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 bmr18587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.52 _LACS_plot.Line_1_terminator_val_y_1 -2.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.95 _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 9.79 _LACS_plot.Line_2_terminator_val_y_2 7.55 _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 105 MET -7.52 -1.47 0 11 LYS 0.24 0.14 1 12 VAL -0.17 -0.20 1 13 ARG -0.55 -0.26 1 14 LYS -0.12 -0.04 1 15 ILE -0.10 -0.27 1 17 SER 0.18 0.18 1 18 THR -3.94 -1.91 1 19 ARG -4.31 -1.84 1 20 LYS -1.75 -1.01 1 21 ILE -4.39 -1.07 1 22 LYS -3.89 -2.07 1 23 ILE -2.97 -3.22 1 24 THR 0.79 0.33 1 25 PHE 1.65 2.51 1 26 ALA -0.15 -1.14 1 27 LEU -2.13 0.75 1 28 ASP -4.01 0.49 1 29 ALA 3.54 2.83 1 30 THR 5.71 4.09 1 31 PHE -0.98 1.19 1 32 ASP 5.90 5.43 1 33 SER 4.22 3.20 1 34 VAL 4.24 3.56 1 35 LEU 3.74 2.04 1 36 SER 4.19 3.71 1 37 LYS 1.49 1.67 1 38 ALA -0.68 1.85 1 40 SER -1.98 0.16 1 41 GLU -3.14 -1.09 1 42 PHE -3.40 -0.41 1 43 GLU -1.86 -1.13 1 44 VAL -7.04 -3.93 1 45 ASP -0.44 1.15 1 46 LYS 4.09 3.10 1 47 ASP 0.28 -0.24 1 48 VAL 1.20 0.58 1 49 THR -3.52 -1.87 1 50 LEU 4.17 3.76 1 51 ASP 3.45 2.79 1 52 GLU 1.52 1.86 1 53 LEU 3.43 2.23 1 54 LEU 4.82 3.25 1 55 ASP 4.12 3.39 1 57 VAL 5.03 3.98 1 58 LEU 5.09 3.34 1 59 ASP 3.22 3.47 1 60 ALA 3.42 2.80 1 62 GLU 5.14 3.78 1 63 SER 3.91 3.30 1 64 THR 6.34 4.69 1 65 LEU 0.32 0.59 1 66 SER 9.79 7.81 1 69 LYS 3.98 3.99 1 70 GLU -0.94 -1.47 1 71 HIS -0.20 2.45 1 72 ASP 2.55 2.42 1 73 VAL 0.95 4.07 1 74 ILE -0.15 0.78 1 76 THR 5.50 4.16 1 77 LYS 3.81 2.97 1 78 VAL 6.06 4.64 1 80 ALA 3.76 2.57 1 81 LEU 5.17 2.97 1 83 ASP 4.10 3.08 1 84 ARG 4.37 4.09 1 85 LEU 2.76 2.35 1 86 ALA 0.63 0.58 1 88 ASP -2.38 -1.03 1 89 TYR 1.38 1.53 1 90 VAL -1.23 -0.53 1 91 TYR -1.61 0.20 1 92 LEU -5.08 -1.91 1 93 PHE -4.16 -2.87 1 94 ASP -2.12 -1.44 1 95 GLU 2.57 2.48 1 98 ASP -2.10 -0.60 1 99 GLU 0.59 -1.03 1 100 VAL -5.06 -2.38 1 101 ILE 2.44 0.35 1 102 ALA -5.06 -0.47 1 104 ARG -2.78 -1.63 1 106 TYR -4.18 -1.46 1 108 SER -3.72 -2.17 1 109 PHE 1.37 1.90 1 110 SER -0.97 -0.55 1 111 ALA 0.22 -0.71 1 113 ASP -0.34 -0.42 1 114 ASP 0.76 1.69 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.52 _LACS_plot.Line_1_terminator_val_y_1 4.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.05 _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 9.79 _LACS_plot.Line_2_terminator_val_y_2 -2.24 _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 105 MET -7.52 6.05 0 11 LYS 0.24 -0.10 1 12 VAL -0.17 -0.03 1 13 ARG -0.55 0.29 1 14 LYS -0.12 0.08 1 15 ILE -0.10 -0.17 1 17 SER 0.18 0.00 1 18 THR -3.94 2.03 1 19 ARG -4.31 2.47 1 20 LYS -1.75 0.74 1 21 ILE -4.39 3.32 1 22 LYS -3.89 1.82 1 23 ILE -2.97 -0.25 1 24 