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 bmr17355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.52 _LACS_plot.Line_1_terminator_val_y_1 -2.66 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.34 _LACS_plot.Line_2_terminator_val_x_2 7.04 _LACS_plot.Line_2_terminator_val_y_2 5.70 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 HIS 4.12 1.19 0 28 GLU 3.18 0.34 0 29 LEU -5.25 -1.60 0 77 THR -6.52 -2.95 0 11 ALA -0.32 0.00 1 12 ALA -0.50 -0.04 1 13 THR 0.00 0.27 1 15 ALA 1.87 2.87 1 16 LEU 4.79 3.72 1 17 GLU 4.00 3.31 1 18 LEU 3.31 3.37 1 19 VAL 6.74 5.76 1 20 ARG 5.19 4.99 1 21 HIS 5.44 5.54 1 22 LEU 2.57 3.06 1 23 VAL 6.51 4.98 1 24 ALA 4.50 3.44 1 25 GLU 2.61 2.66 1 26 ARG 1.91 1.09 1 27 ALA -0.55 -0.37 1 31 VAL 4.33 3.29 1 32 GLU 3.65 2.53 1 33 VAL 0.41 -0.40 1 34 LEU -0.41 -0.22 1 35 ARG -2.39 -1.38 1 36 ASP 3.76 3.06 1 37 ASP -0.55 -1.55 1 38 SER 2.74 2.89 1 39 ARG -0.77 -0.95 1 40 PHE 5.11 5.17 1 41 LEU 4.32 3.01 1 42 ASP 3.40 3.51 1 43 ASP 1.31 1.91 1 44 LEU 0.11 -0.62 1 46 MET -2.35 0.25 1 47 SER -3.69 -1.60 1 48 SER 5.47 3.96 1 49 ILE 3.85 3.11 1 50 THR 6.21 4.63 1 51 VAL 7.05 5.24 1 53 GLN 4.75 3.22 1 54 LEU 3.53 3.56 1 55 VAL 6.18 4.67 1 56 ASN 3.85 3.46 1 57 GLU 3.41 2.90 1 58 ALA 3.44 2.73 1 59 ALA 4.32 3.37 1 60 ARG 4.54 3.61 1 61 ALA 3.21 2.41 1 62 MET -0.94 0.99 1 64 LEU -2.88 -1.50 1 65 SER -0.36 0.02 1 66 ALA -0.09 0.12 1 67 VAL -0.78 -0.19 1 68 ALA -0.55 -0.43 1 69 MET -0.58 -0.30 1 71 THR 1.35 1.07 1 72 ASN 0.50 -0.24 1 73 PHE 2.51 1.91 1 74 ALA 2.14 2.20 1 75 THR -0.87 -1.13 1 76 ALA -1.13 0.43 1 78 VAL 6.20 5.25 1 79 ARG 4.30 3.57 1 80 GLU 2.52 2.83 1 81 MET 3.61 3.63 1 82 ALA 4.17 3.50 1 83 GLU 3.31 2.88 1 84 ALA 3.42 2.47 1 85 LEU 3.27 2.75 1 86 GLU 2.56 2.53 1 87 ALA 2.68 2.01 1 88 ARG 2.23 1.44 1 89 GLU 2.25 2.26 1 90 ARG 1.40 1.41 1 91 GLU -0.43 0.09 1 92 ALA 0.23 0.57 1 94 HIS 0.25 1.04 1 95 LEU -0.18 0.13 1 96 GLU -0.31 0.11 1 98 HIS 0.98 2.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.52 _LACS_plot.Line_1_terminator_val_y_1 3.86 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.66 _LACS_plot.Line_2_terminator_val_x_2 7.04 _LACS_plot.Line_2_terminator_val_y_2 -1.34 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 HIS 4.12 -2.93 0 28 GLU 3.18 -2.84 0 29 LEU -5.25 3.65 0 77 THR -6.52 3.57 0 11 ALA -0.32 0.32 1 12 ALA -0.50 0.46 1 13 THR 0.00 0.27 1 15 ALA 1.87 1.00 1 16 LEU 4.79 -1.07 1 17 GLU 4.00 -0.69 1 18 LEU 3.31 0.06 1 19 VAL 6.74 -0.98 1 20 ARG 5.19 -0.20 1 21 HIS 5.44 0.10 1 22 LEU 2.57 0.49 1 23 VAL 6.51 -1.53 1 24 ALA 4.50 -1.06 1 25 GLU 2.61 0.05 1 26 ARG 1.91 -0.82 1 27 ALA -0.55 0.18 1 31 VAL 4.33 -1.04 1 32 GLU 3.65 -1.12 1 33 VAL 0.41 -0.81 1 34 LEU -0.41 0.19 1 35 ARG -2.39 1.01 1 36 ASP 3.76 -0.70 1 37 ASP -0.55 -1.00 1 38 SER 2.74 0.15 1 39 ARG -0.77 -0.18 1 40 PHE 5.11 0.06 1 41 LEU 4.32 -1.31 1 42 ASP 3.40 0.11 1 43 ASP 