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 bmr26789_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.71 _LACS_plot.Line_1_terminator_val_y_1 -2.41 _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 -0.99 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 4.58 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 103 MET -4.59 -0.38 0 31 GLU -5.67 -1.08 0 10 ASP 0.82 1.32 1 11 SER -1.88 -2.10 1 13 SER 4.38 2.71 1 14 VAL 4.69 3.87 1 15 ARG 5.59 5.41 1 16 SER 4.03 3.12 1 17 MET 4.47 3.87 1 18 VAL 5.49 4.32 1 19 ALA 4.14 3.21 1 20 MET 4.25 3.64 1 21 THR 6.22 5.15 1 22 LEU 4.24 2.41 1 23 ARG 4.71 3.86 1 24 GLU 3.05 2.45 1 25 ALA -1.06 -0.74 1 27 TYR 0.28 0.17 1 28 ARG -0.45 -0.37 1 29 VAL -3.68 -1.72 1 30 ILE -3.37 -1.45 1 32 ALA -5.71 -1.76 1 33 THR 0.26 0.51 1 34 ASP -2.85 -0.98 1 36 ARG 4.36 2.90 1 37 GLU 1.73 2.22 1 39 LEU 3.84 3.25 1 40 GLU 3.29 2.82 1 41 LYS 3.31 3.18 1 42 ALA 2.81 1.91 1 43 LEU 0.09 -0.08 1 44 SER -0.10 1.26 1 45 GLU -1.81 -0.46 1 47 VAL -2.87 -1.17 1 48 ASP -0.81 1.66 1 49 ALA -4.81 -1.14 1 50 ILE -4.49 -0.95 1 51 ILE -3.45 -1.58 1 52 THR -4.77 -3.69 1 55 ASN 1.59 1.87 1 59 LEU -0.53 0.73 1 60 ASP -0.52 -1.03 1 62 LEU 3.86 3.02 1 64 PHE 3.13 2.31 1 65 ILE 5.82 4.06 1 66 ARG 4.66 4.01 1 67 ALA 2.27 2.19 1 68 PHE 2.35 2.59 1 69 ARG 3.05 1.50 1 70 GLU 0.65 0.62 1 71 HIS -0.10 1.01 1 74 SER 1.07 0.99 1 75 LYS 3.35 2.14 1 79 ILE -4.20 -1.66 1 80 ILE -2.92 -1.70 1 81 PHE -4.96 -1.83 1 82 LEU -4.67 -2.89 1 84 THR 1.69 1.22 1 85 ASP -2.02 -0.39 1 86 SER -0.86 -0.30 1 87 ALA 1.16 1.25 1 88 ASP 3.43 3.00 1 89 THR 4.59 3.20 1 90 LEU 3.37 2.24 1 91 LYS 4.36 3.17 1 92 GLN 4.37 2.72 1 93 GLN 3.40 3.25 1 94 ALA 4.09 2.66 1 95 ARG 4.25 3.00 1 96 GLU 3.00 2.41 1 97 ALA 0.16 0.29 1 99 ALA 0.42 0.28 1 100 MET -1.27 0.20 1 102 TRP -2.87 -0.78 1 104 VAL -1.92 -1.55 1 107 PHE -5.09 -3.51 1 108 THR -3.95 -2.29 1 109 GLN 3.73 3.12 1 111 GLN 3.68 2.35 1 112 LEU 3.78 2.66 1 113 LEU 3.61 2.59 1 114 ALA 4.98 3.79 1 115 VAL 3.96 1.43 1 116 ILE 3.67 2.67 1 117 LYS 2.85 2.65 1 118 LYS 2.33 1.68 1 119 VAL -0.45 0.21 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26789_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.71 _LACS_plot.Line_1_terminator_val_y_1 3.30 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.01 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 103 MET -4.59 4.21 0 31 GLU -5.67 4.59 0 10 ASP 0.82 0.50 1 11 SER -1.88 -0.22 1 13 SER 4.38 -1.67 1 14 VAL 4.69 -0.82 1 15 ARG 5.59 -0.18 1 16 SER 4.03 -0.91 1 17 MET 4.47 -0.60 1 18 VAL 5.49 -1.17 1 19 ALA 4.14 -0.93 1 20 MET 4.25 -0.61 1 21 THR 6.22 -1.07 1 22 LEU 4.24 -1.83 1 23 ARG 4.71 -0.85 1 24 