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            bmr16298_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CA 
    _LACS_plot.Line_1_terminator_val_x_1  -5.80 
    _LACS_plot.Line_1_terminator_val_y_1  -2.72 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  0.98 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  -1.37 
    _LACS_plot.Line_2_terminator_val_x_2  7.20 
    _LACS_plot.Line_2_terminator_val_y_2  5.59 
    _LACS_plot.Y_axis_chem_shift_offset   -0.09 

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

         83 ARG  6.40  1.20 0 
         10 LEU  2.90  2.30 1 
         11 LYS  3.30  2.90 1 
         12 GLN  2.70  1.70 1 
         13 TYR  1.70  1.30 1 
         14 ALA  0.90  0.80 1 
         15 ASN  1.40  1.40 1 
         16 ASP -0.50  0.50 1 
         17 VAL -2.10 -1.20 1 
         18 LYS  0.60  0.10 1 
         19 VAL  4.10  3.10 1 
         20 SER  3.90  2.40 1 
         21 SER  3.20  2.20 1 
         22 VAL  5.60  4.40 1 
         23 ARG  3.30  2.60 1 
         24 ALA  3.40  2.60 1 
         25 ARG  4.00  2.90 1 
         26 GLU  3.20  3.40 1 
         27 LYS  3.50  3.00 1 
         28 ALA  2.90  2.60 1 
         29 ILE  2.50  2.50 1 
         30 GLN  4.60  2.70 1 
         31 HIS  3.60  3.70 1 
         32 ALA  2.30  2.00 1 
         33 ILE  6.60  5.60 1 
         34 GLU  3.10  2.60 1 
         35 ARG  1.50  0.90 1 
         36 PHE  0.30  0.00 1 
         37 ASN  3.60  4.70 1 
         38 THR  1.00  0.10 1 
         39 LYS  1.10  1.10 1 
         41 ILE  3.30  3.90 1 
         42 GLN  4.80  2.70 1 
         43 THR -0.10  0.10 1 
         44 ILE  2.40  1.20 1 
         45 LYS -3.30 -2.30 1 
         46 LYS  5.20  4.20 1 
         47 HIS  3.00  4.30 1 
         48 ASP  2.20  2.90 1 
         49 TYR  3.00  2.40 1 
         50 GLN  3.20  2.90 1 
         51 ARG  4.20  3.30 1 
         52 PHE  3.20  2.60 1 
         53 VAL  6.40  4.60 1 
         54 ASP  5.00  3.70 1 
         55 ASP  4.40  3.40 1 
         56 ILE  4.90  3.40 1 
         57 SER  4.20  3.40 1 
         58 ALA  0.30  0.30 1 
         59 GLN -1.30  1.00 1 
         60 TYR -5.80 -1.90 1 
         61 SER -0.90 -0.30 1 
         62 LYS  4.80  4.20 1 
         63 ASN  4.30  3.20 1 
         64 TYR  2.40  2.20 1 
         65 VAL  6.70  5.20 1 
         66 ASP  4.90  3.50 1 
         67 SER  3.90  3.10 1 
         68 ILE  5.70  5.30 1 
         69 VAL  5.40  4.60 1 
         70 ALA  3.80  3.20 1 
         71 SER  4.20  4.00 1 
         72 THR  7.20  5.70 1 
         73 ASN  4.80  2.90 1 
         74 MET  5.40  4.20 1 
         75 ILE  6.10  4.00 1 
         76 PHE  5.90  4.60 1 
         77 LYS  3.70  2.90 1 
         78 TYR  3.10  3.30 1 
         79 ALA  2.50  2.10 1 
         80 TYR  2.40  3.00 1 
         81 ASP  4.30  3.20 1 
         82 THR  0.60 -0.30 1 
         84 LEU  0.70  1.50 1 
         85 ILE -5.00 -2.50 1 
         86 LYS -0.20  0.20 1 
         87 ALA -4.00 -1.60 1 
         88 MET -1.50 -0.60 1 
         90 SER -1.00 -1.20 1 
         91 GLU  0.10  0.20 1 
         93 ILE -0.40 -1.30 1 
         94 LYS -1.80 -1.00 1 
         95 ARG -1.00 -1.50 1 
         97 LYS -0.50 -0.10 1 
         98 LYS -0.40 -0.10 1 
         99 LYS -0.20  0.10 1 
        100 VAL -0.00  0.10 1 
        101 SER -0.10 -0.20 1 
        102 VAL  0.20  0.10 1 
        103 GLU -0.30 -0.20 1 
        104 LEU  0.20  0.10 1 
        105 GLU -0.20  0.20 1 
        106 HIS -0.10  1.30 1 
        110 HIS -0.30  0.90 1 
        111 HIS  1.10  2.30 1 
    stop_

save_


save_LACS_CACB_CB_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr16298_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CB 
    _LACS_plot.Line_1_terminator_val_x_1  -5.80 
    _LACS_plot.Line_1_terminator_val_y_1  3.08 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -1.02 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.63 
    _LACS_plot.Line_2_terminator_val_x_2  7.20 
    _LACS_plot.Line_2_terminator_val_y_2  -1.61 
    _LACS_plot.Y_axis_chem_shift_offset   -0.09 

