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 bmr18523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 -0.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.54 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 5.02 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 LYS 1.92 0.83 0 11 GLU 2.63 2.49 1 12 LYS 2.97 2.39 1 13 ALA 2.95 2.43 1 14 SER 3.44 3.05 1 15 GLU 1.52 1.52 1 16 ALA 0.82 1.38 1 17 LEU -0.31 -0.01 1 18 LYS 0.43 0.42 1 20 ASP 0.29 0.57 1 21 SER 0.76 1.00 1 22 GLN 1.42 1.27 1 23 LYS -0.41 0.20 1 24 SER 0.03 0.07 1 25 TYR 3.97 3.18 1 26 ALA 3.73 3.18 1 27 GLU 3.38 3.00 1 28 GLN 3.37 3.30 1 30 LYS 4.96 4.38 1 31 GLU 3.67 3.10 1 32 TYR 3.66 4.02 1 33 ILE 3.69 3.11 1 34 THR 5.68 4.83 1 35 ASP 2.25 2.93 1 37 ALA 3.50 2.98 1 38 ASP 2.76 2.64 1 39 LYS 2.58 2.24 1 40 VAL 2.81 2.35 1 41 ALA 2.65 2.24 1 43 LYS 0.30 0.71 1 44 VAL 0.44 0.27 1 45 GLN -0.48 0.17 1 47 GLU 0.53 0.96 1 48 ASP 0.37 0.57 1 49 ASN 0.49 0.83 1 50 LYS 0.74 0.79 1 52 VAL 3.01 2.39 1 53 PHE 2.19 1.31 1 54 GLN 2.53 2.18 1 56 VAL 2.92 2.24 1 57 HIS 2.03 2.11 1 58 ASP 1.35 1.38 1 59 SER 1.65 1.79 1 60 ALA 1.23 1.28 1 61 GLU 0.62 0.79 1 62 LYS 0.93 0.86 1 64 LYS 0.76 0.80 1 65 ASP 0.63 0.78 1 66 ASN 0.21 0.57 1 67 ALA 0.58 0.86 1 68 GLU 0.33 0.59 1 70 GLN 0.12 0.45 1 72 GLU -0.79 0.02 1 73 SER -1.11 -0.06 1 74 LEU 3.40 3.08 1 75 ALA 3.36 2.97 1 76 ASP 3.58 3.11 1 77 GLN 2.93 3.04 1 78 ALA 3.36 2.92 1 79 ARG 4.51 3.92 1 80 ASP 3.85 2.97 1 81 TYR 3.34 3.10 1 82 MET 3.47 3.60 1 84 ALA 2.74 2.30 1 85 ALA 3.43 2.95 1 86 LYS 4.85 4.19 1 87 SER 4.02 3.46 1 88 LYS 2.63 1.62 1 89 LEU 3.87 3.25 1 90 ASN 4.02 4.22 1 91 ASP 4.20 3.33 1 92 ALA 3.62 3.17 1 93 VAL 6.05 5.10 1 94 GLU 3.67 3.20 1 95 TYR 3.87 3.83 1 96 VAL 5.43 4.65 1 97 SER 4.06 3.68 1 99 ARG 1.90 1.32 1 100 VAL 2.44 1.95 1 101 HIS 0.63 0.79 1 103 GLU -0.81 0.00 1 104 GLU -0.73 0.01 1 105 ASP -1.20 -0.33 1 107 THR 1.31 1.21 1 108 LYS 0.22 0.21 1 109 LYS 0.82 1.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 0.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.46 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.79 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 -1.02 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 LYS 1.92 -1.09 0 11 GLU 2.63 -0.14 1 12 LYS 2.97 -0.58 1 13 ALA 2.95 -0.52 1 14 SER 3.44 -0.39 1 15 GLU 1.52 0.00 1 16 ALA 0.82 0.56 1 17 LEU -0.31 0.30 1 18 LYS 0.43 -0.01 1 20 ASP 0.29 0.28 1 21 SER 0.76 0.24 1 22 GLN 1.42 -0.15 1 23 LYS -0.41 0.61 1 24 SER 0.03 0.04 1 25 TYR 3.97 -0.79 1 26 ALA 3.73 -0.55 1 27 GLU 3.38 -0.38 1 28 GLN 3.37 -0.07 1 30 LYS 4.96 -0.58 1 31 GLU 3.67 -0.57 1 32 TYR 3.66 0.36 1 33 ILE 3.69 -0.58 1 34 THR 5.68 -0.85 1 35 ASP 2.25 0.68 1 37 ALA 3.50 -0.52 1 38 ASP 2.76 -0.12 1 39 LYS 2.58 -0.34 1 40 VAL 2.81 -0.46 1 41 ALA 2.65 -0.41 1 43 LYS 0.30 0.41 1 44 VAL 0.44 -0.17 1 45 GLN -0.48 0.65 1 47 GLU 0.53 0.43 1 48 ASP 0.37 0.20 1 49 ASN 0.49 0.34 1 50 LYS 0.74 0.05 1 52 VAL 3.01 -0.62 1 53 PHE 2.19 -0.88 1 54 GLN 2.53 -0.35 1 56 VAL 2.92 -0.68 1 57 HIS 2.03 0.08 1 58 ASP 1.35 0.03 1 59 SER 1.65 0.14 1 60 ALA 1.23 0.05 1 61 GLU 0.62 0.17 1 62 LYS 0.93 -0.07 1 64 LYS 0.76 0.04 1 65 ASP 0.63 0.15 1 66 ASN 0.21 0.36 1 67 ALA 0.58 0.28 1 68 GLU 0.33 0.26 1 70 GLN 0.12 0.33 1 72 GLU -0.79 0.81 1 73 SER -1.11 1.05 1 74 LEU 3.40 -0.32 1 75 ALA 3.36 -0.39 1 76 ASP 3.58 -0.47 1 77 GLN 2.93 0.11 1 78 ALA 3.36 -0.44 1 79 ARG 4.51 -0.59 1 80 ASP 3.85 -0.88 1 81 TYR 3.34 -0.24 1 82 MET 3.47 0.13 1 84 ALA 2.74 -0.44 1 85 ALA 3.43 -0.48 1 86 LYS 4.85 -0.66 1 87 SER 4.02 -0.56 1 88 LYS 2.63 -1.01 1 89 LEU 3.87 -0.62 1 90 ASN 4.02 0.20 1 91 ASP 4.20 -0.87 1 92 ALA 3.62 -0.45 1 93 VAL 6.05 -0.95 1 94 GLU 3.67 -0.47 1 95 TYR 3.87 -0.04 1 96 VAL 5.43 -0.78 1 97 SER 4.06 -0.38 1 99 ARG 1.90 -0.58 1 100 VAL 2.44 -0.49 1 101 HIS 0.63 0.16 1 103 GLU -0.81 0.81 1 104 GLU -0.73 0.74 1 105 ASP -1.20 0.87 1 107 THR 1.31 -0.10 1 108 LYS 0.22 -0.01 1 109 LYS 0.82 0.84 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 0.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.11 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 VAL 5.43 -0.66 0 11 GLU 2.63 -0.27 1 12 LYS 2.97 -0.21 1 13 ALA 2.95 -0.33 1 14 SER 3.44 -0.39 1 15 GLU 1.52 -0.21 1 16 ALA 0.82 -0.08 1 17 LEU -0.31 -0.01 1 18 LYS 0.43 -0.07 1 20 ASP 0.29 -0.08 1 21 SER 0.76 -0.12 1 22 GLN 1.42 -0.09 1 23 LYS -0.41 -0.03 1 24 SER 0.03 0.00 1 25 TYR 3.97 -0.20 1 26 ALA 3.73 -0.29 1 27 GLU 3.38 -0.35 1 28 GLN 3.37 -0.19 1 30 LYS 4.96 -0.39 1 31 GLU 3.67 -0.34 1 32 TYR 3.66 -0.30 1 33 ILE 3.69 -0.40 1 34 THR 5.68 -0.45 1 35 ASP 2.25 -0.16 1 36 LYS 1.92 -0.19 1 37 ALA 3.50 -0.34 1 38 ASP 2.76 -0.26 1 39 LYS 2.58 -0.20 1 40 VAL 2.81 -0.23 1 41 ALA 2.65 -0.23 1 43 LYS 0.30 0.01 1 44 VAL 0.44 0.00 1 45 GLN -0.48 -0.02 1 47 GLU 0.53 -0.16 1 48 ASP 0.37 -0.08 1 49 ASN 0.49 -0.09 1 50 LYS 0.74 -0.04 1 52 VAL 3.01 -0.28 1 53 PHE 2.19 -0.07 1 54 GLN 2.53 -0.20 1 56 VAL 2.92 -0.18 1 57 HIS 2.03 -0.22 1 58 ASP 1.35 -0.11 1 59 SER 1.65 -0.15 1 60 ALA 1.23 -0.10 1 61 GLU 0.62 -0.17 1 62 LYS 0.93 -0.05 1 64 LYS 0.76 -0.04 1 65 ASP 0.63 -0.09 1 66 ASN 0.21 -0.08 1 67 ALA 0.58 -0.05 1 68 GLU 0.33 -0.10 1 70 GLN 0.12 