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 bmr18425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.73 _LACS_plot.Line_1_terminator_val_y_1 -4.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _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 8.87 _LACS_plot.Line_2_terminator_val_y_2 6.85 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 THR -7.73 -3.50 0 10 THR 8.88 7.01 1 11 GLU 3.56 3.59 1 12 ARG 4.25 3.33 1 14 ILE 6.32 5.39 1 15 GLU 3.58 3.24 1 16 SER 4.26 4.00 1 17 LEU 3.17 3.40 1 18 ILE 4.73 4.34 1 19 ALA 3.38 2.80 1 20 VAL 5.31 4.32 1 21 PHE 5.08 4.77 1 22 GLN 4.13 3.04 1 23 LYS 3.97 2.95 1 24 TYR 2.98 3.52 1 25 ALA 2.08 1.16 1 27 LYS 4.24 3.17 1 28 ASP -0.82 -1.66 1 34 LEU -2.95 -1.96 1 35 SER -2.88 -1.68 1 36 LYS 6.02 4.76 1 37 THR 5.76 4.44 1 38 GLU 2.40 2.68 1 39 PHE 4.05 3.38 1 40 LEU 4.78 3.37 1 41 SER 4.42 3.58 1 42 PHE 5.14 3.56 1 43 MET 4.31 0.90 1 44 ASN 1.65 2.13 1 45 THR 2.86 2.79 1 46 GLU 0.74 1.23 1 47 LEU -1.59 -2.69 1 48 ALA 3.35 2.99 1 49 ALA 3.72 2.50 1 50 PHE 2.83 2.51 1 51 THR 4.81 3.61 1 52 LYS 3.15 2.02 1 53 ASN 0.30 0.17 1 54 GLN 1.95 1.32 1 59 VAL 5.04 3.83 1 60 LEU 4.75 3.02 1 61 ASP 3.55 3.46 1 62 ARG 4.34 3.62 1 63 MET 3.23 3.96 1 64 MET 5.79 3.76 1 65 LYS 3.58 2.94 1 66 LYS 2.64 2.05 1 67 LEU -0.98 0.05 1 68 ASP 0.26 -1.86 1 69 THR 4.03 2.82 1 70 ASN 0.54 -1.46 1 71 SER 2.90 0.63 1 72 ASP -1.32 -1.77 1 74 GLN -5.72 -2.76 1 75 LEU -3.32 -2.44 1 76 ASP -2.31 -2.00 1 77 PHE 4.42 3.66 1 78 SER 4.59 3.30 1 79 GLU 1.90 2.06 1 80 PHE 2.98 3.15 1 81 LEU 3.85 2.32 1 82 ASN 3.93 2.68 1 83 LEU 4.97 2.90 1 84 ILE 4.17 0.59 1 87 LEU 3.25 2.37 1 88 ALA 4.25 2.85 1 89 MET 4.08 3.67 1 90 ALA 3.51 2.47 1 93 ASP 3.44 3.10 1 94 SER 4.01 2.95 1 95 PHE 3.23 2.35 1 96 LEU 1.69 1.17 1 97 LYS 0.79 0.47 1 98 ALA -0.03 -0.16 1 99 VAL 0.85 0.43 1 101 SER -0.01 0.07 1 102 GLN 0.60 1.64 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.73 _LACS_plot.Line_1_terminator_val_y_1 3.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.40 _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 8.87 _LACS_plot.Line_2_terminator_val_y_2 -2.02 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 THR -7.73 4.23 0 10 THR 8.88 -1.87 1 11 GLU 3.56 0.03 1 12 ARG 4.25 -0.92 1 14 ILE 6.32 -0.93 1 15 GLU 3.58 -0.34 1 16 SER 4.26 -0.26 1 17 LEU 3.17 0.23 1 18 ILE 4.73 -0.39 1 19 ALA 3.38 -0.58 1 20 VAL 5.31 -0.99 1 21 PHE 5.08 -0.31 1 22 GLN 4.13 -1.09 1 23 LYS 3.97 -1.02 1 24 TYR 