GLU 3.05 -0.60 1 25 ALA -1.06 0.32 1 27 TYR 0.28 -0.11 1 28 ARG -0.45 0.08 1 29 VAL -3.68 1.96 1 30 ILE -3.37 1.92 1 32 ALA -5.71 3.95 1 33 THR 0.26 0.25 1 34 ASP -2.85 1.87 1 36 ARG 4.36 -1.46 1 37 GLU 1.73 0.49 1 39 LEU 3.84 -0.59 1 40 GLU 3.29 -0.47 1 41 LYS 3.31 -0.13 1 42 ALA 2.81 -0.90 1 43 LEU 0.09 -0.17 1 44 SER -0.10 1.36 1 45 GLU -1.81 1.35 1 47 VAL -2.87 1.70 1 48 ASP -0.81 2.47 1 49 ALA -4.81 3.67 1 50 ILE -4.49 3.54 1 51 ILE -3.45 1.87 1 52 THR -4.77 1.08 1 55 ASN 1.59 0.28 1 59 LEU -0.53 1.26 1 60 ASP -0.52 -0.51 1 62 LEU 3.86 -0.84 1 64 PHE 3.13 -0.82 1 65 ILE 5.82 -1.76 1 66 ARG 4.66 -0.65 1 67 ALA 2.27 -0.08 1 68 PHE 2.35 0.24 1 69 ARG 3.05 -1.55 1 70 GLU 0.65 -0.03 1 71 HIS -0.10 1.11 1 74 SER 1.07 -0.08 1 75 LYS 3.35 -1.21 1 79 ILE -4.20 2.54 1 80 ILE -2.92 1.22 1 81 PHE -4.96 3.13 1 82 LEU -4.67 1.78 1 84 THR 1.69 -0.47 1 85 ASP -2.02 1.63 1 86 SER -0.86 0.56 1 87 ALA 1.16 0.09 1 88 ASP 3.43 -0.43 1 89 THR 4.59 -1.39 1 90 LEU 3.37 -1.13 1 91 LYS 4.36 -1.19 1 92 GLN 4.37 -1.65 1 93 GLN 3.40 -0.15 1 94 ALA 4.09 -1.43 1 95 ARG 4.25 -1.25 1 96 GLU 3.00 -0.59 1 97 ALA 0.16 0.13 1 99 ALA 0.42 -0.14 1 100 MET -1.27 1.47 1 102 TRP -2.87 2.09 1 104 VAL -1.92 0.37 1 107 PHE -5.09 1.58 1 108 THR -3.95 1.66 1 109 GLN 3.73 -0.61 1 111 GLN 3.68 -1.33 1 112 LEU 3.78 -1.12 1 113 LEU 3.61 -1.02 1 114 ALA 4.98 -1.19 1 115 VAL 3.96 -2.53 1 116 ILE 3.67 -1.00 1 117 LYS 2.85 -0.20 1 118 LYS 2.33 -0.65 1 119 VAL -0.45 0.66 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26789_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.71 _LACS_plot.Line_1_terminator_val_y_1 0.69 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 91 LYS 4.36 -1.73 0 10 ASP 0.82 0.01 1 11 SER -1.88 0.18 1 13 SER 4.38 -0.27 1 14 VAL 4.69 -0.48 1 15 ARG 5.59 -0.74 1 16 SER 4.03 -0.25 1 17 MET 4.47 -0.25 1 18 VAL 5.49 -0.71 1 19 ALA 4.14 -0.40 1 20 MET 4.25 -0.36 1 21 THR 6.22 -0.47 1 22 LEU 4.24 -0.20 1 23 ARG 4.71 0.45 1 24 GLU 3.05 -0.26 1 25 ALA -1.06 0.16 1 27 TYR 0.28 0.06 1 28 ARG -0.45 0.22 1 29 VAL -3.68 1.21 1 30 ILE -3.37 0.27 1 31 GLU -5.67 0.87 1 32 ALA -5.71 0.38 1 33 THR 0.26 0.06 1 34 ASP -2.85 0.24 1 36 ARG 4.36 -0.33 1 37 GLU 1.73 -0.31 1 39 LEU 3.84 -0.47 1 40 GLU 3.29 -0.48 1 41 LYS 3.31 -0.29 1 42 ALA 2.81 -0.45 1 43 LEU 0.09 0.01 1 44 SER -0.10 0.07 1 45 GLU -1.81 0.20 1 47 VAL -2.87 -0.05 1 48 ASP -0.81 0.29 1 49 ALA -4.81 0.46 1 50 ILE -4.49 0.71 1 51 ILE -3.45 0.78 1 52 THR -4.77 1.24 1 55 ASN 1.59 -0.01 1 59 LEU -0.53 0.08 1 60 ASP -0.52 -0.07 1 62 LEU 3.86 -0.15 1 64 PHE 3.13 -0.26 1 65 ILE 5.82 -0.73 1 66 ARG 4.66 -0.36 1 67 ALA 2.27 -0.11 1 68 PHE 2.35 -0.36 1 69 ARG 3.05 -0.14 1 70 