0.03 1 72 GLU -0.79 0.05 1 73 SER -1.11 0.08 1 74 LEU 3.40 -0.17 1 75 ALA 3.36 -0.37 1 76 ASP 3.58 -0.27 1 77 GLN 2.93 -0.23 1 78 ALA 3.36 -0.21 1 79 ARG 4.51 -0.37 1 80 ASP 3.85 -0.17 1 81 TYR 3.34 -0.13 1 82 MET 3.47 -0.27 1 84 ALA 2.74 -0.06 1 85 ALA 3.43 -0.33 1 86 LYS 4.85 -0.47 1 87 SER 4.02 -0.19 1 88 LYS 2.63 0.01 1 89 LEU 3.87 -0.27 1 90 ASN 4.02 -0.37 1 91 ASP 4.20 -0.21 1 92 ALA 3.62 -0.14 1 93 VAL 6.05 -0.55 1 94 GLU 3.67 -0.32 1 95 TYR 3.87 -0.34 1 97 SER 4.06 -0.43 1 99 ARG 1.90 -0.17 1 100 VAL 2.44 -0.20 1 101 HIS 0.63 0.04 1 103 GLU -0.81 -0.06 1 104 GLU -0.73 -0.11 1 105 ASP -1.20 -0.05 1 107 THR 1.31 -0.10 1 108 LYS 0.22 0.00 1 109 LYS 0.82 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 -0.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.87 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 2.80 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 LYS 0.82 4.59 0 11 GLU 2.63 1.87 1 12 LYS 2.97 1.94 1 13 ALA 2.95 0.59 1 14 SER 3.44 1.57 1 15 GLU 1.52 0.90 1 16 ALA 0.82 0.11 1 17 LEU -0.31 -1.38 1 18 LYS 0.43 0.06 1 20 ASP 0.29 0.38 1 21 SER 0.76 0.29 1 22 GLN 1.42 0.05 1 23 LYS -0.41 -0.38 1 24 SER 0.03 1.16 1 25 TYR 3.97 1.85 1 26 ALA 3.73 1.20 1 27 GLU 3.38 2.50 1 28 GLN 3.37 3.16 1 30 LYS 4.96 2.37 1 31 GLU 3.67 1.52 1 32 TYR 3.66 2.19 1 33 ILE 3.69 1.18 1 34 THR 5.68 1.87 1 35 ASP 2.25 1.64 1 36 LYS 1.92 1.40 1 37 ALA 3.50 1.01 1 38 ASP 2.76 2.03 1 39 LYS 2.58 2.01 1 40 VAL 2.81 0.39 1 41 ALA 2.65 1.33 1 43 LYS 0.30 0.02 1 44 VAL 0.44 -1.36 1 45 GLN -0.48 -0.53 1 47 GLU 0.53 -0.13 1 48 ASP 0.37 -0.45 1 49 ASN 0.49 -0.24 1 50 LYS 0.74 0.37 1 52 VAL 3.01 0.12 1 53 PHE 2.19 0.77 1 54 GLN 2.53 1.31 1 56 VAL 2.92 0.28 1 57 HIS 2.03 1.04 1 58 ASP 1.35 0.90 1 59 SER 1.65 0.52 1 60 ALA 1.23 0.43 1 61 GLU 0.62 0.47 1 62 LYS 0.93 0.93 1 64 LYS 0.76 0.07 1 65 ASP 0.63 -0.01 1 66 ASN 0.21 0.13 1 67 ALA 0.58 0.14 1 68 GLU 0.33 0.66 1 70 GLN 0.12 0.48 1 72 GLU -0.79 -0.06 1 73 SER -1.11 0.82 1 74 LEU 3.40 0.89 1 75 ALA 3.36 1.32 1 76 ASP 3.58 2.20 1 77 GLN 2.93 2.08 1 78 ALA 3.36 1.29 1 79 ARG 4.51 2.79 1 80 ASP 3.85 2.73 1 81 TYR 3.34 2.01 1 82 MET 3.47 1.90 1 84 ALA 2.74 2.39 1 85 ALA 3.43 1.08 1 86 LYS 4.85 1.87 1 87 SER 4.02 1.89 1 88 LYS 2.63 1.95 1 89 LEU 3.87 0.69 1 90 ASN 4.02 2.52 1 91 ASP 4.20 2.46 1 92 ALA 3.62 1.17 1 93 VAL 6.05 2.49 1 94 GLU 3.67 2.72 1 95 TYR 3.87 2.51 1 96 VAL 5.43 1.45 1 97 SER 4.06 2.33 1 99 ARG 1.90 1.60 1 100 VAL 2.44 0.02 1 101 HIS 0.63 1.11 1 103 GLU -0.81 -0.16 1 104 GLU -0.73 -0.80 1 105 ASP -1.20 0.29 1 107 THR 1.31 0.21 1 108 LYS 0.22 -1.19 1 stop_ save_