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 bmr10148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 -2.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 5.51 _LACS_plot.Line_2_terminator_val_y_2 3.83 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 PHE -3.86 -0.18 0 60 HIS -0.91 1.84 0 83 PHE -4.22 -0.36 0 37 GLU 4.74 4.87 0 55 PHE -4.49 -0.38 0 10 LEU 0.06 -0.04 1 13 LYS 0.23 0.15 1 14 THR 0.06 0.12 1 15 LYS -0.09 0.03 1 16 LYS -0.16 -0.23 1 17 GLU -3.22 -1.14 1 18 PHE -0.79 -0.74 1 19 ILE -3.56 -1.36 1 21 LYS 3.30 1.90 1 22 PHE 3.69 2.04 1 25 ARG 1.33 2.06 1 26 HIS -2.52 0.55 1 28 THR 0.96 1.06 1 29 LYS -4.27 -1.96 1 30 SER 4.72 2.62 1 31 TYR 3.30 2.91 1 32 ASN 3.09 2.10 1 33 LEU 4.77 2.72 1 34 LEU 4.29 3.41 1 35 ILE 3.96 2.54 1 36 HIS 4.93 4.49 1 38 ARG 3.11 2.26 1 39 THR 2.55 2.09 1 40 HIS 2.49 0.94 1 41 THR 0.76 0.40 1 42 ASP 0.22 0.17 1 43 GLU 0.42 0.78 1 44 ARG -1.23 -0.73 1 46 TYR -0.22 -0.37 1 47 THR -2.49 -1.21 1 49 ASP 2.74 1.30 1 50 ILE 1.94 1.79 1 52 HIS 5.11 3.19 1 53 LYS 1.23 2.00 1 54 ALA -5.12 -1.93 1 56 ARG 1.28 2.12 1 57 ARG -5.82 -2.02 1 58 GLN 4.51 3.34 1 59 ASP 5.06 2.21 1 61 LEU 4.88 2.63 1 62 ARG 5.04 3.53 1 63 ASP 3.36 2.49 1 64 HIS 4.24 3.77 1 65 ARG 4.61 3.67 1 66 TYR 3.13 2.29 1 67 ILE 3.66 2.34 1 68 HIS 0.65 0.34 1 69 SER 0.93 0.90 1 70 LYS 1.19 0.63 1 71 GLU 0.43 -0.13 1 72 LYS 0.08 -0.38 1 74 PHE -0.48 -0.68 1 75 LYS -3.44 -1.25 1 77 GLN 3.34 2.42 1 78 GLU 2.37 1.94 1 81 LYS 1.19 2.01 1 85 GLN -4.27 -1.60 1 86 SER 4.92 2.86 1 87 ARG 4.27 2.89 1 88 THR 4.79 2.80 1 89 LEU 4.86 2.59 1 90 ALA 4.53 3.15 1 91 VAL 4.56 3.68 1 92 HIS 5.51 4.55 1 93 LYS 4.99 4.05 1 94 THR 4.03 3.31 1 95 LEU 2.79 1.58 1 96 HIS 0.52 0.21 1 97 MET 0.43 0.59 1 98 GLN 0.29 0.25 1 99 THR 0.12 -0.03 1 100 SER -0.10 -0.06 1 101 SER -0.30 -0.05 1 103 THR -0.08 -0.05 1 104 ALA -0.45 -0.13 1 105 ALA -0.41 -0.09 1 106 SER 0.53 1.58 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 3.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 5.51 _LACS_plot.Line_2_terminator_val_y_2 -1.68 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 PHE -3.86 3.68 0 60 HIS -0.91 2.75 0 83 PHE -4.22 3.86 0 37 GLU 4.74 0.13 0 55 PHE -4.49 4.11 0 10 LEU 0.06 -0.10 1 13 LYS 0.23 -0.08 1 14 THR 0.06 0.06 1 15 LYS -0.09 0.12 1 16 LYS -0.16 -0.07 1 17 GLU -3.22 2.08 1 18 PHE -0.79 0.05 1 19 ILE -3.56 2.20 1 21 LYS 3.30 -1.40 1 22 PHE 3.69 -1.65 1 25 ARG 1.33 0.73 1 26 HIS -2.52 3.07 1 28 THR 0.96 0.10 1 29 LYS -4.27 2.31 1 30 SER 4.72 -2.10 1 31 TYR 3.30 -0.39 1 32 ASN 