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 bmr19000_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 -2.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.65 _LACS_plot.Line_2_terminator_val_x_2 7.05 _LACS_plot.Line_2_terminator_val_y_2 5.65 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 ILE -5.62 -2.28 0 100 HIS 3.63 6.49 0 76 LYS 5.75 0.78 0 27 LYS 0.90 0.67 1 28 THR -0.22 0.00 1 29 ALA 0.19 0.44 1 30 LYS -0.25 -0.06 1 31 LEU -0.21 -0.23 1 33 ASN 1.59 0.70 1 34 GLU 5.06 5.06 1 35 GLU 4.40 3.52 1 36 LYS 3.51 3.37 1 37 LEU 3.88 2.94 1 38 VAL 7.06 5.41 1 39 LYS 4.86 4.33 1 40 LYS 3.56 2.04 1 41 ALA 2.92 3.14 1 42 LEU 4.02 2.83 1 43 GLU 3.06 2.90 1 44 ILE 4.34 2.68 1 47 LYS 4.51 3.48 1 48 MET 3.17 4.11 1 49 ALA 5.05 2.94 1 50 LYS 3.73 2.69 1 51 MET 3.64 3.07 1 52 GLN 0.05 -0.09 1 54 PHE -0.92 -0.62 1 55 ASP -0.97 -1.05 1 56 LEU -1.25 -2.77 1 58 GLN -0.84 -0.09 1 59 SER -0.76 -0.23 1 63 VAL 3.69 2.95 1 64 ARG 3.95 3.57 1 65 VAL 4.68 4.04 1 66 LYS 5.15 3.91 1 67 ALA 2.45 2.61 1 68 VAL 6.56 4.98 1 69 TYR 3.92 3.89 1 70 LEU 3.58 2.65 1 71 PHE 4.02 2.86 1 72 LEU 3.26 2.06 1 73 VAL 4.64 3.24 1 74 ASP 4.09 3.24 1 75 ALA 0.33 -0.84 1 77 GLN -0.12 0.59 1 79 ALA -0.23 -0.81 1 81 LEU -0.19 0.00 1 83 ASP 4.04 3.05 1 84 SER 1.96 0.84 1 85 LYS -2.17 -1.63 1 86 LEU 0.90 -1.03 1 87 ASP -3.59 -1.96 1 89 ALA 3.88 3.00 1 90 ASN 2.93 3.57 1 91 ILE 6.14 5.31 1 92 LYS 6.06 5.29 1 93 HIS 3.87 4.57 1 94 ARG 3.75 2.21 1 95 LEU 3.56 3.07 1 96 ALA 3.20 3.00 1 97 LEU 2.45 2.77 1 98 TRP 4.98 3.07 1 99 ILE -0.25 -1.80 1 101 ALA 1.79 1.31 1 102 ALA -0.59 -0.51 1 103 LEU 0.32 0.03 1 105 ASP 3.05 2.41 1 107 ASP 3.37 1.20 1 109 LEU 0.02 -0.65 1 110 LYS 1.18 1.72 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19000_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 3.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.35 _LACS_plot.Line_2_terminator_val_x_2 7.05 _LACS_plot.Line_2_terminator_val_y_2 -1.40 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 ILE -5.62 3.34 0 100 HIS 3.63 2.86 0 76 LYS 5.75 -4.97 0 27 LYS 0.90 -0.23 1 28 THR -0.22 0.22 1 29 ALA 0.19 0.25 1 30 LYS -0.25 0.19 1 31 LEU -0.21 -0.02 1 33 ASN 1.59 -0.89 1 34 GLU 5.06 0.00 1 35 GLU 4.40 -0.88 1 36 LYS 3.51 -0.14 1 37 LEU 3.88 -0.94 1 38 VAL 7.06 -1.65 1 39 LYS 4.86 -0.53 1 40 LYS 3.56 -1.52 1 41 ALA 2.92 0.22 1 42 LEU 4.02 -1.19 1 43 GLU 3.06 -0.16 1 44 ILE 4.34 -1.66 1 47 LYS 4.51 -1.03 1 48 MET 3.17 0.94 1 49 ALA 5.05 -2.11 1 50 LYS 3.73 -1.04 1 51 MET 3.64 -0.57 1 52 GLN 0.05 -0.14 1 54 PHE -0.92 0.30 1 55 ASP -0.97 -0.08 1 56 LEU -1.25 -1.52 1 58 GLN -0.84 0.75 1 59 SER -0.76 0.53 1 63 VAL 3.69 -0.74 1 64 ARG 3.95 -0.38 1 65 VAL 4.68 -0.64 1 66 LYS 5.15 -1.24 1 67 ALA 2.45 0.16 1 68 VAL 6.56 -1.58 1 69 TYR 3.92 -0.03 1 70 LEU 3.58 -0.93 1 71 PHE 4.02 -1.16 1 72 LEU 3.26 -1.20 1 73 VAL 4.64 -1.40 1 74 ASP 4.09 -0.85 1 75 ALA 0.33 -1.17 1 77 GLN -0.12 0.71 1 79 ALA -0.23 -0.58 1 81 LEU -0.19 0.19 1 83 ASP 4.04 -0.99 1 84 SER 1.96 -1.12 1 85 LYS -2.17 0.54 1 86 LEU 0.90 -1.93 1 87 ASP -3.59 1.63 1 89 ALA 3.88 -0.88 1 90 ASN 2.93 0.64 1 91 ILE 6.14 -0.83 1 92 LYS 6.06 -0.77 1 93 HIS 3.87 0.70 1 94 ARG 3.75 -1.54 1 95 LEU 3.56 -0.49 1 96 ALA 3.20 -0.20 1 97 LEU 2.45 0.32 1 98 TRP 4.98 -1.91 1 99 ILE -0.25 -1.55 1 101 ALA 1.79 -0.48 1 102 ALA -0.59 0.08 1 103 LEU 0.32 -0.29 1 105 ASP 3.05 -0.64 1 107 ASP 3.37 -2.17 1 109 LEU 0.02 -0.67 1 110 LYS 1.18 0.54 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19000_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 0.