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

         83 ARG  6.40 -5.20 0 
         10 LEU  2.90 -0.60 1 
         11 LYS  3.30 -0.40 1 
         12 GLN  2.70 -1.00 1 
         13 TYR  1.70 -0.40 1 
         14 ALA  0.90 -0.10 1 
         15 ASN  1.40  0.00 1 
         16 ASP -0.50  1.00 1 
         17 VAL -2.10  0.90 1 
         18 LYS  0.60 -0.50 1 
         19 VAL  4.10 -1.00 1 
         20 SER  3.90 -1.50 1 
         21 SER  3.20 -1.00 1 
         22 VAL  5.60 -1.20 1 
         23 ARG  3.30 -0.70 1 
         24 ALA  3.40 -0.80 1 
         25 ARG  4.00 -1.10 1 
         26 GLU  3.20  0.20 1 
         27 LYS  3.50 -0.50 1 
         28 ALA  2.90 -0.30 1 
         29 ILE  2.50  0.00 1 
         30 GLN  4.60 -1.90 1 
         31 HIS  3.60  0.10 1 
         32 ALA  2.30 -0.30 1 
         33 ILE  6.60 -1.00 1 
         34 GLU  3.10 -0.50 1 
         35 ARG  1.50 -0.60 1 
         36 PHE  0.30 -0.30 1 
         37 ASN  3.60  1.10 1 
         38 THR  1.00 -0.90 1 
         39 LYS  1.10  0.00 1 
         41 ILE  3.30  0.60 1 
         42 GLN  4.80 -2.10 1 
         43 THR -0.10  0.20 1 
         44 ILE  2.40 -1.20 1 
         45 LYS -3.30  1.00 1 
         46 LYS  5.20 -1.00 1 
         47 HIS  3.00  1.30 1 
         48 ASP  2.20  0.70 1 
         49 TYR  3.00 -0.60 1 
         50 GLN  3.20 -0.30 1 
         51 ARG  4.20 -0.90 1 
         52 PHE  3.20 -0.60 1 
         53 VAL  6.40 -1.80 1 
         54 ASP  5.00 -1.30 1 
         55 ASP  4.40 -1.00 1 
         56 ILE  4.90 -1.50 1 
         57 SER  4.20 -0.80 1 
         58 ALA  0.30  0.00 1 
         59 GLN -1.30  2.30 1 
         60 TYR -5.80  3.90 1 
         61 SER -0.90  0.60 1 
         62 LYS  4.80 -0.60 1 
         63 ASN  4.30 -1.10 1 
         64 TYR  2.40 -0.20 1 
         65 VAL  6.70 -1.50 1 
         66 ASP  4.90 -1.40 1 
         67 SER  3.90 -0.80 1 
         68 ILE  5.70 -0.40 1 
         69 VAL  5.40 -0.80 1 
         70 ALA  3.80 -0.60 1 
         71 SER  4.20 -0.20 1 
         72 THR  7.20 -1.50 1 
         73 ASN  4.80 -1.90 1 
         74 MET  5.40 -1.20 1 
         75 ILE  6.10 -2.10 1 
         76 PHE  5.90 -1.30 1 
         77 LYS  3.70 -0.80 1 
         78 TYR  3.10  0.20 1 
         79 ALA  2.50 -0.40 1 
         80 TYR  2.40  0.60 1 
         81 ASP  4.30 -1.10 1 
         82 THR  0.60 -0.90 1 
         84 LEU  0.70  0.80 1 
         85 ILE -5.00  2.50 1 
         86 LYS -0.20  0.40 1 
         87 ALA -4.00  2.40 1 
         88 MET -1.50  0.90 1 
         90 SER -1.00 -0.20 1 
         91 GLU  0.10  0.10 1 
         93 ILE -0.40 -0.90 1 
         94 LYS -1.80  0.80 1 
         95 ARG -1.00 -0.50 1 
         97 LYS -0.50  0.40 1 
         98 LYS -0.40  0.30 1 
         99 LYS -0.20  0.30 1 
        100 VAL -0.00  0.10 1 
        101 SER -0.10 -0.10 1 
        102 VAL  0.20 -0.10 1 
        103 GLU -0.30  0.10 1 
        104 LEU  0.20 -0.10 1 
        105 GLU -0.20  0.40 1 
        106 HIS -0.10  1.40 1 
        110 HIS -0.30  1.20 1 
        111 HIS  1.10  1.20 1 
    stop_

save_


save_LACS_CACB_HA_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr16298_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               HA 
    _LACS_plot.Line_1_terminator_val_x_1  -5.80 
    _LACS_plot.Line_1_terminator_val_y_1  0.31 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -0.17 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.08 
    _LACS_plot.Line_2_terminator_val_x_2  7.20 
    _LACS_plot.Line_2_terminator_val_y_2  -0.51 
    _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 

