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 bmr17476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.79 _LACS_plot.Line_1_terminator_val_y_1 -3.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.43 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 5.81 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 HIS 7.91 8.21 0 10 VAL 0.40 0.15 1 12 GLU -0.58 -0.36 1 13 ILE -2.50 -1.08 1 14 THR -3.56 -1.83 1 15 LYS 4.54 3.62 1 16 GLU 5.14 3.85 1 17 ASP 2.94 3.04 1 18 LEU 4.57 2.90 1 19 ILE 4.77 3.52 1 20 GLN 5.04 3.65 1 21 LYS 2.86 3.36 1 22 SER 3.10 2.58 1 23 LEU 0.57 -0.02 1 25 THR -6.44 -2.68 1 27 GLN 3.57 2.98 1 28 ASP 1.23 2.40 1 30 LYS 4.48 0.75 1 31 VAL 1.07 0.75 1 32 GLN -1.96 -0.30 1 35 ASN 4.01 2.08 1 36 LEU -2.25 -0.43 1 37 TRP -1.79 -1.66 1 38 ALA -4.70 -2.70 1 40 LEU -1.79 -0.73 1 41 GLU 2.04 1.22 1 42 ASN 3.18 2.70 1 43 ARG 5.62 2.40 1 45 SER -1.16 -0.81 1 46 TYR 3.13 4.43 1 47 VAL -3.32 -0.96 1 51 GLU 2.65 2.20 1 52 SER 2.31 1.51 1 53 GLN 0.94 -0.89 1 54 VAL -0.18 -0.79 1 55 ASP 1.49 -0.66 1 57 SER 4.84 4.45 1 58 THR 7.08 4.74 1 59 ILE 5.10 3.94 1 60 HIS 5.68 4.87 1 61 SER 3.38 3.20 1 62 GLN 3.87 2.72 1 63 GLU 1.44 1.87 1 64 THR -0.83 0.39 1 65 LYS 6.57 1.43 1 66 HIS -5.27 -2.36 1 67 TYR 0.64 1.62 1 68 LEU -3.17 -1.36 1 69 THR -2.92 -2.45 1 70 VAL -7.79 -4.72 1 71 ASN 1.36 -0.14 1 72 LEU 2.71 1.47 1 73 THR 3.55 3.48 1 74 THR -0.07 0.36 1 75 LEU 5.38 0.86 1 76 ARG -0.40 0.37 1 77 VAL 0.33 -0.60 1 78 TRP -6.64 -2.33 1 80 TYR 2.54 3.98 1 81 ALA 3.89 1.76 1 83 SER 1.74 -0.36 1 84 LYS -4.75 -2.07 1 85 GLU -0.99 -0.99 1 86 VAL -4.59 -2.82 1 87 PHE -1.77 -0.72 1 88 LEU -1.01 -0.79 1 89 ASP 1.20 0.98 1 90 ARG 0.27 0.05 1 91 LYS 0.83 0.52 1 92 LEU 0.00 0.17 1 94 THR -0.22 -0.04 1 95 GLN -1.55 -1.87 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.79 _LACS_plot.Line_1_terminator_val_y_1 4.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.57 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 -2.09 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 HIS 7.91 0.30 0 10 VAL 0.40 -0.25 1 12 GLU -0.58 0.22 1 13 ILE -2.50 1.42 1 14 THR -3.56 1.73 1 15 LYS 4.54 -0.92 1 16 GLU 5.14 -1.29 1 17 ASP 2.94 0.10 1 18 LEU 4.57 -1.67 1 19 ILE 4.77 -1.25 1 20 GLN 5.04 -1.39 1 21 LYS 2.86 0.50 1 