1.31 0.60 1 44 LEU 0.11 -0.73 1 46 MET -2.35 2.60 1 47 SER -3.69 2.09 1 48 SER 5.47 -1.51 1 49 ILE 3.85 -0.74 1 50 THR 6.21 -1.58 1 51 VAL 7.05 -1.81 1 53 GLN 4.75 -1.53 1 54 LEU 3.53 0.03 1 55 VAL 6.18 -1.51 1 56 ASN 3.85 -0.39 1 57 GLU 3.41 -0.51 1 58 ALA 3.44 -0.71 1 59 ALA 4.32 -0.95 1 60 ARG 4.54 -0.93 1 61 ALA 3.21 -0.80 1 62 MET -0.94 1.93 1 64 LEU -2.88 1.38 1 65 SER -0.36 0.38 1 66 ALA -0.09 0.21 1 67 VAL -0.78 0.59 1 68 ALA -0.55 0.12 1 69 MET -0.58 0.28 1 71 THR 1.35 -0.28 1 72 ASN 0.50 -0.74 1 73 PHE 2.51 -0.60 1 74 ALA 2.14 0.06 1 75 THR -0.87 -0.26 1 76 ALA -1.13 1.56 1 78 VAL 6.20 -0.95 1 79 ARG 4.30 -0.73 1 80 GLU 2.52 0.31 1 81 MET 3.61 0.02 1 82 ALA 4.17 -0.67 1 83 GLU 3.31 -0.43 1 84 ALA 3.42 -0.95 1 85 LEU 3.27 -0.52 1 86 GLU 2.56 -0.03 1 87 ALA 2.68 -0.67 1 88 ARG 2.23 -0.79 1 89 GLU 2.25 0.01 1 90 ARG 1.40 0.01 1 91 GLU -0.43 0.52 1 92 ALA 0.23 0.34 1 94 HIS 0.25 0.79 1 95 LEU -0.18 0.31 1 96 GLU -0.31 0.42 1 98 HIS 0.98 1.32 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.52 _LACS_plot.Line_1_terminator_val_y_1 0.49 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _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 7.04 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 LEU 4.32 0.18 0 11 ALA -0.32 -0.06 1 12 ALA -0.50 0.06 1 13 THR 0.00 0.00 1 15 ALA 1.87 -0.18 1 16 LEU 4.79 -0.47 1 17 GLU 4.00 -0.37 1 18 LEU 3.31 -0.18 1 19 VAL 6.74 -0.70 1 20 ARG 5.19 -0.76 1 21 HIS 5.44 -0.59 1 22 LEU 2.57 -0.26 1 23 VAL 6.51 -0.69 1 24 ALA 4.50 -0.47 1 25 GLU 2.61 -0.31 1 26 ARG 1.91 -0.09 1 27 ALA -0.55 0.02 1 28 GLU 3.18 -0.48 1 29 LEU -5.25 0.22 1 31 VAL 4.33 -0.58 1 32 GLU 3.65 -0.30 1 33 VAL 0.41 0.09 1 34 LEU -0.41 -0.23 1 35 ARG -2.39 0.24 1 36 ASP 3.76 -0.48 1 37 ASP -0.55 -0.03 1 38 SER 2.74 -0.32 1 39 ARG -0.77 0.18 1 40 PHE 5.11 -0.70 1 42 ASP 3.40 -0.46 1 43 ASP 1.31 0.27 1 44 LEU 0.11 -0.07 1 45 HIS 4.12 -0.15 1 46 MET -2.35 0.13 1 47 SER -3.69 0.09 1 48 SER 5.47 -0.77 1 49 ILE 3.85 -0.36 1 50 THR 6.21 -0.47 1 51 VAL 7.05 -1.03 1 53 GLN 4.75 -0.25 1 54 LEU 3.53 -0.29 1 55 VAL 6.18 -0.58 1 56 ASN 3.85 -0.27 1 57 GLU 3.41 -0.28 1 58 ALA 3.44 -0.45 1 59 ALA 4.32 -0.50 1 60 ARG 4.54 -0.24 1 61 ALA 3.21 -0.18 1 62 MET -0.94 -0.18 1 64 LEU -2.88 0.19 1 65 SER -0.36 -0.14 1 66 ALA -0.09 -0.11 1 67 VAL -0.78 -0.07 1 68 ALA -0.55 -0.01 1 69 MET -0.58 -0.08 1 71 THR 1.35 -0.28 1 72 ASN 0.50 -0.04 1 73 PHE 2.51 -0.28 1 74 ALA 2.14 -0.25 1 75 THR -0.87 0.13 1 76 ALA -1.13 0.39 1 77 THR -6.52 0.67 1 78 VAL 6.20 -0.70 1 79 ARG 4.30 -0.46 1 80 GLU 2.52 -0.32 1 81 MET 3.61 -0.32 1 82 ALA 4.17 -0.41 1 83 GLU 3.31 -0.32 1 84 ALA 3.42 -0.08 1 85 LEU 3.27 -0.39 1 86 GLU 2.56 -0.30 1 87 ALA 2.68 -0.18 1 88 ARG 2.23 -0.14 1 89 GLU 2.25 -0.30 1 90 ARG 1.40 -0.13 1 91 GLU -0.43 -0.10 1 92 ALA 0.23 -0.07 1 94 HIS 0.25 -0.09 1 95 LEU -0.18 -0.05 1 96 GLU -0.31 -0.17 1 98 HIS 0.98 -0.37 1 stop_ save_