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 bmr18398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 6.31 _LACS_plot.Line_2_terminator_val_y_2 4.95 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 HIS 4.53 7.86 0 11 VAL -4.94 -2.36 1 12 ARG -4.47 -1.06 1 13 VAL -2.06 -1.62 1 14 GLU -7.50 -2.84 1 15 LEU 1.43 1.55 1 16 ALA -0.46 -0.92 1 17 GLU -5.26 -2.75 1 18 GLU -0.01 0.43 1 19 ASP -0.22 -0.25 1 20 ASP -1.10 -0.86 1 22 GLU -2.66 0.46 1 23 LYS 1.89 1.94 1 24 ILE 0.64 0.81 1 25 ALA -2.37 -2.04 1 26 ILE -6.33 -2.39 1 27 LYS -0.85 -0.34 1 28 LEU -5.48 -1.93 1 29 TRP -5.49 -2.34 1 30 LEU -1.93 -0.19 1 31 ARG -2.70 -1.19 1 32 ILE 2.23 -0.25 1 33 GLU -1.22 0.55 1 34 ASP -1.64 -0.79 1 35 ILE 3.31 2.67 1 36 LYS 3.77 2.23 1 37 LYS -0.48 -0.15 1 38 LEU -2.52 -1.25 1 39 LYS 0.33 0.71 1 41 LYS -0.51 -1.24 1 42 TYR -4.45 -1.48 1 43 LYS -0.44 -0.10 1 44 ASP 1.61 1.59 1 45 ASN 1.88 1.08 1 46 GLU 0.35 1.06 1 47 ALA -3.99 -1.50 1 48 ILE -2.78 -0.27 1 49 GLU -2.70 -1.28 1 50 PHE -2.39 -1.64 1 51 SER -2.28 -1.17 1 52 PHE -5.13 -0.25 1 53 ASP -2.06 -0.85 1 54 LEU 2.14 2.68 1 55 GLU -0.30 0.94 1 56 ARG -1.72 1.18 1 57 ASP 1.61 1.39 1 58 VAL -3.60 -0.76 1 60 GLU 6.24 5.42 1 61 ASP 4.14 3.03 1 62 VAL 4.81 4.24 1 63 ALA 3.42 2.41 1 64 GLN 4.82 2.99 1 65 GLU 4.27 3.25 1 66 MET 4.20 4.45 1 67 VAL 3.52 2.37 1 68 GLU 3.38 2.81 1 69 SER 0.95 1.39 1 71 TYR 0.07 0.79 1 72 VAL -5.81 -2.55 1 74 GLU 4.70 3.83 1 76 ASP -2.02 0.24 1 78 LYS 5.05 3.67 1 79 THR 5.59 4.52 1 80 MET 5.19 2.74 1 81 ALA 3.94 3.03 1 82 LYS 3.88 3.18 1 83 ALA 3.13 2.60 1 84 ILE 4.83 5.38 1 85 LYS 4.47 4.23 1 86 ASP 4.23 3.33 1 87 ARG 3.56 1.07 1 88 VAL 6.32 4.62 1 89 SER 4.76 3.80 1 90 LEU 3.12 2.99 1 91 ILE 4.50 4.30 1 92 LYS 5.00 4.34 1 93 ARG 3.22 2.84 1 94 LYS 3.14 2.45 1 95 ARG 1.75 1.60 1 96 GLU 0.04 0.72 1 97 GLN 0.76 0.35 1 98 ARG 0.87 1.72 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 4.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.71 _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 6.31 _LACS_plot.Line_2_terminator_val_y_2 -1.36 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 HIS 4.53 3.33 0 11 VAL -4.94 2.58 1 12 ARG -4.47 3.41 1 13 VAL -2.06 0.44 1 14 GLU -7.50 4.66 1 15 LEU 1.43 0.12 1 16 ALA -0.46 -0.46 1 17 GLU -5.26 2.51 1 18 GLU -0.01 0.44 1 19 ASP -0.22 -0.03 1 20 ASP -1.10 0.24 1 22 GLU -2.66 3.12 1 23 LYS 1.89 0.05 1 24 ILE 0.64 0.17 1 25 ALA -2.37 0.33 1 26 ILE -6.33 3.94 1 27 LYS -0.85 0.51 1 28 LEU -5.48 3.55 1 29 TRP -5.49 3.15 1 30 LEU -1.93 1.74 1 31 ARG -2.70 1.51 1 32 ILE 2.23 -2.48 1 33 GLU -1.22 1.77 1 34 ASP -1.64 0.85 1 35 ILE 3.31 -0.64 1 36 LYS 3.77 -1.54 1 37 LYS -0.48 0.33 1 38 LEU -2.52 1.27 1 39 LYS 0.33 0.38 1 41 LYS -0.51 -0.73 1 42 TYR -4.45 2.97 1 43 LYS -0.44 0.34 1 44 ASP 1.61 -0.02 1 45 ASN 1.88 -0.80 1 46 GLU 0.35 0.71 1 47 ALA -3.99 2.49 1 48 ILE -2.78 2.51 1 49 GLU -2.70 1.42 1 50 PHE -2.39 0.75 1 51 SER -2.28 1.11 1 52 PHE -5.13 4.88 1 53 ASP -2.06 1.21 1 54 LEU 2.14 0.54 1 55 GLU -0.30 1.24 1 56 ARG -1.72 2.90 1 57 ASP 1.61 -0.22 1 58 VAL -3.60 2.84 1 60 GLU 6.24 -0.82 1 61 ASP 4.14 -1.11 1 62 VAL 4.81 -0.57 1 63 ALA 3.42 -1.01 1 64 GLN 4.82 -1.83 1 65 GLU 4.27 -1.02 1 66 MET 4.20 0.25 1 67 VAL 3.52 -1.15 1 68 GLU 3.38 -0.57 1 69 SER 0.95 0.44 1 71 TYR 0.07 0.72 1 72 VAL -5.81 3.26 1 74 GLU 4.70 -0.87 1 76 ASP -2.02 2.26 1 78 LYS 5.05 -1.38 1 79 THR 5.59 -1.07 1 80 MET 5.19 -2.45 1 81 ALA 3.94 -0.91 1 82 LYS 3.88 -0.70 1 83 ALA 3.13 -0.53 1 84 ILE 4.83 0.55 1 85 LYS 4.47 -0.24 1 86 ASP 4.23 -0.90 1 87 ARG 3.56 -2.49 1 88 VAL 6.32 -1.70 1 89 SER 4.76 -0.96 1 90 LEU 3.12 -0.13 1 91 ILE 4.50 -0.20 1 92 LYS 5.00 -0.66 1 93 ARG 3.22 -0.38 1 94 LYS 3.14 -0.69 1 95 ARG 1.75 -0.15 1 96 GLU 0.04 0.68 1 97 GLN 0.76 -0.41 1 98 ARG 0.87 0.85 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _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 6.31 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _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 13 VAL -2.06 1.33 0 11 VAL -4.94 0.84 1 12 ARG -4.47 0.34 1 14 GLU -7.50 0.38 1 15 LEU 1.43 -0.08 1 16 ALA -0.46 -0.30 1 17 GLU -5.26 0.16 1 18 GLU -0.01 -0.26 1 19 ASP -0.22 -0.03 1 20 ASP -1.10 -0.05 1 22 GLU -2.66 0.05 1 23 LYS 1.89 -0.17 1 24 ILE 0.64 0.00 1 25 ALA -2.37 0.96 1 26 ILE -6.33 0.43 1 27 LYS -0.85 0.22 1 28 LEU -5.48 0.31 1 29 TRP -5.49 0.82 1 30 LEU -1.93 0.66 1 31 ARG -2.70 0.61 1 32 ILE 2.23 -0.18 1 33 GLU -1.22 0.07 1 34 ASP -1.64 0.26 1 35 ILE 3.31 -0.23 1 36 LYS 3.77 -0.12 1 37 LYS -0.48 0.04 1 38 LEU -2.52 0.39 1 39 LYS 0.33 0.04 1 41 LYS -0.51 0.10 1 42 TYR -4.45 0.21 1 43 LYS -0.44 0.05 1 44 ASP 1.61 -0.31 1 45 ASN 1.88 -0.26 1 46 GLU 0.35 -0.22 1 47 ALA -3.99 0.99 1 48 ILE -2.78 0.19 1 49 GLU -2.70 0.65 1 50 PHE -2.39 0.32 1 51 SER -2.28 0.56 1 52 PHE -5.13 0.05 1 53 ASP -2.06 0.20 1 54 LEU 2.14 -0.17 1 55 GLU -0.30 0.10 1 56 ARG -1.72 0.05 1 57 ASP 1.61 0.10 1 58 VAL -3.60 0.36 1 60 GLU 6.24 -0.54 1 61 ASP 4.14 0.02 1 62 VAL 4.81 -0.26 1 63 ALA 