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 bmr11306_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.02 _LACS_plot.Line_1_terminator_val_y_1 -0.90 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 3.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.98 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 6.85 _LACS_plot.Y_axis_chem_shift_offset -2.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -6.93 1.58 0 63 HIS 3.65 8.08 0 10 GLU 5.40 6.53 1 11 GLN 3.92 4.97 1 12 VAL 6.12 6.72 1 13 ILE 5.11 4.27 1 14 ARG 2.33 4.36 1 15 LYS 3.67 4.98 1 16 TYR -2.00 1.03 1 17 THR -7.02 -0.49 1 18 GLU -5.12 -0.25 1 19 GLU 0.33 3.31 1 20 LEU -2.26 0.59 1 21 LYS 1.75 3.71 1 22 VAL -2.95 0.62 1 23 ALA 0.04 2.09 1 25 GLU 0.94 1.49 1 26 GLU -5.14 0.65 1 27 ASP 0.01 2.48 1 29 ILE 2.92 4.23 1 30 ILE 3.93 6.17 1 32 MET 6.23 3.71 1 33 GLU -3.23 0.10 1 34 LYS 1.27 3.08 1 35 LEU 3.49 4.48 1 36 ALA -0.78 2.23 1 37 VAL -4.13 -0.89 1 38 ALA -0.07 2.44 1 39 SER -1.37 2.16 1 41 TYR 1.79 2.96 1 42 SER 3.66 5.84 1 43 ASP 1.46 3.14 1 44 MET -0.40 2.96 1 45 THR -0.71 2.16 1 46 ASP -0.56 2.15 1 47 SER -0.73 2.18 1 48 LYS 0.77 2.44 1 49 ALA -0.34 3.01 1 50 LEU -2.27 0.74 1 53 MET -0.15 0.48 1 54 VAL 2.42 3.74 1 55 VAL -4.33 0.48 1 57 ARG -5.61 -0.69 1 58 LEU 0.59 2.61 1 59 THR 4.58 6.11 1 60 LYS 2.05 4.15 1 62 SER 3.92 4.74 1 64 ALA -5.05 0.11 1 66 HIS 2.52 6.36 1 67 LEU 5.69 6.07 1 68 LEU 2.38 4.67 1 70 LEU 2.19 4.94 1 71 LEU 3.94 5.77 1 72 ALA 4.54 5.12 1 73 MET 2.80 5.40 1 74 TYR 3.37 6.14 1 76 ASN -0.07 2.56 1 78 ASN 1.68 3.03 1 79 LYS 4.48 2.79 1 80 ASP -1.30 1.27 1 82 SER -3.85 1.13 1 83 LEU -5.01 1.40 1 84 GLN -4.53 -0.16 1 87 SER 3.09 4.61 1 89 LYS 6.06 3.96 1 90 THR 4.96 6.50 1 91 ILE -0.36 2.30 1 92 TYR 0.49 1.61 1 94 GLU 0.75 1.92 1 95 LYS 2.27 2.31 1 96 THR 0.17 2.63 1 98 THR 0.00 2.34 1 99 GLN 0.23 2.28 1 101 TRP -0.04 2.15 1 103 LYS 2.29 2.32 1 104 MET 0.03 2.35 1 105 GLU -0.92 2.17 1 106 VAL -0.02 2.39 1 107 PHE 0.13 2.36 1 108 ARG -0.44 2.23 1 109 SER -0.27 2.27 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11306_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.02 _LACS_plot.Line_1_terminator_val_y_1 6.12 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 2.98 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 0.62 _LACS_plot.Y_axis_chem_shift_offset -2.