3.09 -0.99 1 33 LEU 4.77 -2.05 1 34 LEU 4.29 -0.88 1 35 ILE 3.96 -1.42 1 36 HIS 4.93 -0.44 1 38 ARG 3.11 -0.85 1 39 THR 2.55 -0.46 1 40 HIS 2.49 -1.55 1 41 THR 0.76 -0.36 1 42 ASP 0.22 -0.05 1 43 GLU 0.42 0.36 1 44 ARG -1.23 0.50 1 46 TYR -0.22 -0.15 1 47 THR -2.49 1.28 1 49 ASP 2.74 -1.44 1 50 ILE 1.94 -0.15 1 52 HIS 5.11 -1.92 1 53 LYS 1.23 0.77 1 54 ALA -5.12 3.19 1 56 ARG 1.28 0.84 1 57 ARG -5.82 3.80 1 58 GLN 4.51 -1.17 1 59 ASP 5.06 -2.85 1 61 LEU 4.88 -2.25 1 62 ARG 5.04 -1.51 1 63 ASP 3.36 -0.87 1 64 HIS 4.24 -0.47 1 65 ARG 4.61 -0.94 1 66 TYR 3.13 -0.84 1 67 ILE 3.66 -1.32 1 68 HIS 0.65 -0.31 1 69 SER 0.93 -0.03 1 70 LYS 1.19 -0.56 1 71 GLU 0.43 -0.56 1 72 LYS 0.08 -0.46 1 74 PHE -0.48 -0.20 1 75 LYS -3.44 2.19 1 77 GLN 3.34 -0.92 1 78 GLU 2.37 -0.43 1 81 LYS 1.19 0.82 1 85 GLN -4.27 2.67 1 86 SER 4.92 -2.06 1 87 ARG 4.27 -1.38 1 88 THR 4.79 -1.99 1 89 LEU 4.86 -2.27 1 90 ALA 4.53 -1.38 1 91 VAL 4.56 -0.88 1 92 HIS 5.51 -0.96 1 93 LYS 4.99 -0.94 1 94 THR 4.03 -0.72 1 95 LEU 2.79 -1.21 1 96 HIS 0.52 -0.31 1 97 MET 0.43 0.16 1 98 GLN 0.29 -0.04 1 99 THR 0.12 -0.15 1 100 SER -0.10 0.04 1 101 SER -0.30 0.25 1 103 THR -0.08 0.03 1 104 ALA -0.45 0.32 1 105 ALA -0.41 0.32 1 106 SER 0.53 1.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 0.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _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 5.51 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _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 58 GLN 4.51 -1.34 0 86 SER 4.92 -1.39 0 33 LEU 4.77 -1.42 0 30 SER 4.72 -1.45 0 10 LEU 0.06 -0.09 1 13 LYS 0.23 0.06 1 14 THR 0.06 -0.09 1 15 LYS -0.09 -0.04 1 16 LYS -0.16 -0.13 1 17 GLU -3.22 -0.05 1 18 PHE -0.79 0.05 1 19 ILE -3.56 0.48 1 21 LYS 3.30 -0.22 1 22 PHE 3.69 -0.23 1 25 ARG 1.33 -0.24 1 26 HIS -2.52 0.44 1 27 PHE -3.86 0.10 1 28 THR 0.96 0.34 1 29 LYS -4.27 0.25 1 31 TYR 3.30 -0.45 1 32 ASN 3.09 -0.46 1 34 LEU 4.29 -0.41 1 35 ILE 3.96 -0.64 1 36 HIS 4.93 -0.45 1 37 GLU 4.74 -0.43 1 38 ARG 3.11 -0.21 1 39 THR 2.55 -0.27 1 40 HIS 2.49 -0.32 1 41 THR 0.76 -0.20 1 42 ASP 0.22 -0.12 1 43 GLU 0.42 -0.25 1 44 ARG -1.23 -0.12 1 46 TYR -0.22 0.21 1 47 THR -2.49 0.78 1 49 ASP 2.74 -0.29 1 50 ILE 1.94 -0.33 1 52 HIS 5.11 -0.21 1 53 LYS 1.23 -0.27 1 54 ALA -5.12 0.78 1 55 PHE -4.49 0.10 1 56 ARG 1.28 0.26 1 57 ARG -5.82 0.31 1 59 ASP 5.06 -0.59 1 60 HIS -0.91 -0.30 1 61 LEU 4.88 -1.19 1 62 ARG 5.04 -0.62 1 63 ASP 3.36 -0.24 1 64 HIS 4.24 -0.52 1 65 ARG 4.61 -0.76 1 66 TYR 3.13 -0.21 1 67 ILE 3.66 -0.33 1 68 