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 bmr25299_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.52 _LACS_plot.Line_1_terminator_val_y_1 -2.15 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 4.66 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 HIS -2.86 1.68 0 51 TYR 5.90 5.68 0 10 THR 0.39 0.13 1 11 GLU -0.45 0.00 1 12 ASP -0.16 -0.05 1 13 LEU 0.39 0.11 1 15 ASP 0.06 0.09 1 16 LYS 0.64 0.06 1 17 LYS 0.80 0.22 1 18 GLU 0.05 0.23 1 20 GLU -0.86 0.07 1 21 TYR -3.31 -0.52 1 22 ILE -5.40 -1.36 1 23 LYS -1.64 -1.16 1 24 LEU -6.52 -2.20 1 25 LYS -3.04 -1.19 1 26 VAL -0.46 -1.02 1 27 ILE -2.32 -1.23 1 29 GLN 2.81 2.14 1 30 ASP 0.47 -0.78 1 31 SER 3.86 2.19 1 32 SER 0.31 0.51 1 33 GLU -3.81 -1.23 1 34 ILE -3.22 -0.99 1 35 HIS -3.58 -0.38 1 36 PHE -5.51 -0.64 1 37 LYS -1.32 -0.65 1 38 VAL -6.48 -3.76 1 39 LYS 0.22 0.16 1 40 MET 2.59 1.98 1 41 THR -0.68 -1.69 1 42 THR 1.57 1.46 1 43 HIS 0.70 1.14 1 44 LEU 2.32 0.86 1 45 LYS 4.24 4.38 1 46 LYS 3.85 2.51 1 47 LEU 4.01 3.45 1 48 LYS 6.43 3.67 1 49 GLU 2.97 3.05 1 50 SER 4.35 3.82 1 53 GLN 4.36 3.23 1 54 ARG 3.85 2.65 1 55 GLN -0.79 -0.38 1 57 VAL -2.66 -2.31 1 59 MET 3.46 3.03 1 60 ASN 2.53 0.86 1 61 SER 0.13 1.16 1 62 LEU -5.32 -1.57 1 63 ARG -3.83 -1.44 1 64 PHE -2.46 -1.29 1 65 LEU -5.31 -1.37 1 66 PHE -3.63 -1.28 1 67 GLU 3.26 0.27 1 69 GLN -3.37 -1.88 1 70 ARG 1.72 1.28 1 71 ILE -0.27 0.05 1 72 ALA -1.11 -1.76 1 73 ASP 3.99 3.04 1 74 ASN 0.43 -1.13 1 76 THR -1.15 -1.06 1 78 LYS 3.11 2.89 1 79 GLU 2.04 2.29 1 80 LEU -0.46 -0.42 1 82 MET -0.42 1.57 1 83 GLU 3.82 0.07 1 84 GLU 2.28 2.36 1 85 GLU 5.32 2.10 1 86 ASP 0.28 1.29 1 87 VAL -2.81 -0.75 1 88 ILE -3.64 -1.52 1 89 GLU -4.88 -1.54 1 90 VAL -3.60 -2.51 1 91 TYR -5.30 -1.64 1 92 GLN 0.34 0.38 1 93 GLU -0.75 -0.21 1 94 GLN 0.09 0.11 1 95 THR 0.24 0.25 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25299_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.52 _LACS_plot.Line_1_terminator_val_y_1 4.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 -1.76 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 HIS -2.86 4.54 0 51 TYR 5.90 -0.22 0 10 THR 0.39 -0.26 1 11 GLU -0.45 0.45 1 12 ASP -0.16 0.11 1 13 LEU 0.39 -0.28 1 15 ASP 0.06 0.03 1 16 LYS 0.64 -0.58 1 17 LYS 0.80 -0.58 1 18 GLU 0.05 0.18 1 20 GLU -0.86 0.93 1 21 TYR -3.31 2.79 1 22 ILE -5.40 4.04 1 23 