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            bmr5145_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CA 
    _LACS_plot.Line_1_terminator_val_x_1  -4.40 
    _LACS_plot.Line_1_terminator_val_y_1  -1.99 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  0.83 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  -1.74 
    _LACS_plot.Line_2_terminator_val_x_2  6.69 
    _LACS_plot.Line_2_terminator_val_y_2  5.32 
    _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 

         46 ASP  0.40 -1.70 0 
         47 ILE -4.40 -1.60 0 
         10 HIS -0.20 -0.10 1 
         12 ILE -0.10 -0.10 1 
         14 TRP -0.70 -0.50 1 
         15 ASN -0.30 -0.60 1 
         16 ARG  0.60  0.30 1 
         17 LYS  0.10 -0.10 1 
         18 ALA -0.70 -0.60 1 
         19 LEU -0.20 -0.30 1 
         21 SER  0.00 -0.10 1 
         22 THR  0.60  0.20 1 
         23 ALA  0.60  0.50 1 
         24 GLN  0.30  0.20 1 
         25 ILE  0.70  0.50 1 
         26 THR  0.70  0.50 1 
         27 GLU  1.00  0.40 1 
         28 ALA  1.00  0.70 1 
         29 GLN  0.90  0.60 1 
         30 VAL  1.30  0.90 1 
         31 ALA  1.20  0.90 1 
         32 GLU  1.00  0.40 1 
         33 ASN -0.70 -0.80 1 
         34 ARG  0.40  0.20 1 
         37 ALA -0.50  0.50 1 
         38 PHE -2.50 -2.60 1 
         39 ILE -1.20 -0.10 1 
         40 LYS -1.20 -0.90 1 
         41 GLN -0.20  0.00 1 
         43 ARG -0.40 -0.10 1 
         44 LYS  0.90 -0.30 1 
         45 LEU -0.40 -0.40 1 
         48 ASP -1.50 -1.90 1 
         49 PHE  0.60  0.50 1 
         51 ALA  5.00  4.50 1 
         52 GLU  3.70  2.90 1 
         54 ASN  4.50  2.80 1 
         55 ARG  4.20  3.30 1 
         56 TYR  3.60  4.10 1 
         57 TYR  4.80  4.80 1 
         58 GLU  4.30  2.90 1 
         59 ALA -0.70  0.30 1 
         60 ASN -1.50  0.10 1 
         61 TYR  6.60  3.50 1 
         62 TRP  1.90 -0.50 1 
         63 GLN  1.30  0.20 1 
         64 PHE -0.50  0.70 1 
         70 TYR -0.30  1.60 1 
         71 ASN  0.10 -0.80 1 
         74 SER  1.10  0.80 1 
         75 GLU -0.20 -0.50 1 
         76 ALA  0.80  0.50 1 
         77 ASN  1.40  0.30 1 
         78 VAL -0.70 -0.20 1 
         79 THR -2.70 -1.20 1 
         80 LYS  4.70  3.30 1 
         81 GLU  4.50  3.10 1 
         82 ALA  2.70  2.20 1 
         83 PHE  3.40  3.50 1 
         84 VAL  6.70  5.50 1 
         85 THR  6.10  5.10 1 
         88 ILE  5.30  4.50 1 
         89 ASN  4.10  2.80 1 
         90 ALA  3.30  2.40 1 
         91 THR  6.10  4.20 1 
         92 GLN  4.30  3.40 1 
         93 ALA  2.80  1.90 1 
         94 ALA  0.60  0.50 1 
         95 ASN -3.80 -2.00 1 
         96 GLN  5.10  4.40 1 
         98 GLU  1.80  1.20 1 
         99 PHE  1.90  2.20 1 
        100 GLN  0.30 -0.20 1 
        101 LYS  0.80  0.50 1 
        103 ASP  0.00 -0.20 1 
        104 ASN -0.70 -0.60 1 
        105 LYS  4.10  3.30 1 
        106 LEU  3.80  2.30 1 
        107 HIS  5.20  5.10 1 
        108 GLN  3.90  3.40 1 
        109 GLN  4.30  3.60 1 
        110 VAL  5.70  3.80 1 
        111 LEU  3.30  3.10 1 
        112 TRP  3.60  3.30 1 
        113 ARG  4.00  2.00 1 
        114 LEU  3.60  3.60 1 
        115 VAL  6.50  5.10 1 
        116 GLN  5.30  4.20 1 
        117 GLU  3.50  2.10 1 
        118 LEU  3.30  2.90 1 
        120 SER  3.00  2.50 1 
        121 LEU -0.20  0.20 1 
        123 HIS -2.20 -0.60 1 
        125 GLU  2.20  1.20 1 
        126 PHE  0.30 -0.90 1 
        127 TRP -0.90 -1.40 1 
        128 LEU  0.00  0.00 1 
        129 GLU -0.60 -0.90 1 
        130 ARG -0.00 -0.10 1 
    stop_

save_


save_LACS_CACB_CB_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr5145_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CB 
    _LACS_plot.Line_1_terminator_val_x_1  -4.40 
    _LACS_plot.Line_1_terminator_val_y_1  2.41 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -1.17 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.26 
    _LACS_plot.Line_2_terminator_val_x_2  6.69 
    _LACS_plot.Line_2_terminator_val_y_2  -1.37 
    _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 