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 PHE -6.93 8.51 0 63 HIS 3.65 4.43 0 10 GLU 5.40 1.13 1 11 GLN 3.92 1.05 1 12 VAL 6.12 0.60 1 13 ILE 5.11 -0.84 1 14 ARG 2.33 2.03 1 15 LYS 3.67 1.31 1 16 TYR -2.00 3.03 1 17 THR -7.02 6.53 1 18 GLU -5.12 4.87 1 19 GLU 0.33 2.98 1 20 LEU -2.26 2.85 1 21 LYS 1.75 1.96 1 22 VAL -2.95 3.57 1 23 ALA 0.04 2.05 1 25 GLU 0.94 0.55 1 26 GLU -5.14 5.79 1 27 ASP 0.01 2.47 1 29 ILE 2.92 1.31 1 30 ILE 3.93 2.24 1 32 MET 6.23 -2.52 1 33 GLU -3.23 3.33 1 34 LYS 1.27 1.81 1 35 LEU 3.49 0.99 1 36 ALA -0.78 3.01 1 37 VAL -4.13 3.24 1 38 ALA -0.07 2.51 1 39 SER -1.37 3.53 1 41 TYR 1.79 1.17 1 42 SER 3.66 2.18 1 43 ASP 1.46 1.68 1 44 MET -0.40 3.36 1 45 THR -0.71 2.87 1 46 ASP -0.56 2.71 1 47 SER -0.73 2.91 1 48 LYS 0.77 1.67 1 49 ALA -0.34 3.35 1 50 LEU -2.27 3.01 1 53 MET -0.15 0.63 1 54 VAL 2.42 1.32 1 55 VAL -4.33 4.81 1 57 ARG -5.61 4.92 1 58 LEU 0.59 2.02 1 59 THR 4.58 1.53 1 60 LYS 2.05 2.10 1 62 SER 3.92 0.82 1 64 ALA -5.05 5.16 1 66 HIS 2.52 3.84 1 67 LEU 5.69 0.38 1 68 LEU 2.38 2.29 1 70 LEU 2.19 2.75 1 71 LEU 3.94 1.83 1 72 ALA 4.54 0.58 1 73 MET 2.80 2.60 1 74 TYR 3.37 2.77 1 76 ASN -0.07 2.63 1 78 ASN 1.68 1.35 1 79 LYS 4.48 -1.69 1 80 ASP -1.30 2.57 1 82 SER -3.85 4.98 1 83 LEU -5.01 6.41 1 84 GLN -4.53 4.37 1 87 SER 3.09 1.52 1 89 LYS 6.06 -2.10 1 90 THR 4.96 1.54 1 91 ILE -0.36 2.66 1 92 TYR 0.49 1.12 1 94 GLU 0.75 1.17 1 95 LYS 2.27 0.04 1 96 THR 0.17 2.46 1 98 THR 0.00 2.34 1 99 GLN 0.23 2.05 1 101 TRP -0.04 2.19 1 103 LYS 2.29 0.03 1 104 MET 0.03 2.32 1 105 GLU -0.92 3.09 1 106 VAL -0.02 2.41 1 107 PHE 0.13 2.23 1 108 ARG -0.44 2.67 1 109 SER -0.27 2.54 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11306_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.02 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 SER -1.37 -1.77 0 10 GLU 5.40 -0.66 1 11 GLN 3.92 -0.35 1 12 VAL 6.12 -0.84 1 13 ILE 5.11 -0.71 1 14 ARG 2.33 -0.43 1 15 LYS 3.67 -0.37 1 16 TYR -2.00 0.53 1 17 THR -7.02 1.19 1 18 GLU -5.12 0.34 1 19 GLU 0.33 0.07 1 20 LEU -2.26 0.39 1 21 LYS 1.75 0.00 1 22 VAL -2.95 0.11 1 23 ALA 0.04 -0.29 1 25 GLU 0.94 0.06 1 26 GLU -5.14 0.25 1 27 ASP 0.01 0.17 1 29 ILE 2.92 0.40 1 30 ILE 3.93 -0.03 1 32 MET 6.23 -0.05 1 33 GLU -3.23 0.46 1 34 LYS 1.27 0.18 1 35 LEU 3.49 -0.64 1 36 ALA -0.78 -0.20 1 37 VAL -4.13 0.54 1 38 ALA -0.07 -0.28 1 41 TYR 1.79 0.12 1 42 SER 3.66 -0.37 1 43 ASP 1.46 0.10 1 44 MET -0.40 0.19 1 45 THR -0.71 0.22 1 46 ASP -0.56 0.16 1 47 SER -0.73 0.06 1 48 LYS 0.77 0.17 1 49 ALA -0.34 0.08 1 50 LEU -2.27 0.25 1 53 MET -0.15 0.53 1 54 VAL 2.42 0.08 1 55 VAL -4.33 0.88 1 57 ARG -5.61 1.08 1 58 LEU 0.59 0.66 1 59 THR 4.58 -0.33 1 60 LYS 2.05 0.41 1 62 SER 3.92 -0.25 1 63 HIS 3.65 -0.11 1 64 ALA -5.05 1.09 1 65 PHE -6.93 0.51 1 66 HIS 2.52 0.44 1 67 LEU 5.69 -0.21 1 68 LEU 2.38 -0.25 1 70 LEU 2.19 -0.47 1 71 LEU 3.94 -0.36 1 72 ALA 