GLU 0.65 -0.26 1 71 HIS -0.10 -0.29 1 74 SER 1.07 -0.74 1 75 LYS 3.35 -0.34 1 79 ILE -4.20 0.82 1 80 ILE -2.92 0.12 1 81 PHE -4.96 0.65 1 82 LEU -4.67 0.81 1 84 THR 1.69 0.22 1 85 ASP -2.02 0.15 1 86 SER -0.86 0.08 1 87 ALA 1.16 -0.22 1 88 ASP 3.43 -0.43 1 89 THR 4.59 -0.42 1 90 LEU 3.37 -0.18 1 92 GLN 4.37 -0.47 1 93 GLN 3.40 -0.40 1 94 ALA 4.09 -0.67 1 95 ARG 4.25 -0.18 1 96 GLU 3.00 -0.41 1 97 ALA 0.16 -0.09 1 99 ALA 0.42 0.02 1 100 MET -1.27 0.16 1 102 TRP -2.87 0.94 1 103 MET -4.59 -0.08 1 104 VAL -1.92 0.41 1 107 PHE -5.09 0.81 1 108 THR -3.95 0.29 1 109 GLN 3.73 -0.28 1 111 GLN 3.68 -0.46 1 112 LEU 3.78 -0.53 1 113 LEU 3.61 -0.22 1 114 ALA 4.98 -0.30 1 115 VAL 3.96 -0.53 1 116 ILE 3.67 -0.33 1 117 LYS 2.85 -0.25 1 118 LYS 2.33 -0.01 1 119 VAL -0.45 0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26789_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.71 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.80 _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 6.22 _LACS_plot.Line_2_terminator_val_y_2 2.65 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ARG 4.71 5.53 0 10 ASP 0.82 0.52 1 13 SER 4.38 2.85 1 14 VAL 4.69 1.71 1 15 ARG 5.59 1.84 1 16 SER 4.03 1.99 1 17 MET 4.47 3.45 1 18 VAL 5.49 0.76 1 19 ALA 4.14 1.56 1 20 MET 4.25 2.61 1 21 THR 6.22 2.12 1 22 LEU 4.24 1.74 1 24 GLU 3.05 0.69 1 25 ALA -1.06 -1.11 1 27 TYR 0.28 0.05 1 28 ARG -0.45 -0.86 1 29 VAL -3.68 -0.45 1 30 ILE -3.37 -2.23 1 31 GLU -5.67 -1.50 1 32 ALA -5.71 -1.96 1 33 THR 0.26 -1.65 1 34 ASP -2.85 0.04 1 36 ARG 4.36 2.58 1 37 GLU 1.73 2.65 1 39 LEU 3.84 -0.38 1 40 GLU 3.29 4.37 1 41 LYS 3.31 1.33 1 42 ALA 2.81 -0.21 1 43 LEU 0.09 0.67 1 44 SER -0.10 -0.84 1 47 VAL -2.87 -1.92 1 48 ASP -0.81 -0.97 1 49 ALA -4.81 -3.34 1 50 ILE -4.49 -2.96 1 51 ILE -3.45 -2.41 1 52 THR -4.77 -2.91 1 60 ASP -0.52 -1.04 1 62 LEU 3.86 1.62 1 64 PHE 3.13 0.49 1 65 ILE 5.82 1.24 1 66 ARG 4.66 2.64 1 67 ALA 2.27 3.16 1 68 PHE 2.35 1.76 1 69 ARG 3.05 0.51 1 70 GLU 0.65 0.16 1 74 SER 1.07 1.33 1 79 ILE -4.20 -1.13 1 80 ILE -2.92 -2.94 1 84 THR 1.69 -0.17 1 85 ASP -2.02 -0.94 1 86 SER -0.86 -0.22 1 87 ALA 1.16 0.69 1 88 ASP 3.43 0.03 1 90 LEU 3.37 0.31 1 91 LYS 4.36 2.26 1 92 GLN 4.37 2.30 1 93 GLN 3.40 2.99 1 94 ALA 4.09 1.09 1 95 ARG 4.25 4.37 1 96 GLU 3.00 1.39 1 97 ALA 0.16 -0.87 1 99 ALA 0.42 -0.80 1 100 MET -1.27 -0.25 1 103 MET -4.59 -3.51 1 104 VAL -1.92 -0.36 1 107 PHE -5.09 -1.09 1 108 THR -3.95 0.83 1 109 GLN 3.73 2.60 1 111 GLN 3.68 0.13 1 112 LEU 3.78 1.17 1 113 LEU 3.61 3.05 1 114 ALA 4.98 1.16 1 115 VAL 3.96 1.09 1 116 ILE 3.67 2.21 1 117 LYS 2.85 1.82 1 118 LYS 2.33 -0.01 1 119 VAL -0.45 -0.61 1 stop_ save_