         46 ASP  0.40 -2.10 0 
         47 ILE -4.40  2.80 0 
         10 HIS -0.20  0.10 1 
         12 ILE -0.10  0.00 1 
         14 TRP -0.70  0.20 1 
         15 ASN -0.30 -0.30 1 
         16 ARG  0.60 -0.30 1 
         17 LYS  0.10 -0.20 1 
         18 ALA -0.70  0.10 1 
         19 LEU -0.20 -0.10 1 
         21 SER  0.00 -0.10 1 
         22 THR  0.60 -0.40 1 
         23 ALA  0.60 -0.10 1 
         24 GLN  0.30 -0.10 1 
         25 ILE  0.70 -0.20 1 
         26 THR  0.70 -0.20 1 
         27 GLU  1.00 -0.60 1 
         28 ALA  1.00 -0.30 1 
         29 GLN  0.90 -0.30 1 
         30 VAL  1.30 -0.40 1 
         31 ALA  1.20 -0.30 1 
         32 GLU  1.00 -0.60 1 
         33 ASN -0.70 -0.10 1 
         34 ARG  0.40 -0.20 1 
         37 ALA -0.50  1.00 1 
         38 PHE -2.50 -0.10 1 
         39 ILE -1.20  1.10 1 
         40 LYS -1.20  0.30 1 
         41 GLN -0.20  0.20 1 
         43 ARG -0.40  0.30 1 
         44 LYS  0.90 -1.20 1 
         45 LEU -0.40  0.00 1 
         48 ASP -1.50 -0.40 1 
         49 PHE  0.60 -0.10 1 
         51 ALA  5.00 -0.50 1 
         52 GLU  3.70 -0.80 1 
         54 ASN  4.50 -1.70 1 
         55 ARG  4.20 -0.90 1 
         56 TYR  3.60  0.50 1 
         57 TYR  4.80  0.00 1 
         58 GLU  4.30 -1.40 1 
         59 ALA -0.70  1.00 1 
         60 ASN -1.50  1.60 1 
         61 TYR  6.60 -3.10 1 
         62 TRP  1.90 -2.40 1 
         63 GLN  1.30 -1.10 1 
         64 PHE -0.50  1.20 1 
         70 TYR -0.30  1.90 1 
         71 ASN  0.10 -0.90 1 
         74 SER  1.10 -0.30 1 
         75 GLU -0.20 -0.30 1 
         76 ALA  0.80 -0.30 1 
         77 ASN  1.40 -1.10 1 
         78 VAL -0.70  0.50 1 
         79 THR -2.70  1.50 1 
         80 LYS  4.70 -1.40 1 
         81 GLU  4.50 -1.40 1 
         82 ALA  2.70 -0.50 1 
         83 PHE  3.40  0.10 1 
         84 VAL  6.70 -1.20 1 
         85 THR  6.10 -1.00 1 
         88 ILE  5.30 -0.80 1 
         89 ASN  4.10 -1.30 1 
         90 ALA  3.30 -0.90 1 
         91 THR  6.10 -1.90 1 
         92 GLN  4.30 -0.90 1 
         93 ALA  2.80 -0.90 1 
         94 ALA  0.60 -0.10 1 
         95 ASN -3.80  1.80 1 
         96 GLN  5.10 -0.70 1 
         98 GLU  1.80 -0.60 1 
         99 PHE  1.90  0.30 1 
        100 GLN  0.30 -0.50 1 
        101 LYS  0.80 -0.30 1 
        103 ASP  0.00 -0.20 1 
        104 ASN -0.70  0.10 1 
        105 LYS  4.10 -0.80 1 
        106 LEU  3.80 -1.50 1 
        107 HIS  5.20 -0.10 1 
        108 GLN  3.90 -0.50 1 
        109 GLN  4.30 -0.70 1 
        110 VAL  5.70 -1.90 1 
        111 LEU  3.30 -0.20 1 
        112 TRP  3.60 -0.30 1 
        113 ARG  4.00 -2.00 1 
        114 LEU  3.60  0.00 1 
        115 VAL  6.50 -1.40 1 
        116 GLN  5.30 -1.10 1 
        117 GLU  3.50 -1.40 1 
        118 LEU  3.30 -0.40 1 
        120 SER  3.00 -0.50 1 
        121 LEU -0.20  0.40 1 
        123 HIS -2.20  1.60 1 
        125 GLU  2.20 -1.00 1 
        126 PHE  0.30 -1.20 1 
        127 TRP -0.90 -0.50 1 
        128 LEU  0.00  0.00 1 
        129 GLU -0.60 -0.30 1 
        130 ARG -0.00 -0.10 1 
    stop_

save_


save_LACS_CACB_HA_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr5145_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               HA 
    _LACS_plot.Line_1_terminator_val_x_1  -4.40 
    _LACS_plot.Line_1_terminator_val_y_1  0.20 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -0.34 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.00 
    _LACS_plot.Line_2_terminator_val_x_2  6.69 
    _LACS_plot.Line_2_terminator_val_y_2  -0.75 
    _LACS_plot.Y_axis_chem_shift_offset   0.17 

