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 bmr19362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.26 _LACS_plot.Line_1_terminator_val_y_1 -1.25 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.55 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 4.71 _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 82 ARG 0.64 1.37 0 10 LYS 0.83 0.64 1 11 TYR 0.64 0.52 1 12 ALA 1.89 1.43 1 13 GLU 3.24 2.94 1 14 GLU 3.14 2.67 1 15 GLU 3.25 2.74 1 16 LEU 3.56 2.79 1 17 GLU 3.44 2.67 1 18 GLN 4.45 3.29 1 19 VAL 5.66 4.29 1 20 ARG 5.20 4.30 1 21 GLU 3.07 2.39 1 22 ALA 4.42 2.87 1 23 LEU 4.14 3.17 1 24 ARG 4.16 3.34 1 25 LYS 4.57 3.69 1 26 ALA 3.62 2.37 1 27 GLU 3.77 3.02 1 28 LYS 3.46 2.04 1 29 GLU 3.11 2.31 1 30 LEU 3.58 2.66 1 31 GLU 2.62 2.02 1 32 SER 1.86 1.48 1 33 HIS 0.31 0.28 1 34 SER 2.53 1.96 1 35 SER 0.90 0.83 1 36 TRP -0.20 -0.38 1 37 TYR -1.26 -0.70 1 38 ALA 0.68 0.57 1 40 GLU 3.83 2.95 1 41 ALA 2.97 2.40 1 42 LEU 3.69 2.99 1 43 GLN 4.63 3.76 1 44 LYS 4.13 2.96 1 45 TRP 4.51 3.91 1 46 LEU 3.82 3.21 1 47 GLN 4.88 3.72 1 48 LEU 3.04 2.51 1 49 THR 6.01 4.57 1 50 HIS 4.88 4.06 1 51 GLU 3.54 2.67 1 52 VAL 5.97 4.50 1 53 GLU 3.49 2.92 1 54 VAL 5.42 4.24 1 55 GLN 4.67 3.18 1 56 TYR 4.22 3.60 1 57 TYR 4.99 3.88 1 58 ASN 3.86 3.27 1 59 ILE 4.55 3.61 1 60 LYS 4.27 2.85 1 61 LYS 3.85 3.03 1 62 GLN 3.54 2.79 1 63 ASN 3.15 2.64 1 64 ALA 3.57 2.42 1 65 GLU 3.04 2.65 1 66 LYS 4.04 3.19 1 67 GLN 3.68 2.70 1 68 LEU 3.31 2.73 1 69 LEU 3.31 2.69 1 70 VAL 3.72 2.82 1 71 ALA 2.50 1.63 1 72 LYS 2.66 2.29 1 73 GLU 2.21 1.82 1 75 ALA 1.95 1.45 1 76 GLU 1.50 1.28 1 77 LYS 2.15 1.70 1 78 ILE 1.27 0.85 1 79 LYS 0.87 0.60 1 80 LYS 0.09 0.07 1 81 LYS 0.33 0.26 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.26 _LACS_plot.Line_1_terminator_val_y_1 0.01 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.45 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 -1.30 _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 82 ARG 0.64 0.73 0 10 LYS 0.83 -0.19 1 11 TYR 0.64 -0.12 1 12 ALA 1.89 -0.46 1 13 GLU 3.24 -0.30 1 14 GLU 3.14 -0.47 1 15 GLU 3.25 -0.51 1 16 LEU 3.56 -0.77 1 17 GLU 3.44 -0.77 1 18 GLN 4.45 -1.16 1 19 VAL 5.66 -1.37 1 20 ARG 5.20 -0.90 1 21 GLU 3.07 -0.68 1 22 ALA 4.42 -1.55 1 23 LEU 4.14 -0.97 1 24 ARG 4.16 -0.82 1 25 LYS 4.57 -0.88 1 26 ALA 3.62 -1.25 1 27 GLU 3.77 -0.75 1 28 LYS 3.46 -1.42 1 29 GLU 3.11 -0.80 1 30 LEU 3.58 -0.92 1 31 GLU 2.62 -0.60 1 32 SER 1.86 -0.38 1 33 HIS 0.31 -0.03 1 34 SER 2.53 -0.57 1 35 SER 0.90 -0.07 1 36 TRP -0.20 -0.18 1 37 TYR -1.26 0.56 1 38 ALA 0.68 -0.11 1 40 GLU 3.83 -0.88 1 41 ALA 2.97 -0.57 1 42 LEU 3.69 -0.70 1 43 GLN 4.63 -0.87 1 44 LYS 4.13 -1.17 1 45 TRP 4.51 -0.60 1 46 LEU 3.82 -0.61 1 47 GLN 4.88 -1.16 1 48 LEU 3.04 -0.53 1 49 THR 6.01 -1.44 1 50 HIS 4.88 -0.82 1 51 GLU 3.54 -0.87 1 52 VAL 5.97 -1.47 1 53 GLU 3.49 -0.57 1 54 VAL 5.42 -1.18 1 55 GLN 4.67 -1.49 1 56 TYR 4.22 -0.62 1 57 TYR 4.99 -1.11 1 58 ASN 3.86 -0.59 1 59 ILE 4.55 -0.94 1 60 LYS 4.27 -1.42 1 61 LYS 3.85 -0.82 1 62 GLN 3.54 -0.75 1 63 ASN 3.15 -0.51 1 64 ALA 3.57 -1.15 1 65 GLU 3.04 -0.39 1 66 LYS 4.04 -0.85 1 67 GLN 3.68 -0.98 1 68 LEU 3.31 -0.58 1 69 LEU 3.31 -0.62 1 70 VAL 3.72 -0.90 1 71 ALA 2.50 -0.87 1 72 LYS 2.66 -0.37 1 73 GLU 2.21 -0.39 1 75 ALA 1.95 -0.50 1 76 GLU 1.50 -0.22 1 77 LYS 2.15 -0.45 1 78 ILE 1.27 -0.42 1 79 LYS 0.87 -0.27 1 80 LYS 0.09 -0.02 1 81 LYS 0.33 -0.