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 bmr26807_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.63 _LACS_plot.Line_1_terminator_val_y_1 -1.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 5.05 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 MET 6.58 2.19 0 10 GLU 3.15 2.57 1 11 SER 2.35 1.27 1 13 ASP -0.66 -0.66 1 14 ARG 0.72 0.32 1 15 ARG -4.55 -1.82 1 16 PHE -4.26 -0.27 1 17 SER 1.88 2.54 1 18 ARG -5.27 -1.50 1 19 SER 4.16 2.75 1 20 ASP 4.30 2.31 1 21 GLU 1.62 1.72 1 22 LEU 5.26 2.80 1 23 THR 6.03 5.23 1 24 ARG 4.31 3.63 1 25 HIS 4.38 4.30 1 26 ILE 5.33 4.65 1 27 ARG 3.51 2.41 1 28 ILE 3.41 1.87 1 29 HIS 1.93 1.27 1 30 THR 1.26 1.22 1 32 GLN 0.46 0.23 1 33 LYS -0.67 -0.18 1 35 PHE -0.17 -0.74 1 36 GLN -4.24 -0.92 1 38 ARG 3.24 1.66 1 39 ILE 3.16 2.64 1 42 ARG 1.52 2.02 1 43 ASN -3.32 -0.62 1 44 PHE -3.94 -0.20 1 45 SER 0.86 1.60 1 46 ARG -5.52 -1.68 1 47 SER 4.16 2.67 1 48 ASP 5.04 2.22 1 49 HIS -0.17 1.83 1 50 LEU 5.26 3.05 1 51 THR 6.87 5.59 1 52 THR 5.71 4.76 1 53 HIS 5.40 4.51 1 54 ILE 5.97 5.12 1 55 ARG 3.62 2.52 1 56 THR 2.62 2.33 1 57 HIS 1.55 0.89 1 58 THR 1.05 1.09 1 60 GLU 0.66 0.49 1 61 LYS -1.26 -0.32 1 63 PHE -0.37 -0.36 1 64 ALA -4.16 -1.82 1 66 ASP 2.87 2.29 1 67 ILE 2.73 2.21 1 70 ARG 2.24 2.12 1 71 LYS -2.73 -1.02 1 72 PHE -4.19 -0.53 1 73 ALA 0.97 1.68 1 74 ARG -5.63 -1.93 1 75 SER 4.41 2.67 1 76 ASP 4.58 2.59 1 77 GLU 1.63 1.81 1 78 ARG 6.17 3.47 1 79 LYS 4.79 3.79 1 80 ARG 4.27 3.59 1 81 HIS 4.99 4.09 1 82 THR 5.05 4.93 1 83 LYS 3.57 2.57 1 84 ILE 3.64 2.21 1 85 HIS 0.66 0.25 1 86 LEU 0.47 0.33 1 87 ARG 0.73 0.26 1 88 GLN 0.29 0.31 1 89 LYS 0.21 0.17 1 90 ASP 0.79 1.86 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26807_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.63 _LACS_plot.Line_1_terminator_val_y_1 4.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.76 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 -1.82 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 MET 6.58 -4.39 0 10 GLU 3.15 -0.58 1 11 SER 2.35 -1.08 1 13 ASP -0.66 0.00 1 14 ARG 0.72 -0.40 1 15 ARG -4.55 2.73 1 16 PHE -4.26 3.99 1 17 SER 1.88 0.66 1 18 ARG -5.27 3.77 1 19 SER 4.16 -1.41 1 20 ASP 4.30 -1.99 1 21 GLU 1.62 0.10 1 22 LEU 5.26 -2.46 1 23 THR 6.03 -0.80 1 24 ARG 4.31 -0.68 1 25 HIS 4.38 -0.08 1 26 ILE 5.33 -0.68 1 27 ARG 3.51 -1.10 1 28 ILE 3.41 -1.54 1 29 HIS 1.93 -0.66 1 30 THR 1.26 -0.04 1 32 GLN 0.46 -0.23 1 33 LYS -0.67 0.49 1 35 PHE -0.17 -0.57 1 36 GLN -4.24 3.32 1 38 ARG 3.24 -1.58 1 39 ILE 3.16 -0.52 1 42 ARG 1.52 0.50 1 43 ASN -3.32 2.70 1 44 PHE -3.94 3.74 1 45 SER 0.86 0.74 1 46 ARG -5.52 3.84 1 47 SER 4.16 -1.49 1 48 ASP 5.04 -2.82 1 49 HIS -0.17 2.00 1 50 LEU 5.26 -2.21 1 51 THR 6.87 -1.28 1 52 THR 5.71 -0.95 1 53 HIS 5.40 -0.89 1 54 ILE 5.97 -0.85 1 55 ARG 3.62 -1.10 1 56 THR 2.62 -0.29 1 57 HIS 1.55 -0.66 1 58 THR 1.05 0.04 1 60 GLU 0.66 -0.17 1 61 LYS -1.26 0.94 1 63 PHE -0.37 0.01 1 64 ALA -4.16 2.34 1 66 ASP 2.87 -0.58 1 67 ILE 2.73 -0.52 1 70 ARG 2.24 -0.12 1 71 LYS -2.73 1.71 1 72 PHE -4.19 3.66 1 73 ALA 0.97 0.71 1 74 ARG -5.63 3.70 1 75 SER 4.41 -1.74 1 76 ASP 4.58 -1.99 1 77 GLU 1.63 0.18 1 78 ARG 6.17 -2.70 1 79 LYS 4.79 -1.00 1 80 ARG 4.27 -0.68 1 81 HIS 4.99 -0.90 1 82 THR 5.05 -0.12 1 83 LYS 3.57 -1.00 1 84 ILE 3.64 -1.43 1 85 HIS 0.66 -0.41 1 86 LEU 0.47 -0.14 1 87 ARG 0.73 -0.47 1 88 GLN 0.29 0.02 1 89 LYS 0.21 -0.04 1 90 ASP 0.79 1.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26807_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.63 _LACS_plot.Line_1_terminator_val_y_1 0.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _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 75 SER 4.41 -1.43 0 78 ARG 6.17 -1.63 0 10 GLU 3.15 -0.38 1 11 SER 2.35 -0.30 1 13 ASP -0.66 0.13 1 14 ARG 0.72 -0.35 1 15 ARG -4.55 0.64 1 16 PHE -4.26 0.26 1 17 SER 1.88 0.30 1 18 ARG -5.27 0.50 1 19 SER 4.16 -1.34 1 20 ASP 4.30 -0.39 1 21 GLU 1.62 -0.56 1 22 LEU 5.26 -0.97 1 23 THR 6.03 -0.68 1 24 ARG 4.31 -0.42 1 25 HIS 4.38 -0.48 1 26 ILE 5.33 -0.64 1 27 ARG 3.51 -0.27 1 28 ILE 3.41 -0.19 1 29 HIS 1.93 -0.11 1 30 THR 1.26 -0.08 1 32 GLN 0.46 -0.08 1 33 LYS -0.67 -0.09 1 35 PHE -0.17 0.09 1 36 GLN -4.24 0.86 1 38 ARG 3.24 -0.03 1 39 ILE 3.16 -0.27 1 41 MET 6.58 -0.08 1 42 ARG 1.52 -0.28 1 43 ASN -3.32 0.60 1 44 PHE -3.94 0.15 1 45 SER 0.86 0.23 1 46 ARG -5.52 0.16 1 47 SER 4.16 -1.30 1 48 ASP 5.04 -0.34 1 49 HIS -0.17 -0.26 1 50 LEU 5.26 -1.04 1 51 THR 6.87 -0.59 1 52 THR 5.71 -0.55 1 53 HIS 5.40 -0.48 1 54 ILE 5.97 -0.59 1 55 ARG 3.62 -0.18 1 56 THR 2.62 -0.23 