22 SER 3.10 -0.52 1 23 LEU 0.57 -0.59 1 25 THR -6.44 3.76 1 27 GLN 3.57 -0.59 1 28 ASP 1.23 1.17 1 30 LYS 4.48 -3.73 1 31 VAL 1.07 -0.32 1 32 GLN -1.96 1.66 1 35 ASN 4.01 -1.93 1 36 LEU -2.25 1.82 1 37 TRP -1.79 0.13 1 38 ALA -4.70 2.00 1 40 LEU -1.79 1.06 1 41 GLU 2.04 -0.82 1 42 ASN 3.18 -0.48 1 43 ARG 5.62 -3.22 1 45 SER -1.16 0.35 1 46 TYR 3.13 1.30 1 47 VAL -3.32 2.36 1 51 GLU 2.65 -0.45 1 52 SER 2.31 -0.80 1 53 GLN 0.94 -1.83 1 54 VAL -0.18 -0.61 1 55 ASP 1.49 -2.15 1 57 SER 4.84 -0.39 1 58 THR 7.08 -2.34 1 59 ILE 5.10 -1.16 1 60 HIS 5.68 -0.81 1 61 SER 3.38 -0.18 1 62 GLN 3.87 -1.15 1 63 GLU 1.44 0.43 1 64 THR -0.83 1.22 1 65 LYS 6.57 -5.14 1 66 HIS -5.27 2.91 1 67 TYR 0.64 0.98 1 68 LEU -3.17 1.81 1 69 THR -2.92 0.47 1 70 VAL -7.79 3.07 1 71 ASN 1.36 -1.50 1 72 LEU 2.71 -1.24 1 73 THR 3.55 -0.07 1 74 THR -0.07 0.43 1 75 LEU 5.38 -4.52 1 76 ARG -0.40 0.77 1 77 VAL 0.33 -0.93 1 78 TRP -6.64 4.31 1 80 TYR 2.54 1.44 1 81 ALA 3.89 -2.13 1 83 SER 1.74 -2.10 1 84 LYS -4.75 2.68 1 85 GLU -0.99 0.00 1 86 VAL -4.59 1.77 1 87 PHE -1.77 1.05 1 88 LEU -1.01 0.22 1 89 ASP 1.20 -0.22 1 90 ARG 0.27 -0.22 1 91 LYS 0.83 -0.31 1 92 LEU 0.00 0.17 1 94 THR -0.22 0.18 1 95 GLN -1.55 -0.32 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.79 _LACS_plot.Line_1_terminator_val_y_1 0.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 THR -6.44 -0.53 0 64 THR -0.83 -1.47 0 10 VAL 0.40 0.15 1 12 GLU -0.58 -0.06 1 13 ILE -2.50 0.31 1 14 THR -3.56 0.30 1 15 LYS 4.54 -0.45 1 16 GLU 5.14 -0.44 1 17 ASP 2.94 -0.25 1 18 LEU 4.57 -0.53 1 19 ILE 4.77 -0.54 1 20 GLN 5.04 -0.42 1 21 LYS 2.86 -0.37 1 22 SER 3.10 -0.52 1 23 LEU 0.57 0.03 1 27 GLN 3.57 -0.34 1 28 ASP 1.23 0.16 1 30 LYS 4.48 -0.09 1 31 VAL 1.07 0.10 1 32 GLN -1.96 0.14 1 35 ASN 4.01 -0.62 1 36 LEU -2.25 0.29 1 37 TRP -1.79 0.60 1 38 ALA -4.70 0.81 1 40 LEU -1.79 0.19 1 41 GLU 2.04 -0.64 1 42 ASN 3.18 -0.38 1 43 ARG 5.62 -0.55 1 45 SER -1.16 0.34 1 46 TYR 3.13 -0.59 1 47 VAL -3.32 0.53 1 51 GLU 2.65 -0.57 1 52 SER 2.31 -0.07 1 53 GLN 0.94 0.35 1 54 VAL -0.18 -0.01 1 55 ASP 1.49 -0.46 1 56 HIS 7.91 -0.45 1 57 SER 4.84 -0.13 1 58 THR 7.08 -0.52 1 59 ILE 5.10 -0.66 1 60 HIS 5.68 -0.78 1 61 SER 3.38 -0.61 1 62 GLN 3.87 -0.50 1 63 GLU 1.44 -0.40 1 65 LYS 6.57 -1.13 1 66 HIS -5.27 -0.13 1 67 TYR 0.64 0.18 1 68 LEU -3.17 1.30 1 69 THR -2.92 1.08 1 70 VAL -7.79 1.39 1 71 ASN 1.36 -1.21 1 72 LEU 2.71 -0.49 1 73 THR 3.55 -0.12 1 74 THR -0.07 -0.27 1 75 LEU 5.38 -0.43 1 76 ARG -0.40 -0.03 1 77 VAL 0.33 0.78 1 78 TRP -6.64 0.18 1 80 TYR 2.54 -0.29 1 81 ALA 3.89 -0.53 1 83 SER 1.74 -0.90 1 84 LYS -4.75 -0.48 1 85 GLU -0.99 0.37 1 86 VAL -4.59 0.23 1 87 PHE -1.77 0.22 1 88 LEU -1.01 0.07 1 89 ASP 1.20 -0.18 1 90 ARG 0.27 0.02 1 91 LYS 0.83 -0.08 1 92 LEU 0.00 0.00 1 94 THR -0.22 -0.01 1 95 GLN -1.55 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.79 _LACS_plot.Line_1_terminator_val_y_1 -3.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.35 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 3.21 _LACS_plot.Y_axis_chem_shift_offset 0.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 HIS -5.27 2.99 0 10 VAL 0.40 0.50 1 12 GLU -0.58 -0.40 1 13 ILE -2.50 -1.06 1 14 THR -3.56 0.30 1 15 LYS 4.54 1.63 1 16 GLU 5.14 2.34 1 17 ASP 2.94 2.13 1 18 LEU 4.57 2.04 1 19 ILE 4.77 3.45 1 20 GLN 5.04 3.77 1 21 LYS 2.86 2.44 1 22 SER 3.10 -0.40 1 23 LEU 0.57 0.00 1 25 THR -6.44 0.06 1 27 GLN 3.57 0.53 1 28 ASP 1.23 -0.06 1 31 VAL 1.07 -1.30 1 32 GLN -1.96 0.11 1 35 ASN 4.01 0.53 1 36 LEU -2.25 -2.18 1 37 TRP -1.79 -0.24 1 38 ALA -4.70 -2.45 1 40 LEU -1.79 -1.19 1 41 GLU 2.04 0.60 1 42 ASN 3.18 0.68 1 43 ARG 5.62 -1.75 1 45 SER -1.16 -0.07 1 46 TYR 3.13 -0.61 1 47 VAL -3.32 -3.17 1 51 GLU 2.65 -0.12 1 52 SER 2.31 -0.22 1 53 GLN 0.94 -1.39 1 54 VAL -0.18 -2.14 1 55 ASP 1.49 0.20 1 56 HIS 7.91 4.29 1 57 SER 4.84 2.73 1 58 THR 7.08 1.64 1 59 ILE 5.10 1.38 1 60 HIS 5.68 4.94 1 61 SER 3.38 2.21 1 62 GLN 3.87 2.60 1 63 GLU 1.44 1.75 1 64 THR -0.83 0.76 1 65 LYS 6.57 -2.26 1 67 TYR 0.64 -2.07 1 68 LEU -3.17 -1.47 1 69 THR -2.92 -3.27 1 70 VAL -7.79 -4.06 1 71 ASN 1.36 1.74 1 72 LEU 2.71 -0.90 1 73 THR 3.55 0.71 1 74 THR -0.07 3.12 1 75 LEU 5.38 -2.55 1 76 ARG -0.40 -1.57 1 77 VAL 0.33 -1.76 1 78 TRP -6.64 -3.18 1 80 TYR 2.54 1.57 1 81 ALA 3.89 1.79 1 83 SER 1.74 -1.50 1 84 LYS -4.75 -4.01 1 85 GLU -0.99 -0.48 1 86 VAL -4.59 -3.04 1 87 PHE -1.77 -0.27 1 88 LEU -1.01 -0.68 1 89 ASP 1.20 0.13 1 90 ARG 0.27 -0.18 1 91 LYS 0.83 0.15 1 92 LEU 0.00 -0.36 1 94 THR -0.22 -0.27 1 95 GLN -1.55 -2.09 1 stop_ save_