LYS -1.64 0.48 1 24 LEU -6.52 4.32 1 25 LYS -3.04 1.85 1 26 VAL -0.46 -0.56 1 27 ILE -2.32 1.09 1 29 GLN 2.81 -0.67 1 30 ASP 0.47 -1.25 1 31 SER 3.86 -1.67 1 32 SER 0.31 0.20 1 33 GLU -3.81 2.58 1 34 ILE -3.22 2.23 1 35 HIS -3.58 3.20 1 36 PHE -5.51 4.87 1 37 LYS -1.32 0.67 1 38 VAL -6.48 2.72 1 39 LYS 0.22 -0.06 1 40 MET 2.59 -0.61 1 41 THR -0.68 -1.01 1 42 THR 1.57 -0.11 1 43 HIS 0.70 0.44 1 44 LEU 2.32 -1.46 1 45 LYS 4.24 0.14 1 46 LYS 3.85 -1.34 1 47 LEU 4.01 -0.56 1 48 LYS 6.43 -2.76 1 49 GLU 2.97 0.08 1 50 SER 4.35 -0.53 1 53 GLN 4.36 -1.13 1 54 ARG 3.85 -1.20 1 55 GLN -0.79 0.41 1 57 VAL -2.66 0.35 1 59 MET 3.46 -0.43 1 60 ASN 2.53 -1.67 1 61 SER 0.13 1.03 1 62 LEU -5.32 3.75 1 63 ARG -3.83 2.39 1 64 PHE -2.46 1.17 1 65 LEU -5.31 3.94 1 66 PHE -3.63 2.35 1 67 GLU 3.26 -2.99 1 69 GLN -3.37 1.49 1 70 ARG 1.72 -0.44 1 71 ILE -0.27 0.32 1 72 ALA -1.11 -0.65 1 73 ASP 3.99 -0.95 1 74 ASN 0.43 -1.56 1 76 THR -1.15 0.09 1 78 LYS 3.11 -0.22 1 79 GLU 2.04 0.25 1 80 LEU -0.46 0.04 1 82 MET -0.42 1.99 1 83 GLU 3.82 -3.75 1 84 GLU 2.28 0.08 1 85 GLU 5.32 -3.22 1 86 ASP 0.28 1.01 1 87 VAL -2.81 2.06 1 88 ILE -3.64 2.12 1 89 GLU -4.88 3.34 1 90 VAL -3.60 1.09 1 91 TYR -5.30 3.66 1 92 GLN 0.34 0.04 1 93 GLU -0.75 0.54 1 94 GLN 0.09 0.02 1 95 THR 0.24 0.01 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25299_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.48 _LACS_plot.Line_1_terminator_val_y_1 0.80 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 -0.56 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 LYS 4.24 0.83 0 10 THR 0.39 0.01 1 11 GLU -0.45 -0.07 1 12 ASP -0.16 0.00 1 13 LEU 0.39 0.01 1 15 ASP 0.06 -0.23 1 16 LYS 0.64 0.03 1 17 LYS 0.80 0.00 1 18 GLU 0.05 -0.03 1 20 GLU -0.86 -0.09 1 21 TYR -3.31 0.57 1 22 ILE -5.40 0.66 1 23 LYS -1.64 0.38 1 26 VAL -0.46 0.97 1 27 ILE -2.32 0.86 1 29 GLN 2.81 -0.18 1 30 ASP 0.47 -0.06 1 31 SER 3.86 -0.38 1 33 GLU -3.81 0.80 1 34 ILE -3.22 0.28 1 37 LYS -1.32 1.00 1 38 VAL -6.48 0.87 1 39 LYS 0.22 0.26 1 40 MET 2.59 -0.34 1 41 THR -0.68 0.01 1 42 THR 1.57 -0.16 1 43 HIS 0.70 0.07 1 44 LEU 2.32 -0.31 1 46 LYS 3.85 -0.19 1 47 LEU 4.01 -0.65 1 48 LYS 6.43 0.14 1 49 GLU 2.97 -0.37 1 50 SER 4.35 -0.15 1 51 TYR 5.90 -0.07 1 53 GLN 4.36 -0.20 1 54 ARG 3.85 -0.28 1 55 GLN -0.79 -0.04 1 57 VAL -2.66 0.52 1 59 MET 3.46 0.32 1 60 ASN 2.53 -0.04 1 61 SER 