1 57 HIS 1.55 0.10 1 58 THR 1.05 -0.07 1 60 GLU 0.66 -0.18 1 61 LYS -1.26 -0.06 1 63 PHE -0.37 0.04 1 64 ALA -4.16 0.97 1 66 ASP 2.87 -0.19 1 67 ILE 2.73 -0.27 1 70 ARG 2.24 -0.40 1 71 LYS -2.73 0.50 1 72 PHE -4.19 0.01 1 73 ALA 0.97 0.25 1 74 ARG -5.63 0.49 1 76 ASP 4.58 -0.44 1 77 GLU 1.63 -0.49 1 79 LYS 4.79 -0.38 1 80 ARG 4.27 -0.40 1 81 HIS 4.99 -0.50 1 82 THR 5.05 -0.66 1 83 LYS 3.57 -0.35 1 84 ILE 3.64 -0.24 1 85 HIS 0.66 0.01 1 86 LEU 0.47 0.01 1 87 ARG 0.73 -0.03 1 88 GLN 0.29 -0.02 1 89 LYS 0.21 0.01 1 90 ASP 0.79 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26807_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.63 _LACS_plot.Line_1_terminator_val_y_1 -1.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _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 6.58 _LACS_plot.Line_2_terminator_val_y_2 1.68 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 HIS -0.17 4.08 0 90 ASP 0.79 4.46 0 10 GLU 3.15 0.37 1 11 SER 2.35 -1.79 1 13 ASP -0.66 0.46 1 14 ARG 0.72 -0.87 1 15 ARG -4.55 -1.37 1 16 PHE -4.26 -0.68 1 17 SER 1.88 -0.62 1 18 ARG -5.27 0.33 1 19 SER 4.16 2.03 1 20 ASP 4.30 2.20 1 21 GLU 1.62 2.32 1 22 LEU 5.26 -0.10 1 23 THR 6.03 1.05 1 24 ARG 4.31 1.97 1 25 HIS 4.38 2.64 1 26 ILE 5.33 0.85 1 27 ARG 3.51 2.22 1 28 ILE 3.41 1.28 1 29 HIS 1.93 1.85 1 30 THR 1.26 0.69 1 32 GLN 0.46 -0.15 1 33 LYS -0.67 -0.48 1 35 PHE -0.17 -1.61 1 36 GLN -4.24 -1.04 1 38 ARG 3.24 -0.45 1 39 ILE 3.16 0.41 1 41 MET 6.58 -0.66 1 42 ARG 1.52 -1.88 1 43 ASN -3.32 -0.93 1 44 PHE -3.94 -0.43 1 45 SER 0.86 -0.44 1 46 ARG -5.52 -0.01 1 48 ASP 5.04 2.24 1 50 LEU 5.26 -0.33 1 52 THR 5.71 1.46 1 53 HIS 5.40 4.40 1 54 ILE 5.97 1.48 1 55 ARG 3.62 1.91 1 56 THR 2.62 1.05 1 57 HIS 1.55 1.60 1 58 THR 1.05 0.59 1 60 GLU 0.66 0.04 1 61 LYS -1.26 -0.68 1 63 PHE -0.37 -1.30 1 64 ALA -4.16 -0.01 1 66 ASP 2.87 -0.57 1 67 ILE 2.73 0.61 1 70 ARG 2.24 -2.02 1 71 LYS -2.73 -0.89 1 72 PHE -4.19 -0.95 1 73 ALA 0.97 -0.11 1 74 ARG -5.63 0.43 1 75 SER 4.41 2.87 1 76 ASP 4.58 2.27 1 77 GLU 1.63 2.16 1 78 ARG 6.17 1.43 1 79 LYS 4.79 2.58 1 80 ARG 4.27 2.33 1 81 HIS 4.99 2.31 1 82 THR 5.05 0.87 1 83 LYS 3.57 1.99 1 84 ILE 3.64 1.01 1 85 HIS 0.66 0.97 1 86 LEU 0.47 -0.58 1 87 ARG 0.73 -0.18 1 88 GLN 0.29 -0.49 1 89 LYS 0.21 -1.40 1 stop_ save_