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 bmr10252_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.73 _LACS_plot.Line_1_terminator_val_y_1 -0.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 5.42 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 ILE 4.26 1.85 0 67 TYR 4.90 5.41 0 12 LYS 0.00 0.02 1 13 LYS -0.10 0.02 1 14 ASP -0.76 -0.24 1 16 ASN -0.52 -0.15 1 17 GLU -0.49 0.22 1 19 GLN -1.03 -0.64 1 20 LYS 1.55 0.75 1 22 VAL -0.67 -1.23 1 23 SER -2.49 -0.71 1 24 ALA 4.07 3.47 1 25 TYR 3.23 2.38 1 26 ALA 3.43 2.36 1 27 LEU 3.08 2.78 1 28 PHE 4.49 3.95 1 29 PHE 4.19 3.43 1 30 ARG 4.39 3.54 1 31 ASP 2.76 2.32 1 32 THR 3.84 3.23 1 33 GLN 6.87 4.30 1 34 ALA 4.22 2.84 1 35 ALA 3.34 2.13 1 37 LYS 3.82 2.52 1 39 GLN 0.11 0.78 1 40 ASN -1.31 -0.42 1 42 ASN -0.33 -0.35 1 43 ALA -0.06 0.15 1 44 THR -2.73 -1.01 1 45 PHE 4.94 4.28 1 47 GLU 2.83 2.70 1 48 VAL 6.04 4.96 1 49 SER 5.35 4.20 1 50 LYS 3.81 3.32 1 51 ILE 4.59 4.39 1 52 VAL 6.91 5.19 1 53 ALA 4.98 3.77 1 54 SER 4.18 3.33 1 55 MET 3.14 3.79 1 56 TRP 1.63 2.31 1 57 ASP 3.39 2.99 1 59 LEU -0.74 0.01 1 61 GLU 3.58 2.98 1 62 GLU 4.48 3.24 1 63 GLN 3.66 3.35 1 64 LYS 4.57 4.57 1 65 GLN 4.42 3.19 1 66 VAL 5.78 4.66 1 68 LYS 5.45 4.50 1 69 LYS 4.65 3.62 1 70 LYS 3.72 3.82 1 71 THR 5.45 4.60 1 72 GLU 3.56 3.06 1 73 ALA 4.05 2.77 1 74 ALA 3.19 2.40 1 75 LYS 5.17 4.31 1 76 LYS 4.49 3.79 1 77 GLU 3.05 2.38 1 78 TYR 3.47 2.91 1 79 LEU 4.02 3.07 1 80 LYS 4.13 3.43 1 81 GLN 4.06 2.93 1 82 LEU 3.22 2.86 1 83 ALA 3.77 2.44 1 84 ALA 4.02 2.73 1 85 TYR 3.32 2.96 1 86 ARG 4.74 3.45 1 87 ALA 2.98 1.85 1 88 SER 2.22 1.86 1 89 LEU 1.30 0.96 1 90 VAL 1.56 0.98 1 91 SER 0.55 0.56 1 92 LYS 0.68 0.35 1 93 SER 0.07 0.20 1 94 TYR 0.18 0.23 1 95 THR -0.24 -0.06 1 96 ASP -0.01 0.29 1 97 SER 0.36 0.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10252_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.73 _LACS_plot.Line_1_terminator_val_y_1 1.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -1.48 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 ILE 4.26 -2.41 0 67 TYR 4.90 0.51 0 12 LYS 0.00 0.02 1 13 LYS -0.10 0.12 1 14 ASP -0.76 0.52 1 16 ASN -0.52 0.37 1 17 GLU -0.49 0.71 1 19 GLN -1.03 0.39 1 20 LYS 1.55 -0.80 1 22 VAL -0.67 -0.56 1 23 SER -2.49 1.78 1 24 ALA 4.07 -0.60 1 25 TYR 3.23 -0.85 1 26 ALA 3.43 -1.07 1 27 LEU 3.08 -0.30 1 28 PHE 4.49 -0.54 1 29 PHE 4.19 -0.76 1 30 ARG 4.39 -0.85 1 31 ASP 2.76 -0.44 