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            bmr27032_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CA 
    _LACS_plot.Line_1_terminator_val_x_1  -6.00 
    _LACS_plot.Line_1_terminator_val_y_1  -2.06 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  0.90 
    _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  7.22 
    _LACS_plot.Line_2_terminator_val_y_2  5.21 
    _LACS_plot.Y_axis_chem_shift_offset   -0.22 

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

        58 LYS  4.59  0.70 0 
        10 THR  2.43  2.01 1 
        11 PHE -4.73 -0.28 1 
        12 LYS -4.73 -1.45 1 
        13 LEU -2.03 -1.82 1 
        14 ILE  0.39 -0.55 1 
        15 ILE -0.95 -0.29 1 
        16 ASN -0.92 -2.12 1 
        18 LYS  3.07  2.73 1 
        19 THR -0.06  0.37 1 
        20 LEU -4.28 -1.19 1 
        21 LYS -6.00 -2.51 1 
        23 GLU -5.04 -1.35 1 
        24 THR -5.57 -2.06 1 
        25 THR -5.25 -1.84 1 
        26 THR -1.15 -0.05 1 
        27 GLU -3.16 -1.82 1 
        28 ALA -5.95 -1.48 1 
        29 VAL  2.46  1.63 1 
        30 ASP -2.66 -1.42 1 
        31 ALA  3.85  2.41 1 
        32 ALA  3.67  2.43 1 
        33 THR  7.22  5.22 1 
        34 ALA  4.00  2.71 1 
        35 GLU  3.58  3.19 1 
        36 LYS  4.23  3.41 1 
        37 VAL  5.70  4.28 1 
        38 PHE  3.68  2.98 1 
        39 LYS  3.79  3.14 1 
        40 GLN  4.16  2.72 1 
        41 TYR  0.59  1.97 1 
        42 PHE  0.71  0.69 1 
        43 ASN -0.12  0.74 1 
        44 ASP  1.57  1.13 1 
        45 ASN  0.57  0.60 1 
        47 LEU  0.13  0.07 1 
        48 ASP -1.82 -0.96 1 
        50 GLU -2.67 -0.90 1 
        51 TRP -0.40 -0.30 1 
        52 THR -3.69 -1.27 1 
        53 TYR -3.54 -0.67 1 
        54 ASP -4.29 -2.26 1 
        55 ASP  1.02  2.15 1 
        56 ALA  3.32  2.58 1 
        57 THR -1.79 -1.41 1 
        59 THR -2.32  0.37 1 
        60 PHE -3.94 -0.56 1 
        61 THR -1.71  0.05 1 
        62 ILE -3.30 -2.23 1 
        63 THR -1.02 -0.26 1 
        64 GLU -1.37  1.62 1 
    stop_

save_


save_LACS_CACB_CB_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr27032_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CB 
    _LACS_plot.Line_1_terminator_val_x_1  -6.00 
    _LACS_plot.Line_1_terminator_val_y_1  3.94 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -1.10 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.92 
    _LACS_plot.Line_2_terminator_val_x_2  7.22 
    _LACS_plot.Line_2_terminator_val_y_2  -2.01 
    _LACS_plot.Y_axis_chem_shift_offset   -0.22 

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

        58 LYS  4.59 -3.89 0 
        10 THR  2.43 -0.42 1 
        11 PHE -4.73  4.45 1 
        12 LYS -4.73  3.28 1 
        13 LEU -2.03  0.21 1 
        14 ILE  0.39 -0.94 1 
        15 ILE -0.95  0.66 1 
        16 ASN -0.92 -1.20 1 
        18 LYS  3.07 -0.34 1 
        19 THR -0.06  0.43 1 
        20 LEU -4.28  3.09 1 
        21 LYS -6.00  3.49 1 
        23 GLU -5.04  3.69 1 
        24 THR -5.57  3.51 1 
        25 THR -5.25  3.41 1 
        26 THR -1.15  1.10 1 
        27 GLU -3.16  1.34 1 
        28 ALA -5.95  4.47 1 
        29 VAL  2.46 -0.83 1 
        30 ASP -2.66  1.24 1 
        31 ALA  3.85 -1.44 1 
        32 ALA  3.67 -1.24 1 
        33 THR  7.22 -2.00 1 
        34 ALA  4.00 -1.29 1 
        35 GLU  3.58 -0.39 1 
        36 LYS  4.23 -0.82 1 
        37 VAL  5.70 -1.42 1 
        38 PHE  3.68 -0.70 1 
        39 LYS  3.79 -0.65 1 
        40 GLN  4.16 -1.44 1 
        41 TYR  0.59  1.38 1 
        42 PHE  0.71 -0.02 1 
        43 ASN -0.12  0.86 1 
        44 ASP  1.57 -0.44 1 
        45 ASN  0.57  0.03 1 
        47 LEU  0.13 -0.06 1 
        48 ASP -1.82  0.86 1 
        50 GLU -2.67  1.77 1 
        51 TRP -0.40  0.10 1 
        52 THR -3.69  2.42 1 
        53 TYR -3.54  2.87 1 
        54 ASP -4.29  2.03 1 
        55 ASP  1.02  1.13 1 
        56 ALA  3.32 -0.74 1 
        57 THR -1.79  0.38 1 
        59 THR -2.32  2.69 1 
        60 PHE -3.94  3.38 1 
        61 THR -1.71  1.76 1 
        62 ILE -3.30  1.07 1 
        63 THR -1.02  0.76 1 
        64 GLU -1.37  2.99 1 
    stop_

save_


save_LACS_CACB_HA_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr27032_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               HA 
    _LACS_plot.Line_1_terminator_val_x_1  -6.00 
    _LACS_plot.Line_1_terminator_val_y_1  1.01 
    _LACS_plot.Line_1_terminator_val_x_2  2.00 
    _LACS_plot.Line_1_terminator_val_y_2  -0.14 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  0.44 
    _LACS_plot.Line_2_terminator_val_x_2  7.22 
    _LACS_plot.Line_2_terminator_val_y_2  -0.87 
    _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 