2.98 0.54 1 25 ALA 2.08 -0.92 1 27 LYS 4.24 -1.07 1 28 ASP -0.82 -0.84 1 34 LEU -2.95 0.99 1 35 SER -2.88 1.20 1 36 LYS 6.02 -1.26 1 37 THR 5.76 -1.32 1 38 GLU 2.40 0.28 1 39 PHE 4.05 -0.67 1 40 LEU 4.78 -1.41 1 41 SER 4.42 -0.84 1 42 PHE 5.14 -1.58 1 43 MET 4.31 -3.41 1 44 ASN 1.65 0.48 1 45 THR 2.86 -0.07 1 46 GLU 0.74 0.49 1 47 LEU -1.59 -1.10 1 48 ALA 3.35 -0.36 1 49 ALA 3.72 -1.22 1 50 PHE 2.83 -0.32 1 51 THR 4.81 -1.20 1 52 LYS 3.15 -1.13 1 53 ASN 0.30 -0.13 1 54 GLN 1.95 -0.63 1 59 VAL 5.04 -1.21 1 60 LEU 4.75 -1.73 1 61 ASP 3.55 -0.09 1 62 ARG 4.34 -0.72 1 63 MET 3.23 0.73 1 64 MET 5.79 -2.03 1 65 LYS 3.58 -0.64 1 66 LYS 2.64 -0.59 1 67 LEU -0.98 1.03 1 68 ASP 0.26 -2.12 1 69 THR 4.03 -1.21 1 70 ASN 0.54 -2.00 1 71 SER 2.90 -2.27 1 72 ASP -1.32 -0.45 1 74 GLN -5.72 2.96 1 75 LEU -3.32 0.88 1 76 ASP -2.31 0.31 1 77 PHE 4.42 -0.76 1 78 SER 4.59 -1.29 1 79 GLU 1.90 0.16 1 80 PHE 2.98 0.17 1 81 LEU 3.85 -1.53 1 82 ASN 3.93 -1.25 1 83 LEU 4.97 -2.07 1 84 ILE 4.17 -3.58 1 87 LEU 3.25 -0.88 1 88 ALA 4.25 -1.40 1 89 MET 4.08 -0.41 1 90 ALA 3.51 -1.04 1 93 ASP 3.44 -0.34 1 94 SER 4.01 -1.06 1 95 PHE 3.23 -0.88 1 96 LEU 1.69 -0.52 1 97 LYS 0.79 -0.32 1 98 ALA -0.03 -0.13 1 99 VAL 0.85 -0.42 1 101 SER -0.01 0.08 1 102 GLN 0.60 1.04 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.73 _LACS_plot.Line_1_terminator_val_y_1 0.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.00 _LACS_plot.Line_2_terminator_val_x_2 8.87 _LACS_plot.Line_2_terminator_val_y_2 -0.94 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 LEU -3.32 1.52 0 10 THR 8.88 -0.64 1 11 GLU 3.56 -0.68 1 12 ARG 4.25 -0.38 1 14 ILE 6.32 -0.78 1 15 GLU 3.58 -0.54 1 16 SER 4.26 -0.26 1 17 LEU 3.17 -0.16 1 18 ILE 4.73 -0.79 1 19 ALA 3.38 -0.46 1 20 VAL 5.31 -0.29 1 21 PHE 5.08 -1.35 1 22 GLN 4.13 -0.79 1 23 LYS 3.97 -0.63 1 24 TYR 2.98 -0.62 1 25 ALA 2.08 -0.47 1 27 LYS 4.24 -0.45 1 28 ASP -0.82 -0.14 1 33 THR -7.73 0.85 1 34 LEU -2.95 0.82 1 35 SER -2.88 -0.01 1 36 LYS 6.02 -0.16 1 37 THR 5.76 -0.47 1 38 GLU 2.40 -0.28 1 39 PHE 4.05 -0.44 1 40 LEU 4.78 -0.84 1 42 PHE 5.14 -1.84 1 43 MET 4.31 -0.89 1 44 ASN 1.65 -0.54 1 45 THR 2.86 -0.21 1 46 GLU 0.74 -0.46 1 47 LEU -1.59 0.54 1 48 ALA 3.35 -0.52 1 49 ALA 3.72 -0.47 1 50 PHE 2.83 -0.48 1 51 THR 4.81 -0.77 1 52 LYS 3.15 -0.38 1 53 ASN 0.30 -0.22 1 59 VAL 5.04 -0.54 1 60 LEU 4.75 -0.20 1 61 ASP 3.55 -0.42 1 62 ARG 4.34 -0.47 1 63 MET 3.23 -0.55 1 64 MET 5.79 -1.17 1 65 LYS 3.58 -0.43 1 66 LYS 