1 32 THR 3.84 -0.61 1 33 GLN 6.87 -2.57 1 34 ALA 4.22 -1.38 1 35 ALA 3.34 -1.21 1 37 LYS 3.82 -1.30 1 39 GLN 0.11 0.67 1 40 ASN -1.31 0.89 1 42 ASN -0.33 -0.02 1 43 ALA -0.06 0.21 1 44 THR -2.73 1.72 1 45 PHE 4.94 -0.66 1 47 GLU 2.83 -0.13 1 48 VAL 6.04 -1.08 1 49 SER 5.35 -1.15 1 50 LYS 3.81 -0.49 1 51 ILE 4.59 -0.20 1 52 VAL 6.91 -1.72 1 53 ALA 4.98 -1.21 1 54 SER 4.18 -0.85 1 55 MET 3.14 0.65 1 56 TRP 1.63 0.68 1 57 ASP 3.39 -0.40 1 59 LEU -0.74 0.75 1 61 GLU 3.58 -0.60 1 62 GLU 4.48 -1.24 1 63 GLN 3.66 -0.31 1 64 LYS 4.57 0.00 1 65 GLN 4.42 -1.23 1 66 VAL 5.78 -1.12 1 68 LYS 5.45 -0.95 1 69 LYS 4.65 -1.03 1 70 LYS 3.72 0.10 1 71 THR 5.45 -0.85 1 72 GLU 3.56 -0.50 1 73 ALA 4.05 -1.28 1 74 ALA 3.19 -0.79 1 75 LYS 5.17 -0.86 1 76 LYS 4.49 -0.70 1 77 GLU 3.05 -0.67 1 78 TYR 3.47 -0.56 1 79 LEU 4.02 -0.95 1 80 LYS 4.13 -0.70 1 81 GLN 4.06 -1.13 1 82 LEU 3.22 -0.36 1 83 ALA 3.77 -1.33 1 84 ALA 4.02 -1.29 1 85 TYR 3.32 -0.36 1 86 ARG 4.74 -1.29 1 87 ALA 2.98 -1.13 1 88 SER 2.22 -0.36 1 89 LEU 1.30 -0.34 1 90 VAL 1.56 -0.58 1 91 SER 0.55 0.01 1 92 LYS 0.68 -0.33 1 93 SER 0.07 0.13 1 94 TYR 0.18 0.05 1 95 THR -0.24 0.18 1 96 ASP -0.01 0.30 1 97 SER 0.36 -0.14 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10252_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.73 _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 -0.14 _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 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.43 _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 25 TYR 3.23 -1.87 0 12 LYS 0.00 0.00 1 13 LYS -0.10 -0.05 1 14 ASP -0.76 -0.03 1 16 ASN -0.52 -0.06 1 17 GLU -0.49 -1.40 1 19 GLN -1.03 -0.05 1 20 LYS 1.55 -1.22 1 22 VAL -0.67 0.18 1 23 SER -2.49 -0.04 1 24 ALA 4.07 -0.27 1 26 ALA 3.43 -0.56 1 27 LEU 3.08 -0.32 1 28 PHE 4.49 -0.97 1 29 PHE 4.19 -1.14 1 30 ARG 4.39 -0.29 1 31 ASP 2.76 -0.12 1 32 THR 3.84 -0.40 1 33 GLN 6.87 -0.97 1 34 ALA 4.22 -0.36 1 35 ALA 3.34 -0.19 1 36 ILE 4.26 -0.42 1 37 LYS 3.82 -0.34 1 39 GLN 0.11 -0.03 1 40 ASN -1.31 0.11 1 42 ASN -0.33 0.11 1 43 ALA -0.06 0.12 1 44 THR -2.73 0.13 1 45 PHE 4.94 -0.32 1 47 GLU 2.83 -0.30 1 48 VAL 6.04 -0.71 1 49 SER 5.35 -0.38 1 50 LYS 3.81 -0.19 1 51 ILE 4.59 -0.38 1 52 VAL 6.91 -0.46 1 53 ALA 4.98 0.09 1 54 SER 4.18 -0.05 1 55 MET 3.14 -0.29 1 56 TRP 1.63 -0.76 1 57 ASP 3.39 -0.39 1 59 LEU -0.74 -0.22 1 61 GLU 3.58 -0.48 1 62 GLU 4.48 -0.32 1 63 GLN 3.66 -0.06 1 64 LYS 