THR 0.79 -0.46 1 25 PHE 1.65 0.86 1 26 ALA -0.15 -0.99 1 27 LEU -2.13 2.88 1 28 ASP -4.01 4.50 1 29 ALA 3.54 -0.71 1 30 THR 5.71 -1.62 1 31 PHE -0.98 2.17 1 32 ASP 5.90 -0.47 1 33 SER 4.22 -1.02 1 34 VAL 4.24 -0.68 1 35 LEU 3.74 -1.70 1 36 SER 4.19 -0.48 1 37 LYS 1.49 0.18 1 38 ALA -0.68 2.53 1 40 SER -1.98 2.14 1 41 GLU -3.14 2.05 1 42 PHE -3.40 2.99 1 43 GLU -1.86 0.73 1 44 VAL -7.04 3.11 1 45 ASP -0.44 1.59 1 46 LYS 4.09 -0.99 1 47 ASP 0.28 -0.52 1 48 VAL 1.20 -0.62 1 49 THR -3.52 1.65 1 50 LEU 4.17 -0.41 1 51 ASP 3.45 -0.66 1 52 GLU 1.52 0.34 1 53 LEU 3.43 -1.20 1 54 LEU 4.82 -1.57 1 55 ASP 4.12 -0.73 1 57 VAL 5.03 -1.05 1 58 LEU 5.09 -1.75 1 59 ASP 3.22 0.25 1 60 ALA 3.42 -0.62 1 62 GLU 5.14 -1.36 1 63 SER 3.91 -0.61 1 64 THR 6.34 -1.65 1 65 LEU 0.32 0.27 1 66 SER 9.79 -1.98 1 69 LYS 3.98 0.01 1 70 GLU -0.94 -0.53 1 71 HIS -0.20 2.65 1 72 ASP 2.55 -0.13 1 73 VAL 0.95 3.12 1 74 ILE -0.15 0.93 1 76 THR 5.50 -1.34 1 77 LYS 3.81 -0.84 1 78 VAL 6.06 -1.42 1 80 ALA 3.76 -1.19 1 81 LEU 5.17 -2.20 1 83 ASP 4.10 -1.02 1 84 ARG 4.37 -0.28 1 85 LEU 2.76 -0.41 1 86 ALA 0.63 -0.05 1 88 ASP -2.38 1.35 1 89 TYR 1.38 0.15 1 90 VAL -1.23 0.70 1 91 TYR -1.61 1.81 1 92 LEU -5.08 3.17 1 93 PHE -4.16 1.29 1 94 ASP -2.12 0.68 1 95 GLU 2.57 -0.09 1 98 ASP -2.10 1.50 1 99 GLU 0.59 -1.62 1 100 VAL -5.06 2.68 1 101 ILE 2.44 -2.09 1 102 ALA -5.06 4.59 1 104 ARG -2.78 1.15 1 106 TYR -4.18 2.72 1 108 SER -3.72 1.55 1 109 PHE 1.37 0.53 1 110 SER -0.97 0.42 1 111 ALA 0.22 -0.93 1 113 ASP -0.34 -0.08 1 114 ASP 0.76 0.93 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.52 _LACS_plot.Line_1_terminator_val_y_1 0.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 9.79 _LACS_plot.Line_2_terminator_val_y_2 -0.86 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 111 ALA 0.22 -1.60 0 11 LYS 0.24 -0.03 1 12 VAL -0.17 0.00 1 13 ARG -0.55 0.03 1 14 LYS -0.12 -0.01 1 15 ILE -0.10 0.00 1 17 SER 0.18 0.07 1 18 THR -3.94 0.65 1 19 ARG -4.31 0.42 1 20 LYS -1.75 0.94 1 21 ILE -4.39 0.42 1 22 LYS -3.89 1.01 1 23 ILE -2.97 0.29 1 24 THR 0.79 -0.40 1 25 PHE 1.65 -0.27 1 26 ALA -0.15 0.60 1 27 LEU -2.13 0.33 1 28 ASP -4.01 0.04 1 29 ALA 3.54 -0.09 1 30 THR 5.71 -0.54 1 31 PHE -0.98 0.10 1 32 ASP 5.90 -0.23 1 33 SER 4.22 -0.26 1 34 VAL 4.24 -0.33 1 35 LEU 3.74 -0.36 1 37 LYS 1.49 0.02 1 38 ALA -0.68 0.10 1 40 SER -1.98 0.43 1 41 GLU -3.14 0.81 1 42 PHE -3.40 -0.05 1 43 GLU -1.86 0.82 1 44 VAL -7.04 0.73 1 45 ASP -0.44 -0.12 1 46 LYS 4.09 -0.54 1 47 ASP 0.28 0.19 1 48 VAL 1.20 0.04 1 49 THR -3.52 0.32 1 50 LEU 4.17 -0.51 1 51 ASP 3.45 -0.37 1 52 GLU 1.52 -0.31 1 53 LEU 3.43 -0.46 1 54 LEU 4.82 -0.38 1 55 ASP 4.12 -0.31 1 57 VAL 5.03 -0.31 1 58 LEU 5.09 -0.61 1 59 ASP 3.22 -0.30 1 60 ALA 3.42 -0.01 1 62 GLU 5.14 -0.66 