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 bmr5885_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.42 _LACS_plot.Line_1_terminator_val_y_1 -0.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.51 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 6.16 _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 67 PHE 3.76 1.13 0 10 ILE 1.70 0.69 1 12 ASP 3.56 3.03 1 14 LEU 4.68 3.05 1 15 ASP 4.57 3.44 1 16 GLU 2.49 2.43 1 17 LEU 3.86 2.87 1 18 GLU 4.18 3.83 1 19 LYS 3.55 2.95 1 20 ALA 3.50 2.37 1 21 LEU 3.79 2.56 1 22 GLU 2.99 2.47 1 23 ALA 1.31 0.98 1 24 LEU -0.71 0.02 1 25 SER 1.70 1.55 1 26 ALA 0.38 0.21 1 27 GLU -1.42 -0.34 1 28 ASP -0.35 0.22 1 31 ASP 2.96 2.51 1 32 ASP 2.39 1.11 1 33 VAL 5.90 4.68 1 36 ARG 4.14 2.91 1 37 LEU 2.74 3.15 1 38 GLU 4.01 3.58 1 40 LEU 3.68 3.01 1 41 LEU 2.92 2.70 1 44 TRP 3.30 3.01 1 45 ASN 3.03 2.08 1 46 SER 2.19 1.77 1 47 ARG 2.68 1.60 1 48 ARG 0.44 -0.21 1 49 ALA -0.01 0.24 1 50 ASP -0.28 -0.15 1 51 ALA -0.19 0.05 1 60 ASP -0.45 -0.47 1 61 ALA 0.08 0.18 1 62 SER 0.00 0.17 1 63 ASP 3.86 2.45 1 64 ASP 4.09 3.31 1 65 GLU 2.84 2.51 1 66 LEU 3.67 2.99 1 68 SER 4.51 3.47 1 69 MET 4.80 3.61 1 70 LEU 4.35 2.53 1 71 ASP 4.41 3.42 1 72 GLN 3.06 2.57 1 73 ARG 2.55 2.09 1 74 PHE -1.32 -2.09 1 78 GLU 0.33 0.46 1 79 ASP 0.95 0.53 1 80 LEU 1.04 0.49 1 81 LEU 1.04 0.57 1 86 ASN 1.28 1.18 1 88 MET 0.49 -0.06 1 89 THR 5.71 4.91 1 90 GLU 4.41 4.34 1 92 LYS 4.45 4.39 1 96 TYR 5.79 5.14 1 97 LEU 4.95 3.90 1 100 THR 7.85 5.95 1 101 VAL 6.76 5.27 1 102 THR 6.32 5.10 1 104 LEU 3.62 3.07 1 105 ASP 5.23 3.63 1 106 SER 4.43 3.39 1 107 VAL 5.36 4.18 1 108 THR 7.04 5.94 1 109 ALA 4.07 2.78 1 110 ARG 3.70 2.63 1 111 LEU 4.46 3.65 1 112 ARG 3.99 3.11 1 113 GLU 2.34 2.24 1 114 VAL 3.31 2.50 1 115 GLU 1.83 2.08 1 116 HIS 1.82 1.42 1 117 ARG 0.83 0.54 1 118 ALA 0.26 0.26 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5885_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.42 _LACS_plot.Line_1_terminator_val_y_1 1.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.49 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 -1.68 _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 67 PHE 3.76 -2.63 0 10 ILE 1.70 -1.01 1 12 ASP 3.56 -0.53 1 14 LEU 4.68 -1.63 1 15 ASP 4.57 -1.13 1 16 GLU 2.49 -0.06 1 17 LEU 3.86 -0.99 1 18 GLU 4.18 -0.35 1 19 LYS 3.55 -0.60 1 20 ALA 3.50 -1.13 1 21 LEU 3.79 -1.23 1 22 GLU 2.99 -0.52 1 23 ALA 1.31 -0.33 1 24 LEU -0.71 0.73 1 25 SER 1.70 -0.15 