        35 GLU  3.58 -1.37 0 
        50 GLU -2.67 -0.65 0 
        10 THR  2.43  0.39 1 
        11 PHE -4.73  0.69 1 
        12 LYS -4.73  1.17 1 
        13 LEU -2.03  0.66 1 
        14 ILE  0.39  0.15 1 
        15 ILE -0.95 -0.28 1 
        16 ASN -0.92  0.60 1 
        18 LYS  3.07 -0.21 1 
        19 THR -0.06  0.10 1 
        20 LEU -4.28  0.74 1 
        21 LYS -6.00  0.87 1 
        23 GLU -5.04  1.30 1 
        24 THR -5.57  1.31 1 
        25 THR -5.25  1.65 1 
        26 THR -1.15  0.44 1 
        27 GLU -3.16  1.14 1 
        28 ALA -5.95  0.62 1 
        29 VAL  2.46  0.04 1 
        30 ASP -2.66  0.02 1 
        31 ALA  3.85 -1.08 1 
        32 ALA  3.67 -0.32 1 
        33 THR  7.22 -0.64 1 
        34 ALA  4.00 -1.09 1 
        36 LYS  4.23 -0.61 1 
        37 VAL  5.70 -0.56 1 
        38 PHE  3.68  0.13 1 
        39 LYS  3.79 -0.09 1 
        40 GLN  4.16 -0.43 1 
        41 TYR  0.59 -0.17 1 
        42 PHE  0.71  0.28 1 
        43 ASN -0.12  0.19 1 
        44 ASP  1.57 -0.06 1 
        45 ASN  0.57  0.02 1 
        47 LEU  0.13  0.21 1 
        48 ASP -1.82  0.26 1 
        51 TRP -0.40  0.86 1 
        52 THR -3.69  0.36 1 
        53 TYR -3.54  0.41 1 
        54 ASP -4.29 -0.08 1 
        55 ASP  1.02 -0.48 1 
        56 ALA  3.32 -0.24 1 
        57 THR -1.79  0.01 1 
        58 LYS  4.59 -0.15 1 
        59 THR -2.32  1.15 1 
        60 PHE -3.94  1.11 1 
        61 THR -1.71  0.81 1 
        62 ILE -3.30  0.18 1 
        63 THR -1.02  0.38 1 
        64 GLU -1.37 -0.06 1 
    stop_

save_


save_LACS_CACB_CO_output
    _LACS_plot.Sf_category                LACS_output 
    _LACS.plot.Input_file_name            bmr27032_21.str 
    _LACS_plot.X_coord_name               CA-CB 
    _LACS_plot.Y_coord_name               CO 
    _LACS_plot.Line_1_terminator_val_x_1  -6.00 
    _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  0.47 
    _LACS_plot.Line_2_terminator_val_x_1  -2.00 
    _LACS_plot.Line_2_terminator_val_y_1  -0.93 
    _LACS_plot.Line_2_terminator_val_x_2  7.22 
    _LACS_plot.Line_2_terminator_val_y_2  2.17 
    _LACS_plot.Y_axis_chem_shift_offset   0.23 

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

        58 LYS  4.59 -1.72 0 
        10 THR  2.43 -0.37 1 
        11 PHE -4.73 -1.47 1 
        12 LYS -4.73 -3.36 1 
        13 LEU -2.03 -2.52 1 
        14 ILE  0.39 -1.89 1 
        15 ILE -0.95 -1.49 1 
        16 ASN -0.92  0.43 1 
        18 LYS  3.07  2.28 1 
        19 THR -0.06 -1.30 1 
        20 LEU -4.28 -3.88 1 
        21 LYS -6.00 -0.53 1 
        23 GLU -5.04 -1.18 1 
        24 THR -5.57 -1.31 1 
        25 THR -5.25 -1.03 1 
        26 THR -1.15 -3.52 1 
        27 GLU -3.16 -0.38 1 
        28 ALA -5.95 -0.29 1 
        29 VAL  2.46 -1.50 1 
        30 ASP -2.66 -2.07 1 
        31 ALA  3.85  1.35 1 
        32 ALA  3.67  3.23 1 
        33 THR  7.22  1.19 1 
        34 ALA  4.00 -0.54 1 
        35 GLU  3.58  0.67 1 
        36 LYS  4.23  2.82 1 
        37 VAL  5.70  2.35 1 
        38 PHE  3.68  3.53 1 
        39 LYS  3.79  1.66 1 
        40 GLN  4.16  1.30 1 
        41 TYR  0.59  0.15 1 
        42 PHE  0.71 -0.75 1 
        43 ASN -0.12  0.58 1 
        44 ASP  1.57 -0.02 1 
        45 ASN  0.57  0.09 1 
        47 LEU  0.13 -2.25 1 
        48 ASP -1.82 -0.93 1 
        50 GLU -2.67  0.19 1 
        51 TRP -0.40  1.08 1 
        52 THR -3.69 -1.75 1 
        53 TYR -3.54 -2.71 1 
        54 ASP -4.29 -1.82 1 
        55 ASP  1.02  1.87 1 
        56 ALA  3.32  2.07 1 
        57 THR -1.79  0.67 1 
        59 THR -2.32  0.12 1 
        60 PHE -3.94 -1.08 1 
        61 THR -1.71 -1.80 1 
        62 ILE -3.30 -2.25 1 
        63 THR -1.02 -0.77 1 
    stop_

save_