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.04 _LACS_plot.Line_2_terminator_val_x_2 7.05 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 LEU 3.26 -1.16 0 78 ILE -5.62 0.07 0 27 LYS 0.90 -0.01 1 28 THR -0.22 -0.13 1 29 ALA 0.19 -0.11 1 30 LYS -0.25 -0.08 1 31 LEU -0.21 -0.09 1 33 ASN 1.59 -0.03 1 34 GLU 5.06 -0.70 1 35 GLU 4.40 -0.36 1 36 LYS 3.51 -0.31 1 37 LEU 3.88 -0.32 1 38 VAL 7.06 -0.73 1 39 LYS 4.86 -0.44 1 40 LYS 3.56 -0.10 1 41 ALA 2.92 -0.10 1 42 LEU 4.02 -0.26 1 43 GLU 3.06 -0.28 1 44 ILE 4.34 -0.31 1 47 LYS 4.51 -0.24 1 48 MET 3.17 -0.45 1 49 ALA 5.05 -1.13 1 50 LYS 3.73 -0.17 1 51 MET 3.64 -0.28 1 52 GLN 0.05 0.05 1 54 PHE -0.92 -0.07 1 55 ASP -0.97 0.00 1 56 LEU -1.25 0.19 1 58 GLN -0.84 -0.25 1 59 SER -0.76 -0.49 1 63 VAL 3.69 -0.48 1 64 ARG 3.95 -0.47 1 65 VAL 4.68 -0.69 1 66 LYS 5.15 -0.44 1 67 ALA 2.45 -0.20 1 68 VAL 6.56 -0.67 1 69 TYR 3.92 -0.76 1 70 LEU 3.58 -0.93 1 71 PHE 4.02 -0.68 1 73 VAL 4.64 -0.42 1 74 ASP 4.09 -0.45 1 75 ALA 0.33 -0.27 1 76 LYS 5.75 -0.37 1 77 GLN -0.12 -0.24 1 79 ALA -0.23 -0.17 1 81 LEU -0.19 -0.34 1 83 ASP 4.04 -0.41 1 84 SER 1.96 -0.27 1 85 LYS -2.17 0.19 1 86 LEU 0.90 -0.14 1 87 ASP -3.59 -0.06 1 89 ALA 3.88 -0.27 1 90 ASN 2.93 -0.28 1 91 ILE 6.14 -1.05 1 92 LYS 6.06 -0.66 1 93 HIS 3.87 -0.41 1 94 ARG 3.75 -0.28 1 95 LEU 3.56 -0.14 1 96 ALA 3.20 -0.40 1 97 LEU 2.45 -0.42 1 98 TRP 4.98 -0.30 1 99 ILE -0.25 -0.75 1 100 HIS 3.63 -0.99 1 101 ALA 1.79 -0.36 1 102 ALA -0.59 -0.21 1 103 LEU 0.32 -0.43 1 105 ASP 3.05 -0.48 1 107 ASP 3.37 -0.35 1 109 LEU 0.02 -0.02 1 110 LYS 1.18 -0.46 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19000_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 -3.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _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 7.05 _LACS_plot.Line_2_terminator_val_y_2 3.04 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 ILE -5.62 -2.79 0 29 ALA 0.19 -0.71 1 33 ASN 1.59 0.66 1 34 GLU 5.06 0.85 1 35 GLU 4.40 3.13 1 36 LYS 3.51 3.35 1 37 LEU 3.88 1.09 1 38 VAL 7.06 1.25 1 39 LYS 4.86 2.78 1 40 LYS 3.56 1.43 1 41 ALA 2.92 2.86 1 42 LEU 4.02 2.83 1 43 GLU 3.06 2.81 1 44 ILE 4.34 2.83 1 47 LYS 4.51 2.33 1 48 MET 3.17 2.04 1 49 ALA 5.05 2.08 1 50 LYS 3.73 4.66 1 51 MET 3.64 1.41 1 52 GLN 0.05 -0.64 1 55 ASP -0.97 -1.43 1 58 GLN -0.84 -0.78 1 63 VAL 3.69 1.20 1 64 ARG 3.95 1.76 1 65 VAL 4.68 0.78 1 66 LYS 5.15 0.58 1 67 ALA 2.45 2.95 1 68 VAL 6.56 0.57 1 69 TYR 3.92 -0.65 1 70 LEU 3.58 2.34 1 71 PHE 4.02 0.44 1 72 LEU 3.26 2.04 1 73 VAL 4.64 4.72 1 74 ASP 4.09 1.28 1 75 ALA 0.33 -1.40 1 76 LYS 5.75 -0.38 1 77 GLN -0.12 -0.60 1 84 SER 1.96 0.59 1 85 LYS -2.17 -2.45 1 86 LEU 0.90 -2.37 1 89 ALA 3.88 3.14 1 90 ASN 2.93 3.39 1 91 ILE 6.14 1.21 1 92 LYS 6.06 1.02 1 93 HIS 3.87 2.65 1 94 ARG 3.75 3.40 1 95 LEU 3.56 0.63 1 96 ALA 3.20 1.31 1 97 LEU 2.45 2.11 1 98 TRP 4.98 1.89 1 99 ILE -0.25 0.44 1 100 HIS 3.63 3.94 1 101 ALA 1.79 0.09 1 102 ALA -0.59 0.36 1 109 LEU 0.02 -0.94 1 stop_ save_