1 63 SER 3.91 -0.26 1 64 THR 6.34 -0.45 1 65 LEU 0.32 -0.03 1 66 SER 9.79 -0.80 1 69 LYS 3.98 -0.48 1 70 GLU -0.94 0.05 1 71 HIS -0.20 -0.30 1 72 ASP 2.55 -0.24 1 73 VAL 0.95 -0.16 1 74 ILE -0.15 0.32 1 76 THR 5.50 -0.25 1 77 LYS 3.81 -0.03 1 78 VAL 6.06 -0.90 1 80 ALA 3.76 -0.10 1 81 LEU 5.17 0.05 1 83 ASP 4.10 -0.19 1 84 ARG 4.37 -0.32 1 85 LEU 2.76 -0.20 1 86 ALA 0.63 0.05 1 88 ASP -2.38 0.30 1 89 TYR 1.38 -0.43 1 90 VAL -1.23 0.01 1 91 TYR -1.61 -0.05 1 92 LEU -5.08 1.15 1 93 PHE -4.16 0.70 1 94 ASP -2.12 0.41 1 95 GLU 2.57 -0.15 1 98 ASP -2.10 0.32 1 99 GLU 0.59 0.39 1 100 VAL -5.06 0.18 1 101 ILE 2.44 -0.21 1 102 ALA -5.06 0.17 1 104 ARG -2.78 0.86 1 105 MET -7.52 0.51 1 106 TYR -4.18 0.33 1 108 SER -3.72 0.45 1 109 PHE 1.37 0.84 1 110 SER -0.97 0.21 1 113 ASP -0.34 -0.18 1 114 ASP 0.76 -0.33 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.52 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _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 6.33 _LACS_plot.Line_2_terminator_val_y_2 2.31 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 MET -7.52 -2.70 0 91 TYR -1.61 2.79 0 11 LYS 0.24 -0.02 1 12 VAL -0.17 -0.49 1 13 ARG -0.55 -0.53 1 14 LYS -0.12 -0.51 1 17 SER 0.18 -0.21 1 18 THR -3.94 -0.70 1 19 ARG -4.31 -2.88 1 20 LYS -1.75 -0.04 1 21 ILE -4.39 -2.17 1 22 LYS -3.89 -1.23 1 23 ILE -2.97 -0.48 1 24 THR 0.79 -1.39 1 25 PHE 1.65 -1.45 1 26 ALA -0.15 -1.76 1 27 LEU -2.13 -0.40 1 28 ASP -4.01 -0.85 1 29 ALA 3.54 1.39 1 30 THR 5.71 0.33 1 31 PHE -0.98 0.42 1 32 ASP 5.90 2.49 1 33 SER 4.22 2.63 1 34 VAL 4.24 2.75 1 35 LEU 3.74 0.96 1 36 SER 4.19 1.34 1 37 LYS 1.49 1.30 1 38 ALA -0.68 1.31 1 40 SER -1.98 -0.19 1 41 GLU -3.14 -1.53 1 42 PHE -3.40 -1.87 1 43 GLU -1.86 -0.90 1 44 VAL -7.04 -1.81 1 45 ASP -0.44 0.82 1 46 LYS 4.09 0.23 1 47 ASP 0.28 -0.21 1 48 VAL 1.20 -1.72 1 49 THR -3.52 1.18 1 50 LEU 4.17 0.70 1 51 ASP 3.45 2.22 1 52 GLU 1.52 3.46 1 53 LEU 3.43 -0.04 1 54 LEU 4.82 2.74 1 55 ASP 4.12 2.54 1 57 VAL 5.03 1.82 1 58 LEU 5.09 0.02 1 59 ASP 3.22 2.40 1 60 ALA 3.42 3.22 1 62 GLU 5.14 2.80 1 63 SER 3.91 1.96 1 64 THR 6.34 0.69 1 65 LEU 0.32 0.34 1 69 LYS 3.98 -0.74 1 70 GLU -0.94 -0.10 1 71 HIS -0.20 2.93 1 72 ASP 2.55 0.73 1 73 VAL 0.95 2.40 1 74 ILE -0.15 0.69 1 76 THR 5.50 2.94 1 77 LYS 3.81 3.26 1 78 VAL 6.06 1.40 1 80 ALA 3.76 2.63 1 83 ASP 4.10 3.17 1 84 ARG 4.37 2.19 1 85 LEU 2.76 0.04 1 86 ALA 0.63 1.29 1 88 ASP -2.38 -1.09 1 89 TYR 1.38 -1.11 1 90 VAL -1.23 -2.54 1 92 LEU -5.08 -1.91 1 93 PHE -4.16 -1.69 1 94 ASP -2.12 1.84 1 95 GLU 2.57 0.67 1 98 ASP -2.10 0.60 1 99 GLU 0.59 -2.07 1 100 VAL -5.06 -3.19 1 101 ILE 2.44 -1.04 1 106 TYR -4.18 -2.14 1 108 SER -3.72 -0.82 1 109 PHE 1.37 0.89 1 110 SER -0.97 -2.54 1 113 ASP -0.34 -1.20 1 stop_ save_