4.54 -0.44 1 73 MET 2.80 -0.40 1 74 TYR 3.37 -0.33 1 76 ASN -0.07 0.17 1 78 ASN 1.68 -0.28 1 79 LYS 4.48 -0.90 1 80 ASP -1.30 0.10 1 82 SER -3.85 0.90 1 83 LEU -5.01 0.50 1 84 GLN -4.53 0.93 1 87 SER 3.09 0.03 1 89 LYS 6.06 -0.16 1 90 THR 4.96 -0.28 1 91 ILE -0.36 0.29 1 92 TYR 0.49 -0.47 1 94 GLU 0.75 0.23 1 95 LYS 2.27 0.04 1 96 THR 0.17 0.08 1 98 THR 0.00 0.05 1 99 GLN 0.23 -0.01 1 101 TRP -0.04 0.07 1 103 LYS 2.29 0.04 1 104 MET 0.03 0.06 1 105 GLU -0.92 0.00 1 106 VAL -0.02 -0.01 1 107 PHE 0.13 0.09 1 108 ARG -0.44 -0.32 1 109 SER -0.27 0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11306_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.02 _LACS_plot.Line_1_terminator_val_y_1 0.15 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 2.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.46 _LACS_plot.Line_2_terminator_val_x_2 6.23 _LACS_plot.Line_2_terminator_val_y_2 3.51 _LACS_plot.Y_axis_chem_shift_offset -2.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 LEU 0.59 -5.76 0 10 GLU 5.40 3.65 1 11 GLN 3.92 5.31 1 12 VAL 6.12 2.48 1 13 ILE 5.11 5.72 1 14 ARG 2.33 3.50 1 15 LYS 3.67 3.99 1 16 TYR -2.00 0.30 1 17 THR -7.02 1.35 1 18 GLU -5.12 1.37 1 19 GLU 0.33 2.10 1 20 LEU -2.26 1.20 1 21 LYS 1.75 2.44 1 22 VAL -2.95 0.84 1 23 ALA 0.04 1.83 1 25 GLU 0.94 1.30 1 26 GLU -5.14 0.31 1 27 ASP 0.01 2.45 1 29 ILE 2.92 2.01 1 30 ILE 3.93 2.31 1 32 MET 6.23 1.55 1 33 GLU -3.23 2.26 1 34 LYS 1.27 3.37 1 35 LEU 3.49 0.91 1 36 ALA -0.78 1.70 1 37 VAL -4.13 -0.68 1 38 ALA -0.07 1.53 1 39 SER -1.37 5.52 1 41 TYR 1.79 2.55 1 42 SER 3.66 2.21 1 43 ASP 1.46 2.46 1 44 MET -0.40 2.00 1 45 THR -0.71 0.81 1 46 ASP -0.56 1.89 1 47 SER -0.73 2.98 1 48 LYS 0.77 2.76 1 49 ALA -0.34 1.91 1 50 LEU -2.27 -0.22 1 53 MET -0.15 3.37 1 54 VAL 2.42 2.54 1 55 VAL -4.33 0.47 1 57 ARG -5.61 2.56 1 59 THR 4.58 4.00 1 60 LYS 2.05 2.40 1 62 SER 3.92 0.89 1 63 HIS 3.65 1.11 1 64 ALA -5.05 -1.20 1 65 PHE -6.93 3.45 1 66 HIS 2.52 6.66 1 67 LEU 5.69 3.74 1 68 LEU 2.38 3.27 1 70 LEU 2.19 3.03 1 71 LEU 3.94 2.64 1 72 ALA 4.54 4.49 1 73 MET 2.80 5.77 1 74 TYR 3.37 5.49 1 76 ASN -0.07 2.71 1 78 ASN 1.68 3.02 1 79 LYS 4.48 1.92 1 80 ASP -1.30 3.57 1 82 SER -3.85 0.60 1 83 LEU -5.01 -1.41 1 84 GLN -4.53 1.22 1 87 SER 3.09 2.89 1 89 LYS 6.06 1.52 1 90 THR 4.96 0.52 1 91 ILE -0.36 0.43 1 92 TYR 0.49 1.20 1 94 GLU 0.75 1.90 1 95 LYS 2.27 2.71 1 96 THR 0.17 2.79 1 98 THR 0.00 2.07 1 99 GLN 0.23 2.12 1 101 TRP -0.04 3.06 1 103 LYS 2.29 2.24 1 104 MET 0.03 2.10 1 105 GLU -0.92 1.88 1 106 VAL -0.02 1.76 1 107 PHE 0.13 1.96 1 108 ARG -0.44 1.68 1 109 SER -0.27 2.20 1 stop_ save_