         72 THR  7.20  0.32 0 
         10 LEU  2.90 -1.34 0 
         11 LYS  3.30 -0.48 1 
         12 GLN  2.70 -0.30 1 
         13 TYR  1.70 -0.54 1 
         14 ALA  0.90 -0.50 1 
         15 ASN  1.40 -0.25 1 
         16 ASP -0.50  0.02 1 
         17 VAL -2.10  0.19 1 
         18 LYS  0.60  0.01 1 
         19 VAL  4.10 -0.30 1 
         20 SER  3.90 -0.27 1 
         21 SER  3.20  0.04 1 
         22 VAL  5.60 -0.48 1 
         23 ARG  3.30 -0.16 1 
         24 ALA  3.40 -0.09 1 
         25 ARG  4.00 -0.16 1 
         26 GLU  3.20 -0.52 1 
         27 LYS  3.50 -0.25 1 
         28 ALA  2.90 -0.05 1 
         29 ILE  2.50  0.20 1 
         30 GLN  4.60 -0.39 1 
         31 HIS  3.60 -0.44 1 
         32 ALA  2.30 -0.91 1 
         33 ILE  6.60 -0.56 1 
         34 GLU  3.10 -0.34 1 
         35 ARG  1.50 -0.34 1 
         36 PHE  0.30 -0.04 1 
         37 ASN  3.60 -0.32 1 
         38 THR  1.00 -0.07 1 
         39 LYS  1.10 -0.11 1 
         41 ILE  3.30 -0.18 1 
         42 GLN  4.80 -0.10 1 
         43 THR -0.10  0.11 1 
         44 ILE  2.40 -0.39 1 
         45 LYS -3.30  0.26 1 
         46 LYS  5.20  0.00 1 
         47 HIS  3.00 -0.29 1 
         48 ASP  2.20 -0.14 1 
         49 TYR  3.00  0.11 1 
         50 GLN  3.20 -0.63 1 
         51 ARG  4.20 -0.22 1 
         52 PHE  3.20 -0.31 1 
         53 VAL  6.40 -1.22 1 
         54 ASP  5.00 -0.49 1 
         55 ASP  4.40 -0.25 1 
         56 ILE  4.90 -0.13 1 
         57 SER  4.20 -0.09 1 
         58 ALA  0.30  0.00 1 
         59 GLN -1.30 -0.22 1 
         60 TYR -5.80  0.49 1 
         61 SER -0.90 -0.07 1 
         62 LYS  4.80 -0.43 1 
         63 ASN  4.30 -0.30 1 
         64 TYR  2.40 -0.05 1 
         65 VAL  6.70 -0.93 1 
         66 ASP  4.90 -0.38 1 
         67 SER  3.90 -0.09 1 
         68 ILE  5.70 -0.57 1 
         69 VAL  5.40 -0.45 1 
         70 ALA  3.80 -0.23 1 
         71 SER  4.20 -0.28 1 
         73 ASN  4.80 -0.27 1 
         74 MET  5.40 -0.54 1 
         75 ILE  6.10 -1.28 1 
         76 PHE  5.90 -0.45 1 
         77 LYS  3.70  0.01 1 
         78 TYR  3.10  0.02 1 
         79 ALA  2.50 -0.58 1 
         80 TYR  2.40 -0.24 1 
         81 ASP  4.30 -0.34 1 
         82 THR  0.60 -0.13 1 
         83 ARG  6.40 -0.46 1 
         84 LEU  0.70 -0.15 1 
         85 ILE -5.00  0.61 1 
         86 LYS -0.20 -0.01 1 
         87 ALA -4.00  0.21 1 
         88 MET -1.50 -0.22 1 
         90 SER -1.00 -0.55 1 
         91 GLU  0.10 -0.24 1 
         93 ILE -0.40 -0.10 1 
         94 LYS -1.80  0.14 1 
         95 ARG -1.00 -0.07 1 
         97 LYS -0.50 -0.04 1 
         98 LYS -0.40 -0.04 1 
         99 LYS -0.20 -0.02 1 
        100 VAL -0.00  0.00 1 
        101 SER -0.10  0.02 1 
        102 VAL  0.20 -0.01 1 
        103 GLU -0.30 -0.10 1 
        104 LEU  0.20 -0.09 1 
        105 GLU -0.20 -0.21 1 
        106 HIS -0.10  0.03 1 
        110 HIS -0.30 -0.16 1 
        111 HIS  1.10 -0.34 1 
    stop_

save_


save_LACS_CACB_CO_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr16298_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CO 
    _LACS_plot.Line_1_terminator_val_x_1  -5.80 
    _LACS_plot.Line_1_terminator_val_y_1  -2.21 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  0.96 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  -0.56 
    _LACS_plot.Line_2_terminator_val_x_2  7.20 
    _LACS_plot.Line_2_terminator_val_y_2  2.74 
    _LACS_plot.Y_axis_chem_shift_offset   -0.15 