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

         47 ILE -4.40 -0.65 0 
         10 HIS -0.20 -0.18 1 
         12 ILE -0.10 -0.22 1 
         14 TRP -0.70 -0.15 1 
         15 ASN -0.30 -0.27 1 
         16 ARG  0.60 -0.39 1 
         17 LYS  0.10 -0.22 1 
         18 ALA -0.70 -0.16 1 
         19 LEU -0.20 -0.23 1 
         21 SER  0.00 -0.14 1 
         22 THR  0.60 -0.20 1 
         23 ALA  0.60 -0.17 1 
         24 GLN  0.30 -0.19 1 
         25 ILE  0.70 -0.12 1 
         26 THR  0.70 -0.17 1 
         27 GLU  1.00 -0.24 1 
         28 ALA  1.00 -0.20 1 
         29 GLN  0.90 -0.22 1 
         30 VAL  1.30 -0.25 1 
         31 ALA  1.20 -0.27 1 
         32 GLU  1.00 -0.36 1 
         33 ASN -0.70 -0.52 1 
         34 ARG  0.40 -0.20 1 
         37 ALA -0.50 -0.34 1 
         38 PHE -2.50  0.38 1 
         39 ILE -1.20 -0.17 1 
         40 LYS -1.20  0.44 1 
         41 GLN -0.20  0.06 1 
         43 ARG -0.40 -0.15 1 
         44 LYS  0.90 -0.38 1 
         45 LEU -0.40 -0.08 1 
         46 ASP  0.40 -0.04 1 
         48 ASP -1.50  0.00 1 
         49 PHE  0.60 -0.37 1 
         51 ALA  5.00 -0.34 1 
         52 GLU  3.70 -0.36 1 
         54 ASN  4.50 -0.03 1 
         55 ARG  4.20 -0.31 1 
         56 TYR  3.60 -0.53 1 
         57 TYR  4.80 -1.03 1 
         58 GLU  4.30 -0.65 1 
         59 ALA -0.70  0.02 1 
         60 ASN -1.50 -0.61 1 
         61 TYR  6.60 -0.91 1 
         62 TRP  1.90 -0.56 1 
         63 GLN  1.30 -0.43 1 
         64 PHE -0.50 -0.50 1 
         70 TYR -0.30 -0.29 1 
         71 ASN  0.10 -0.02 1 
         74 SER  1.10 -0.24 1 
         75 GLU -0.20 -0.20 1 
         76 ALA  0.80 -0.59 1 
         77 ASN  1.40 -0.34 1 
         78 VAL -0.70  0.15 1 
         79 THR -2.70  0.03 1 
         80 LYS  4.70 -0.76 1 
         81 GLU  4.50 -0.46 1 
         82 ALA  2.70 -0.28 1 
         83 PHE  3.40 -0.41 1 
         84 VAL  6.70 -0.89 1 
         85 THR  6.10 -0.68 1 
         88 ILE  5.30 -1.03 1 
         89 ASN  4.10 -0.47 1 
         90 ALA  3.30 -0.30 1 
         91 THR  6.10 -0.27 1 
         92 GLN  4.30 -0.85 1 
         93 ALA  2.80 -0.34 1 
         94 ALA  0.60 -0.19 1 
         95 ASN -3.80  0.31 1 
         96 GLN  5.10 -0.25 1 
         98 GLU  1.80 -0.35 1 
         99 PHE  1.90 -0.32 1 
        100 GLN  0.30 -0.01 1 
        101 LYS  0.80 -0.23 1 
        103 ASP  0.00 -0.27 1 
        104 ASN -0.70 -0.13 1 
        105 LYS  4.10 -0.45 1 
        106 LEU  3.80 -0.44 1 
        107 HIS  5.20 -1.02 1 
        108 GLN  3.90 -0.41 1 
        109 GLN  4.30 -0.30 1 
        110 VAL  5.70 -0.87 1 
        111 LEU  3.30 -0.51 1 
        112 TRP  3.60 -0.29 1 
        113 ARG  4.00 -0.26 1 
        114 LEU  3.60 -0.58 1 
        115 VAL  6.50 -0.72 1 
        116 GLN  5.30 -0.90 1 
        117 GLU  3.50 -0.41 1 
        118 LEU  3.30 -0.43 1 
        120 SER  3.00 -0.22 1 
        121 LEU -0.20 -0.16 1 
        123 HIS -2.20 -0.23 1 
        125 GLU  2.20 -0.52 1 
        126 PHE  0.30 -0.17 1 
        127 TRP -0.90  0.06 1 
        128 LEU  0.00 -0.11 1 
        129 GLU -0.60 -0.20 1 
        130 ARG -0.00 -0.10 1 
    stop_

save_