2.64 -0.48 1 67 LEU -0.98 -0.32 1 68 ASP 0.26 -0.06 1 69 THR 4.03 -0.44 1 70 ASN 0.54 0.03 1 71 SER 2.90 -0.59 1 72 ASP -1.32 0.00 1 74 GLN -5.72 0.43 1 76 ASP -2.31 0.40 1 77 PHE 4.42 -1.43 1 78 SER 4.59 -0.70 1 79 GLU 1.90 -0.25 1 80 PHE 2.98 -0.71 1 81 LEU 3.85 -1.04 1 82 ASN 3.93 -0.43 1 83 LEU 4.97 -0.46 1 84 ILE 4.17 -0.93 1 87 LEU 3.25 -0.34 1 88 ALA 4.25 -0.39 1 89 MET 4.08 -0.43 1 90 ALA 3.51 -0.18 1 93 ASP 3.44 -0.48 1 94 SER 4.01 -0.47 1 95 PHE 3.23 -0.48 1 96 LEU 1.69 -0.62 1 97 LYS 0.79 -0.31 1 98 ALA -0.03 -0.21 1 99 VAL 0.85 -0.28 1 101 SER -0.01 -0.21 1 102 GLN 0.60 -0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18425_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.73 _LACS_plot.Line_1_terminator_val_y_1 -1.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.21 _LACS_plot.Line_2_terminator_val_x_2 8.87 _LACS_plot.Line_2_terminator_val_y_2 2.90 _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 102 GLN 0.60 4.36 0 33 THR -7.73 -0.69 0 10 THR 8.88 1.92 1 11 GLU 3.56 3.15 1 12 ARG 4.25 2.64 1 14 ILE 6.32 0.40 1 15 GLU 3.58 3.04 1 16 SER 4.26 1.17 1 17 LEU 3.17 0.89 1 18 ILE 4.73 0.65 1 19 ALA 3.38 3.77 1 20 VAL 5.31 0.61 1 21 PHE 5.08 1.11 1 22 GLN 4.13 2.58 1 23 LYS 3.97 1.31 1 24 TYR 2.98 0.43 1 25 ALA 2.08 2.27 1 27 LYS 4.24 1.19 1 28 ASP -0.82 0.79 1 34 LEU -2.95 -1.16 1 35 SER -2.88 -0.22 1 36 LYS 6.02 1.72 1 37 THR 5.76 2.95 1 38 GLU 2.40 2.20 1 39 PHE 4.05 0.78 1 40 LEU 4.78 1.40 1 41 SER 4.42 2.13 1 42 PHE 5.14 1.00 1 43 MET 4.31 1.88 1 44 ASN 1.65 0.45 1 45 THR 2.86 0.84 1 46 GLU 0.74 0.81 1 47 LEU -1.59 -0.92 1 48 ALA 3.35 1.76 1 49 ALA 3.72 1.91 1 50 PHE 2.83 2.04 1 51 THR 4.81 2.01 1 52 LYS 3.15 0.33 1 53 ASN 0.30 -0.16 1 54 GLN 1.95 1.47 1 59 VAL 5.04 1.26 1 60 LEU 4.75 1.32 1 61 ASP 3.55 2.71 1 62 ARG 4.34 2.91 1 63 MET 3.23 1.09 1 64 MET 5.79 0.37 1 65 LYS 3.58 2.11 1 66 LYS 2.64 1.80 1 67 LEU -0.98 -0.68 1 68 ASP 0.26 1.29 1 69 THR 4.03 1.29 1 70 ASN 0.54 -0.70 1 71 SER 2.90 -0.73 1 72 ASP -1.32 1.88 1 74 GLN -5.72 -1.31 1 75 LEU -3.32 -1.02 1 76 ASP -2.31 -1.20 1 77 PHE 4.42 0.92 1 78 SER 4.59 2.35 1 79 GLU 1.90 3.13 1 80 PHE 2.98 1.04 1 81 LEU 3.85 2.16 1 82 ASN 3.93 2.93 1 83 LEU 4.97 0.29 1 84 ILE 4.17 1.41 1 87 LEU 3.25 1.96 1 88 ALA 4.25 1.53 1 89 MET 4.08 1.50 1 90 ALA 3.51 2.79 1 93 ASP 3.44 2.12 1 94 SER 4.01 1.49 1 95 PHE 3.23 1.34 1 96 LEU 1.69 0.70 1 97 LYS 0.79 -0.42 1 98 ALA -0.03 -0.56 1 99 VAL 0.85 -0.47 1 101 SER -0.01 -0.95 1 stop_ save_