terminator_val_x_1  -7.20 
    _LACS_plot.Line_1_terminator_val_y_1  0.41 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -0.19 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.10 
    _LACS_plot.Line_2_terminator_val_x_2  6.60 
    _LACS_plot.Line_2_terminator_val_y_2  -0.53 
    _LACS_plot.Y_axis_chem_shift_offset   0.05 

    loop_
        _LACS.Comp_index_ID 
        _LACS.Comp_ID 
        _LACS.X_coord_val 
        _LACS.Y_coord_val 
        _LACS.Designator 

         66 LEU  3.50 -1.48 0 
         36 ASP -0.70 -0.05 1 
         38 ASN  0.10 -0.01 1 
         39 ALA -0.10 -0.02 1 
         40 GLU -0.80 -0.06 1 
         41 PHE -0.60 -0.17 1 
         42 ASP -2.30 -0.05 1 
         44 ASP  0.50 -0.01 1 
         45 LEU -1.70 -0.13 1 
         50 LEU  0.60 -0.18 1 
         51 HIS -1.40  0.16 1 
         52 ARG -5.00  0.70 1 
         54 LEU  3.50 -0.21 1 
         55 ALA  3.10 -0.18 1 
         57 ALA  3.00 -0.42 1 
         58 ARG -7.20  0.18 1 
         59 TYR -2.50  0.17 1 
         60 PHE -4.40  0.10 1 
         61 ILE  2.30 -0.21 1 
         62 ASP -3.30 -0.55 1 
         63 SER  3.30 -0.66 1 
         64 THR  6.10 -0.50 1 
         65 ASN  3.20 -0.39 1 
         67 LYS  5.30 -0.53 1 
         68 THR  5.80 -0.54 1 
         69 HIS  6.60 -0.48 1 
         70 PHE  1.60 -0.82 1 
         71 ARG  0.50  0.08 1 
         72 SER -1.90 -0.01 1 
         73 LYS  4.30 -0.29 1 
         74 ASP  3.60 -0.25 1 
         75 HIS  3.30 -0.62 1 
         76 LYS  4.90 -0.59 1 
         77 LYS  4.10 -0.29 1 
         78 ARG  2.80 -0.22 1 
         79 LEU  3.30 -0.47 1 
         80 LYS  3.50 -0.19 1 
         81 GLN  2.90 -0.19 1 
         82 LEU  0.60 -0.05 1 
         83 SER  0.90 -0.07 1 
         84 VAL -0.20  0.12 1 
         85 GLU  0.20 -0.03 1 
         87 TYR  0.00  0.04 1 
         88 SER -1.00  0.00 1 
         89 GLN  1.50 -0.11 1 
         90 GLU  1.60  0.04 1 
         91 GLU  1.00 -0.21 1 
         92 ALA  1.30 -0.12 1 
         93 GLU  1.20 -0.18 1 
         94 ARG  1.60 -0.12 1 
         95 ALA  0.90 -0.09 1 
         96 ALA  1.00 -0.01 1 
         98 MET  0.40  0.07 1 
        100 SER -0.60  0.02 1 
        101 TYR  0.10  0.00 1 
        102 VAL -3.60  0.17 1 
    stop_

save_


save_LACS_CACB_CO_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr6682_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CO 
    _LACS_plot.Line_1_terminator_val_x_1  -7.20 
    _LACS_plot.Line_1_terminator_val_y_1  -3.70 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  1.18 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  -1.08 
    _LACS_plot.Line_2_terminator_val_x_2  6.60 
    _LACS_plot.Line_2_terminator_val_y_2  3.79 
    _LACS_plot.Y_axis_chem_shift_offset   -0.08 

    loop_
        _LACS.Comp_index_ID 
        _LACS.Comp_ID 
        _LACS.X_coord_val 
        _LACS.Y_coord_val 
        _LACS.Designator 

         57 ALA  3.00 -2.10 0 
         38 ASN  0.10  0.00 1 
         39 ALA -0.10 -0.30 1 
         40 GLU -0.80 -0.80 1 
         41 PHE -0.60 -1.30 1 
         42 ASP -2.30 -0.70 1 
         44 ASP  0.50 -0.30 1 
         45 LEU -1.70 -0.80 1 
         50 LEU  0.60 -0.80 1 
         51 HIS -1.40 -0.70 1 
         52 ARG -5.00 -1.90 1 
         54 LEU  3.50  1.60 1 
         55 ALA  3.10  1.80 1 
         58 ARG -7.20 -2.30 1 
         59 TYR -2.50 -1.30 1 
         60 PHE -4.40  0.30 1 
         61 ILE  2.30 -1.90 1 
         62 ASP -3.30 -1.00 1 
         64 THR  6.10  1.80 1 
         65 ASN  3.20  2.50 1 
         66 LEU  3.50 -1.20 1 
         67 LYS  5.30  3.70 1 
         68 THR  5.80  2.70 1 
         69 HIS  6.60  4.60 1 
         70 PHE  1.60  0.60 1 
         71 ARG  0.50  0.20 1 
         72 SER -1.90  0.50 1 
         73 LYS  4.30  2.70 1 
         74 ASP  3.60  2.30 1 
         75 HIS  3.30  2.20 1 
         76 LYS  4.90  2.90 1 
         77 LYS  4.10  2.20 1 
         78 ARG  2.80  2.10 1 
         79 LEU  3.30  2.20 1 
         80 LYS  3.50  2.40 1 
         81 GLN  2.90  1.70 1 
         82 LEU  0.60  0.10 1 
         83 SER  0.90 -0.10 1 
         84 VAL -0.20 -0.30 1 
         85 GLU  0.20 -0.20 1 
         87 TYR  0.00  0.10 1 
         88 SER -1.00  0.20 1 
         89 GLN  1.50  0.90 1 
         90 GLU  1.60  1.20 1 
         91 GLU  1.00 -0.70 1 
         92 ALA  1.30  1.50 1 
         93 GLU  1.20  1.30 1 
         94 ARG  1.60  1.10 1 
         95 ALA  0.90  0.50 1 
         96 ALA  1.00  0.90 1 
         98 MET  0.40  0.70 1 
        100 SER -0.60 -0.60 1 
        101 TYR  0.10 -1.00 1 
        102 VAL -3.60 -3.20 1 
    stop_

save_