1 26 ALA 0.38 -0.17 1 27 GLU -1.42 1.08 1 28 ASP -0.35 0.57 1 31 ASP 2.96 -0.45 1 32 ASP 2.39 -1.28 1 33 VAL 5.90 -1.22 1 36 ARG 4.14 -1.23 1 37 LEU 2.74 0.41 1 38 GLU 4.01 -0.43 1 40 LEU 3.68 -0.67 1 41 LEU 2.92 -0.22 1 44 TRP 3.30 -0.29 1 45 ASN 3.03 -0.95 1 46 SER 2.19 -0.42 1 47 ARG 2.68 -1.08 1 48 ARG 0.44 -0.65 1 49 ALA -0.01 0.25 1 50 ASP -0.28 0.13 1 51 ALA -0.19 0.24 1 60 ASP -0.45 -0.02 1 61 ALA 0.08 0.10 1 62 SER 0.00 0.17 1 63 ASP 3.86 -1.41 1 64 ASP 4.09 -0.78 1 65 GLU 2.84 -0.33 1 66 LEU 3.67 -0.68 1 68 SER 4.51 -1.04 1 69 MET 4.80 -1.19 1 70 LEU 4.35 -1.82 1 71 ASP 4.41 -0.99 1 72 GLN 3.06 -0.49 1 73 ARG 2.55 -0.46 1 74 PHE -1.32 -0.77 1 78 GLU 0.33 0.13 1 79 ASP 0.95 -0.42 1 80 LEU 1.04 -0.55 1 81 LEU 1.04 -0.47 1 86 ASN 1.28 -0.10 1 88 MET 0.49 -0.55 1 89 THR 5.71 -0.80 1 90 GLU 4.41 -0.07 1 92 LYS 4.45 -0.06 1 96 TYR 5.79 -0.65 1 97 LEU 4.95 -1.05 1 100 THR 7.85 -1.90 1 101 VAL 6.76 -1.49 1 102 THR 6.32 -1.22 1 104 LEU 3.62 -0.55 1 105 ASP 5.23 -1.60 1 106 SER 4.43 -1.04 1 107 VAL 5.36 -1.18 1 108 THR 7.04 -1.10 1 109 ALA 4.07 -1.29 1 110 ARG 3.70 -1.07 1 111 LEU 4.46 -0.81 1 112 ARG 3.99 -0.88 1 113 GLU 2.34 -0.10 1 114 VAL 3.31 -0.81 1 115 GLU 1.83 0.25 1 116 HIS 1.82 -0.40 1 117 ARG 0.83 -0.29 1 118 ALA 0.26 0.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5885_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.42 _LACS_plot.Line_1_terminator_val_y_1 0.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 -0.51 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 VAL 5.90 -0.96 0 100 THR 7.85 0.00 0 10 ILE 1.70 -0.24 1 12 ASP 3.56 -0.18 1 14 LEU 4.68 -0.39 1 15 ASP 4.57 -0.34 1 16 GLU 2.49 -0.34 1 17 LEU 3.86 -0.38 1 18 GLU 4.18 -0.57 1 19 LYS 3.55 -0.27 1 20 ALA 3.50 -0.14 1 21 LEU 3.79 -0.28 1 22 GLU 2.99 -0.28 1 23 ALA 1.31 0.02 1 24 LEU -0.71 0.05 1 25 SER 1.70 -0.29 1 26 ALA 0.38 0.01 1 27 GLU -1.42 0.05 1 28 ASP -0.35 0.01 1 31 ASP 2.96 0.05 1 32 ASP 2.39 -0.16 1 36 ARG 4.14 -0.19 1 37 LEU 2.74 -0.41 1 38 GLU 4.01 -0.44 1 40 LEU 3.68 -0.20 1 41 LEU 2.92 -0.20 1 44 TRP 3.30 -0.36 1 45 ASN 3.03 -0.28 1 46 SER 2.19 -0.02 1 47 ARG 2.68 -0.17 1 48 ARG 0.44 -0.10 1 49 ALA -0.01 -0.04 1 50 ASP -0.28 -0.05 1 51 ALA -0.19 -0.03 1 60 ASP -0.45 -0.04 1 61 ALA 0.08 0.02 1 62 SER 0.00 -0.08 1 63 ASP 3.86 -0.59 1 64 ASP 4.09 -0.29 1 65 GLU 2.84 -0.33 1 66 LEU 3.67 -0.26 1 67 PHE 3.76 -0.51 1 68 SER 4.51 -0.13 1 69 MET 4.80 -0.35 1 70 LEU 4.35 -0.59 1 71 ASP 4.41 -0.15 1 72 GLN 