HIS 0.65 0.04 1 69 SER 0.93 -0.09 1 70 LYS 1.19 -0.11 1 71 GLU 0.43 -0.16 1 72 LYS 0.08 -0.22 1 74 PHE -0.48 0.07 1 75 LYS -3.44 0.70 1 77 GLN 3.34 -0.21 1 78 GLU 2.37 -0.18 1 81 LYS 1.19 -0.37 1 83 PHE -4.22 0.13 1 85 GLN -4.27 0.31 1 87 ARG 4.27 -0.29 1 88 THR 4.79 -0.51 1 89 LEU 4.86 -1.19 1 90 ALA 4.53 -0.41 1 91 VAL 4.56 -0.46 1 92 HIS 5.51 -0.64 1 93 LYS 4.99 -0.59 1 94 THR 4.03 -0.32 1 95 LEU 2.79 -0.32 1 96 HIS 0.52 0.00 1 97 MET 0.43 -0.06 1 98 GLN 0.29 0.04 1 99 THR 0.12 0.02 1 100 SER -0.10 0.02 1 101 SER -0.30 -0.01 1 103 THR -0.08 -0.08 1 104 ALA -0.45 0.00 1 105 ALA -0.41 0.01 1 106 SER 0.53 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.82 _LACS_plot.Line_1_terminator_val_y_1 -1.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _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 5.51 _LACS_plot.Line_2_terminator_val_y_2 1.70 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 HIS -0.91 4.52 0 10 LEU 0.06 -0.37 1 13 LYS 0.23 0.09 1 14 THR 0.06 -0.44 1 15 LYS -0.09 -0.68 1 16 LYS -0.16 -1.27 1 17 GLU -3.22 -1.95 1 18 PHE -0.79 -1.87 1 19 ILE -3.56 -0.82 1 21 LYS 3.30 -0.84 1 22 PHE 3.69 1.02 1 25 ARG 1.33 -1.66 1 26 HIS -2.52 0.63 1 27 PHE -3.86 -0.59 1 28 THR 0.96 0.01 1 29 LYS -4.27 -0.20 1 31 TYR 3.30 0.56 1 32 ASN 3.09 2.43 1 33 LEU 4.77 -0.70 1 34 LEU 4.29 2.31 1 35 ILE 3.96 2.30 1 36 HIS 4.93 4.81 1 37 GLU 4.74 2.24 1 38 ARG 3.11 1.56 1 39 THR 2.55 1.14 1 40 HIS 2.49 1.43 1 41 THR 0.76 -0.22 1 42 ASP 0.22 -0.43 1 43 GLU 0.42 -0.29 1 44 ARG -1.23 -1.14 1 46 TYR -0.22 -0.49 1 47 THR -2.49 -1.00 1 49 ASP 2.74 -1.21 1 50 ILE 1.94 0.04 1 52 HIS 5.11 0.12 1 53 LYS 1.23 -2.78 1 54 ALA -5.12 -1.04 1 55 PHE -4.49 -0.55 1 56 ARG 1.28 -0.10 1 57 ARG -5.82 0.00 1 58 GLN 4.51 1.93 1 59 ASP 5.06 1.40 1 61 LEU 4.88 -0.75 1 62 ARG 5.04 2.28 1 63 ASP 3.36 2.26 1 64 HIS 4.24 2.23 1 65 ARG 4.61 2.00 1 66 TYR 3.13 2.29 1 67 ILE 3.66 1.11 1 68 HIS 0.65 1.53 1 69 SER 0.93 0.09 1 70 LYS 1.19 0.21 1 71 GLU 0.43 -0.56 1 72 LYS 0.08 -0.03 1 74 PHE -0.48 -1.36 1 75 LYS -3.44 -1.13 1 77 GLN 3.34 0.28 1 78 GLU 2.37 0.68 1 81 LYS 1.19 -1.96 1 83 PHE -4.22 -0.38 1 85 GLN -4.27 -0.77 1 87 ARG 4.27 1.22 1 88 THR 4.79 2.64 1 89 LEU 4.86 -0.71 1 90 ALA 4.53 2.89 1 91 VAL 4.56 2.41 1 92 HIS 5.51 2.42 1 93 LYS 4.99 2.61 1 94 THR 4.03 1.71 1 95 LEU 2.79 1.36 1 96 HIS 0.52 1.13 1 97 MET 0.43 -0.13 1 98 GLN 0.29 0.24 1 99 THR 0.12 -0.21 1 100 SER -0.10 -0.45 1 101 SER -0.30 -0.20 1 103 THR -0.08 -0.44 1 104 ALA -0.45 -0.67 1 105 ALA -0.41 -0.90 1 106 SER 0.53 4.00 1 stop_ save_