3.42 -0.28 1 64 GLN 4.82 -0.30 1 65 GLU 4.27 -0.21 1 66 MET 4.20 -0.32 1 67 VAL 3.52 0.38 1 68 GLU 3.38 -0.33 1 69 SER 0.95 -0.12 1 71 TYR 0.07 0.12 1 72 VAL -5.81 0.52 1 74 GLU 4.70 -0.30 1 76 ASP -2.02 0.57 1 77 HIS 4.53 -1.12 1 78 LYS 5.05 -0.56 1 79 THR 5.59 -0.48 1 80 MET 5.19 -0.54 1 81 ALA 3.94 -0.76 1 82 LYS 3.88 -0.40 1 83 ALA 3.13 -0.11 1 84 ILE 4.83 -0.72 1 85 LYS 4.47 -0.69 1 86 ASP 4.23 -0.26 1 87 ARG 3.56 -0.01 1 88 VAL 6.32 -0.67 1 89 SER 4.76 -0.28 1 90 LEU 3.12 -0.20 1 91 ILE 4.50 -0.50 1 92 LYS 5.00 -0.45 1 93 ARG 3.22 -0.18 1 94 LYS 3.14 -0.16 1 95 ARG 1.75 -0.07 1 96 GLU 0.04 -0.11 1 97 GLN 0.76 0.01 1 98 ARG 0.87 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 -3.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _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 6.31 _LACS_plot.Line_2_terminator_val_y_2 2.73 _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 14 GLU -7.50 -1.54 0 50 PHE -2.39 -3.92 0 67 VAL 3.52 4.73 0 11 VAL -4.94 -2.39 1 12 ARG -4.47 -2.36 1 13 VAL -2.06 -1.06 1 15 LEU 1.43 -0.49 1 16 ALA -0.46 -1.86 1 17 GLU -5.26 -2.47 1 18 GLU -0.01 0.03 1 19 ASP -0.22 -0.20 1 20 ASP -1.10 1.22 1 22 GLU -2.66 0.35 1 23 LYS 1.89 0.46 1 24 ILE 0.64 -2.06 1 25 ALA -2.37 -1.36 1 26 ILE -6.33 -2.71 1 27 LYS -0.85 -1.57 1 28 LEU -5.48 -3.15 1 29 TRP -5.49 -0.08 1 30 LEU -1.93 -2.69 1 31 ARG -2.70 -1.48 1 32 ILE 2.23 -1.12 1 33 GLU -1.22 0.08 1 35 ILE 3.31 1.66 1 36 LYS 3.77 1.67 1 37 LYS -0.48 -0.49 1 39 LYS 0.33 2.99 1 41 LYS -0.51 -1.42 1 42 TYR -4.45 -0.51 1 43 LYS -0.44 -0.34 1 44 ASP 1.61 0.70 1 45 ASN 1.88 -0.47 1 46 GLU 0.35 -1.95 1 47 ALA -3.99 -1.12 1 48 ILE -2.78 -1.51 1 49 GLU -2.70 -0.81 1 51 SER -2.28 -1.39 1 52 PHE -5.13 -2.63 1 53 ASP -2.06 -0.19 1 54 LEU 2.14 0.47 1 55 GLU -0.30 1.36 1 56 ARG -1.72 0.80 1 57 ASP 1.61 -0.27 1 60 GLU 6.24 2.07 1 61 ASP 4.14 2.41 1 62 VAL 4.81 2.60 1 63 ALA 3.42 1.32 1 64 GLN 4.82 2.27 1 65 GLU 4.27 3.16 1 66 MET 4.20 2.51 1 68 GLU 3.38 2.53 1 69 SER 0.95 -0.21 1 71 TYR 0.07 -0.02 1 72 VAL -5.81 -1.81 1 74 GLU 4.70 2.22 1 76 ASP -2.02 -0.38 1 77 HIS 4.53 2.05 1 78 LYS 5.05 3.14 1 79 THR 5.59 1.94 1 80 MET 5.19 1.30 1 81 ALA 3.94 1.10 1 82 LYS 3.88 0.81 1 83 ALA 3.13 3.62 1 84 ILE 4.83 0.16 1 85 LYS 4.47 2.41 1 86 ASP 4.23 2.46 1 87 ARG 3.56 2.32 1 88 VAL 6.32 1.70 1 89 SER 4.76 2.10 1 90 LEU 3.12 1.90 1 91 ILE 4.50 2.44 1 92 LYS 5.00 2.68 1 93 ARG 3.22 2.49 1 94 LYS 3.14 2.07 1 95 ARG 1.75 1.11 1 96 GLU 0.04 0.15 1 97 GLN 0.76 -1.06 1 stop_ save_