4.57 -0.39 1 65 GLN 4.42 -0.28 1 66 VAL 5.78 -0.47 1 67 TYR 4.90 -0.40 1 68 LYS 5.45 -0.12 1 69 LYS 4.65 -0.15 1 70 LYS 3.72 -0.11 1 71 THR 5.45 -0.05 1 72 GLU 3.56 -0.21 1 73 ALA 4.05 -0.06 1 74 ALA 3.19 0.00 1 75 LYS 5.17 -0.27 1 76 LYS 4.49 -0.21 1 77 GLU 3.05 -0.12 1 78 TYR 3.47 -0.14 1 79 LEU 4.02 -0.58 1 80 LYS 4.13 -0.19 1 81 GLN 4.06 -0.20 1 82 LEU 3.22 -0.38 1 83 ALA 3.77 -0.10 1 84 ALA 4.02 -0.19 1 85 TYR 3.32 -0.24 1 86 ARG 4.74 -0.63 1 87 ALA 2.98 -0.12 1 88 SER 2.22 -0.12 1 89 LEU 1.30 -0.18 1 90 VAL 1.56 -0.06 1 91 SER 0.55 -0.05 1 92 LYS 0.68 0.01 1 93 SER 0.07 -0.03 1 94 TYR 0.18 0.11 1 95 THR -0.24 -0.02 1 96 ASP -0.01 0.02 1 97 SER 0.36 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10252_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.73 _LACS_plot.Line_1_terminator_val_y_1 -1.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 3.74 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 GLN 6.87 0.53 0 12 LYS 0.00 -0.27 1 13 LYS -0.10 -0.61 1 16 ASN -0.52 -0.83 1 17 GLU -0.49 -0.49 1 19 GLN -1.03 -0.62 1 20 LYS 1.55 -0.09 1 22 VAL -0.67 -0.68 1 23 SER -2.49 -1.08 1 24 ALA 4.07 0.93 1 25 TYR 3.23 0.35 1 26 ALA 3.43 3.69 1 27 LEU 3.08 1.02 1 28 PHE 4.49 2.84 1 29 PHE 4.19 1.68 1 30 ARG 4.39 2.86 1 31 ASP 2.76 1.55 1 32 THR 3.84 0.94 1 34 ALA 4.22 2.96 1 35 ALA 3.34 3.00 1 36 ILE 4.26 2.81 1 37 LYS 3.82 2.27 1 39 GLN 0.11 -0.19 1 40 ASN -1.31 -1.17 1 42 ASN -0.33 0.19 1 43 ALA -0.06 0.69 1 44 THR -2.73 0.71 1 47 GLU 2.83 2.87 1 48 VAL 6.04 1.34 1 49 SER 5.35 1.42 1 50 LYS 3.81 2.86 1 51 ILE 4.59 2.70 1 52 VAL 6.91 1.96 1 53 ALA 4.98 3.08 1 54 SER 4.18 3.22 1 55 MET 3.14 2.86 1 56 TRP 1.63 2.11 1 57 ASP 3.39 1.80 1 59 LEU -0.74 0.28 1 61 GLU 3.58 2.24 1 62 GLU 4.48 2.49 1 63 GLN 3.66 3.41 1 64 LYS 4.57 3.26 1 65 GLN 4.42 1.75 1 66 VAL 5.78 2.60 1 67 TYR 4.90 2.88 1 68 LYS 5.45 2.87 1 69 LYS 4.65 3.61 1 70 LYS 3.72 3.39 1 71 THR 5.45 1.76 1 72 GLU 3.56 2.90 1 73 ALA 4.05 2.84 1 74 ALA 3.19 3.59 1 75 LYS 5.17 1.50 1 76 LYS 4.49 3.22 1 77 GLU 3.05 1.76 1 78 TYR 3.47 0.84 1 79 LEU 4.02 3.13 1 80 LYS 4.13 3.20 1 81 GLN 4.06 3.91 1 82 LEU 3.22 0.69 1 83 ALA 3.77 3.05 1 84 ALA 4.02 2.46 1 85 TYR 3.32 2.64 1 86 ARG 4.74 2.66 1 87 ALA 2.98 1.80 1 88 SER 2.22 0.62 1 89 LEU 1.30 0.74 1 90 VAL 1.56 0.44 1 91 SER 0.55 0.25 1 92 LYS 0.68 -0.07 1 93 SER 0.07 -0.33 1 94 TYR 0.18 0.11 1 95 THR -0.24 -0.65 1 96 ASP -0.01 -0.05 1 97 SER 0.36 0.24 1 stop_ save_