3.06 -0.27 1 73 ARG 2.55 -0.26 1 74 PHE -1.32 0.39 1 78 GLU 0.33 -0.11 1 79 ASP 0.95 -0.12 1 80 LEU 1.04 -0.10 1 81 LEU 1.04 -0.08 1 86 ASN 1.28 -0.05 1 88 MET 0.49 0.18 1 89 THR 5.71 -0.40 1 90 GLU 4.41 -0.53 1 92 LYS 4.45 -0.39 1 96 TYR 5.79 -0.37 1 97 LEU 4.95 -0.03 1 101 VAL 6.76 -0.55 1 102 THR 6.32 -0.31 1 104 LEU 3.62 -0.18 1 105 ASP 5.23 -0.13 1 106 SER 4.43 -0.11 1 107 VAL 5.36 -0.23 1 108 THR 7.04 -0.50 1 109 ALA 4.07 -0.18 1 110 ARG 3.70 -0.18 1 111 LEU 4.46 -0.24 1 112 ARG 3.99 -0.17 1 113 GLU 2.34 -0.18 1 114 VAL 3.31 -0.13 1 115 GLU 1.83 -0.23 1 116 HIS 1.82 -0.09 1 117 ARG 0.83 -0.05 1 118 ALA 0.26 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5885_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.42 _LACS_plot.Line_1_terminator_val_y_1 -0.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.31 _LACS_plot.Line_2_terminator_val_x_2 7.84 _LACS_plot.Line_2_terminator_val_y_2 2.94 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 101 VAL 6.76 0.97 0 74 PHE -1.32 1.35 0 100 THR 7.85 1.79 0 10 ILE 1.70 -0.08 1 12 ASP 3.56 2.58 1 14 LEU 4.68 0.54 1 15 ASP 4.57 3.05 1 16 GLU 2.49 3.09 1 17 LEU 3.86 -0.16 1 18 GLU 4.18 2.12 1 19 LYS 3.55 2.71 1 20 ALA 3.50 2.63 1 21 LEU 3.79 2.39 1 22 GLU 2.99 1.93 1 23 ALA 1.31 0.97 1 24 LEU -0.71 0.17 1 25 SER 1.70 0.14 1 26 ALA 0.38 -0.19 1 27 GLU -1.42 -0.33 1 28 ASP -0.35 -0.05 1 31 ASP 2.96 0.53 1 32 ASP 2.39 1.30 1 33 VAL 5.90 0.96 1 36 ARG 4.14 3.09 1 37 LEU 2.74 0.79 1 38 GLU 4.01 2.43 1 40 LEU 3.68 1.52 1 41 LEU 2.92 0.17 1 44 TRP 3.30 2.52 1 45 ASN 3.03 2.80 1 46 SER 2.19 0.79 1 47 ARG 2.68 0.49 1 48 ARG 0.44 -0.05 1 49 ALA -0.01 -0.32 1 50 ASP -0.28 -0.74 1 60 ASP -0.45 -0.45 1 61 ALA 0.08 0.25 1 62 SER 0.00 0.78 1 63 ASP 3.86 -0.10 1 64 ASP 4.09 2.75 1 65 GLU 2.84 1.92 1 66 LEU 3.67 0.85 1 67 PHE 3.76 1.99 1 68 SER 4.51 2.74 1 69 MET 4.80 3.08 1 70 LEU 4.35 0.44 1 71 ASP 4.41 3.39 1 72 GLN 3.06 2.13 1 73 ARG 2.55 1.89 1 78 GLU 0.33 -0.15 1 79 ASP 0.95 0.15 1 80 LEU 1.04 -0.20 1 86 ASN 1.28 0.62 1 88 MET 0.49 0.59 1 89 THR 5.71 1.03 1 90 GLU 4.41 0.25 1 92 LYS 4.45 2.08 1 96 TYR 5.79 3.62 1 97 LEU 4.95 0.08 1 102 THR 6.32 2.33 1 104 LEU 3.62 2.39 1 105 ASP 5.23 2.71 1 106 SER 4.43 3.09 1 107 VAL 5.36 1.60 1 108 THR 7.04 1.53 1 109 ALA 4.07 2.65 1 110 ARG 3.70 2.13 1 111 LEU 4.46 0.34 1 112 ARG 3.99 2.61 1 113 GLU 2.34 2.31 1 114 VAL 3.31 1.76 1 115 GLU 1.83 0.71 1 116 HIS 1.82 1.25 1 117 ARG 0.83 -0.02 1 118 ALA 0.26 0.30 1 stop_ save_