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

         85 ILE -5.00 -1.80 0 
         45 LYS -3.30  1.30 0 
         81 ASP  4.30 -1.60 0 
         60 TYR -5.80 -1.30 0 
         10 LEU  2.90  1.40 1 
         11 LYS  3.30  1.90 1 
         12 GLN  2.70  1.50 1 
         13 TYR  1.70  0.50 1 
         14 ALA  0.90  0.00 1 
         15 ASN  1.40  0.30 1 
         16 ASP -0.50 -0.40 1 
         17 VAL -2.10 -0.60 1 
         18 LYS  0.60  1.30 1 
         19 VAL  4.10  0.80 1 
         20 SER  3.90  2.60 1 
         21 SER  3.20  1.40 1 
         22 VAL  5.60  1.40 1 
         23 ARG  3.30  2.70 1 
         24 ALA  3.40  3.30 1 
         25 ARG  4.00  1.50 1 
         26 GLU  3.20  2.20 1 
         27 LYS  3.50  2.30 1 
         28 ALA  2.90  2.30 1 
         29 ILE  2.50  1.10 1 
         30 GLN  4.60  1.80 1 
         31 HIS  3.60  3.80 1 
         32 ALA  2.30  0.70 1 
         33 ILE  6.60  1.70 1 
         34 GLU  3.10  1.70 1 
         35 ARG  1.50  1.00 1 
         36 PHE  0.30 -0.80 1 
         37 ASN  3.60  3.20 1 
         38 THR  1.00 -0.10 1 
         41 ILE  3.30 -0.60 1 
         42 GLN  4.80  0.10 1 
         43 THR -0.10 -0.90 1 
         44 ILE  2.40 -1.80 1 
         46 LYS  5.20  2.30 1 
         47 HIS  3.00  3.80 1 
         48 ASP  2.20  2.90 1 
         49 TYR  3.00  0.80 1 
         50 GLN  3.20  1.30 1 
         51 ARG  4.20  1.60 1 
         52 PHE  3.20 -0.20 1 
         53 VAL  6.40  2.70 1 
         54 ASP  5.00  2.90 1 
         55 ASP  4.40  3.90 1 
         56 ILE  4.90  2.20 1 
         57 SER  4.20 -0.10 1 
         58 ALA  0.30  0.00 1 
         59 GLN -1.30 -0.70 1 
         61 SER -0.90  0.00 1 
         62 LYS  4.80  1.30 1 
         63 ASN  4.30  2.40 1 
         64 TYR  2.40  2.50 1 
         65 VAL  6.70  1.30 1 
         66 ASP  4.90  3.00 1 
         67 SER  3.90  2.90 1 
         68 ILE  5.70  3.20 1 
         69 VAL  5.40  1.20 1 
         70 ALA  3.80  3.90 1 
         71 SER  4.20  0.00 1 
         72 THR  7.20  2.20 1 
         73 ASN  4.80  3.20 1 
         74 MET  5.40  2.10 1 
         75 ILE  6.10  1.60 1 
         76 PHE  5.90  1.50 1 
         77 LYS  3.70  0.70 1 
         78 TYR  3.10  2.80 1 
         79 ALA  2.50  0.00 1 
         80 TYR  2.40  3.80 1 
         82 THR  0.60 -1.50 1 
         83 ARG  6.40 -0.30 1 
         84 LEU  0.70  0.50 1 
         86 LYS -0.20 -1.00 1 
         87 ALA -4.00 -1.60 1 
         90 SER -1.00  0.50 1 
         91 GLU  0.10  0.10 1 
         93 ILE -0.40 -0.60 1 
         94 LYS -1.80 -0.50 1 
         97 LYS -0.50 -0.10 1 
         98 LYS -0.40 -0.30 1 
         99 LYS -0.20 -0.20 1 
        100 VAL -0.00 -0.30 1 
        101 SER -0.10 -0.10 1 
        102 VAL  0.20 -0.20 1 
        103 GLU -0.30 -0.20 1 
        104 LEU  0.20 -0.20 1 
        105 GLU -0.20 -0.40 1 
    stop_

save_