0.13 0.05 1 62 LEU -5.32 0.79 1 63 ARG -3.83 -0.15 1 64 PHE -2.46 0.34 1 65 LEU -5.31 0.96 1 66 PHE -3.63 0.60 1 67 GLU 3.26 -0.77 1 69 GLN -3.37 0.29 1 70 ARG 1.72 0.05 1 71 ILE -0.27 0.37 1 74 ASN 0.43 -0.41 1 75 HIS -2.86 0.21 1 76 THR -1.15 0.65 1 78 LYS 3.11 -0.36 1 79 GLU 2.04 -0.38 1 80 LEU -0.46 -0.11 1 82 MET -0.42 -0.28 1 83 GLU 3.82 0.10 1 84 GLU 2.28 -0.05 1 85 GLU 5.32 -0.62 1 86 ASP 0.28 0.27 1 87 VAL -2.81 0.84 1 88 ILE -3.64 0.66 1 89 GLU -4.88 0.52 1 90 VAL -3.60 0.10 1 91 TYR -5.30 0.64 1 92 GLN 0.34 0.24 1 93 GLU -0.75 0.01 1 94 GLN 0.09 0.12 1 95 THR 0.24 0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25299_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.52 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 1.37 _LACS_plot.Y_axis_chem_shift_offset 0.56 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 HIS 0.70 3.79 0 10 THR 0.39 -0.45 1 11 GLU -0.45 -1.12 1 12 ASP -0.16 -0.36 1 13 LEU 0.39 0.19 1 15 ASP 0.06 -0.24 1 16 LYS 0.64 -0.23 1 17 LYS 0.80 -0.21 1 18 GLU 0.05 -0.09 1 20 GLU -0.86 -2.69 1 21 TYR -3.31 -0.59 1 22 ILE -5.40 -3.34 1 23 LYS -1.64 -1.48 1 24 LEU -6.52 -2.12 1 25 LYS -3.04 -2.91 1 26 VAL -0.46 -0.61 1 27 ILE -2.32 -0.85 1 29 GLN 2.81 -0.35 1 30 ASP 0.47 -0.27 1 31 SER 3.86 -1.44 1 32 SER 0.31 -1.44 1 33 GLU -3.81 -1.72 1 34 ILE -3.22 -2.27 1 35 HIS -3.58 0.25 1 36 PHE -5.51 -2.23 1 38 VAL -6.48 -2.44 1 39 LYS 0.22 2.28 1 40 MET 2.59 -0.17 1 41 THR -0.68 -0.64 1 42 THR 1.57 -1.17 1 44 LEU 2.32 -0.80 1 45 LYS 4.24 -0.18 1 46 LYS 3.85 2.03 1 47 LEU 4.01 -0.48 1 48 LYS 6.43 1.67 1 49 GLU 2.97 2.40 1 50 SER 4.35 2.15 1 51 TYR 5.90 1.05 1 53 GLN 4.36 2.63 1 54 ARG 3.85 1.61 1 55 GLN -0.79 0.06 1 59 MET 3.46 0.77 1 60 ASN 2.53 0.09 1 61 SER 0.13 -1.60 1 62 LEU -5.32 -2.39 1 63 ARG -3.83 -3.71 1 64 PHE -2.46 -2.06 1 65 LEU -5.31 -2.07 1 66 PHE -3.63 -1.26 1 67 GLU 3.26 -0.23 1 69 GLN -3.37 -1.20 1 70 ARG 1.72 0.24 1 72 ALA -1.11 -0.18 1 73 ASP 3.99 -0.56 1 74 ASN 0.43 0.47 1 75 HIS -2.86 1.09 1 78 LYS 3.11 2.30 1 79 GLU 2.04 1.55 1 80 LEU -0.46 -1.28 1 82 MET -0.42 -2.21 1 83 GLU 3.82 -1.51 1 84 GLU 2.28 0.49 1 85 GLU 5.32 -1.94 1 86 ASP 0.28 -2.24 1 87 VAL -2.81 -0.68 1 88 ILE -3.64 -1.93 1 89 GLU -4.88 -1.77 1 90 VAL -3.60 -1.77 1 91 TYR -5.30 -1.77 1 92 GLN 0.34 0.10 1 93 GLU -0.75 -0.66 1 94 GLN 0.09 -0.21 1 95 THR 0.24 0.15 1 stop_ save_