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.26 _LACS_plot.Line_1_terminator_val_y_1 0.10 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 -0.40 _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 27 GLU 3.77 -0.72 0 10 LYS 0.83 -0.07 1 11 TYR 0.64 0.06 1 12 ALA 1.89 -0.01 1 13 GLU 3.24 -0.28 1 14 GLU 3.14 -0.19 1 15 GLU 3.25 -0.21 1 16 LEU 3.56 -0.15 1 17 GLU 3.44 -0.21 1 18 GLN 4.45 -0.20 1 19 VAL 5.66 -0.40 1 20 ARG 5.20 -0.45 1 21 GLU 3.07 -0.17 1 22 ALA 4.42 -0.14 1 23 LEU 4.14 -0.12 1 24 ARG 4.16 -0.10 1 25 LYS 4.57 -0.29 1 26 ALA 3.62 -0.17 1 28 LYS 3.46 -0.23 1 29 GLU 3.11 -0.20 1 30 LEU 3.58 -0.35 1 31 GLU 2.62 -0.34 1 32 SER 1.86 -0.12 1 33 HIS 0.31 0.00 1 34 SER 2.53 -0.12 1 35 SER 0.90 -0.04 1 36 TRP -0.20 -0.05 1 37 TYR -1.26 0.03 1 38 ALA 0.68 -0.05 1 40 GLU 3.83 -0.22 1 41 ALA 2.97 -0.15 1 42 LEU 3.69 -0.48 1 43 GLN 4.63 -0.31 1 44 LYS 4.13 -0.17 1 45 TRP 4.51 -0.36 1 46 LEU 3.82 -0.11 1 47 GLN 4.88 -0.28 1 48 LEU 3.04 -0.22 1 49 THR 6.01 -0.71 1 50 HIS 4.88 -0.28 1 51 GLU 3.54 -0.35 1 52 VAL 5.97 -0.51 1 53 GLU 3.49 -0.24 1 54 VAL 5.42 -0.40 1 55 GLN 4.67 -0.12 1 56 TYR 4.22 -0.39 1 57 TYR 4.99 -0.50 1 58 ASN 3.86 -0.32 1 59 ILE 4.55 -0.38 1 60 LYS 4.27 -0.39 1 62 GLN 3.54 -0.18 1 63 ASN 3.15 -0.19 1 64 ALA 3.57 -0.12 1 65 GLU 3.04 -0.30 1 66 LYS 4.04 -0.22 1 67 GLN 3.68 -0.23 1 68 LEU 3.31 -0.13 1 69 LEU 3.31 -0.14 1 70 VAL 3.72 -0.23 1 71 ALA 2.50 -0.05 1 72 LYS 2.66 -0.14 1 73 GLU 2.21 -0.17 1 75 ALA 1.95 -0.06 1 76 GLU 1.50 -0.15 1 77 LYS 2.15 -0.11 1 78 ILE 1.27 -0.04 1 79 LYS 0.87 -0.03 1 80 LYS 0.09 0.03 1 81 LYS 0.33 0.02 1 82 ARG 0.64 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.26 _LACS_plot.Line_1_terminator_val_y_1 -0.82 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 3.08 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 VAL 5.42 -0.27 0 10 LYS 0.83 0.27 1 11 TYR 0.64 0.71 1 12 ALA 1.89 1.23 1 13 GLU 3.24 1.65 1 14 GLU 3.14 2.28 1 15 GLU 3.25 1.91 1 16 LEU 3.56 1.08 1 17 GLU 3.44 2.43 1 18 GLN 4.45 3.15 1 19 VAL 5.66 1.20 1 20 ARG 5.20 2.02 1 21 GLU 3.07 2.01 1 22 ALA 4.42 3.17 1 23 LEU 4.14 2.04 1 24 ARG 4.16 3.20 1 25 LYS 4.57 2.43 1 26 ALA 3.62 1.48 1 27 GLU 3.77 1.54 1 28 LYS 3.46 3.06 1 29 GLU 3.11 2.50 1 30 LEU 3.58 1.71 1 31 GLU 2.62 1.77 1 32 SER 1.86 0.19 1 33 HIS 0.31 0.73 1 34 SER 2.53 0.56 1 35 SER 0.90 -0.07 1 36 TRP -0.20 -0.63 1 37 TYR -1.26 -1.34 1 40 GLU 3.83 1.58 1 41 ALA 2.97 1.60 1 42 LEU 3.69 1.87 1 43 GLN 4.63 2.60 1 44 LYS 4.13 1.70 1 45 TRP 4.51 2.98 1 46 LEU 3.82 0.91 1 47 GLN 4.88 2.56 1 48 LEU 3.04 1.07 1 49 THR 6.01 1.16 1 51 GLU 3.54 2.55 1 52 VAL 5.97 1.18 1 53 GLU 3.49 2.29 1 55 GLN 4.67 2.37 1 56 TYR 4.22 1.30 1 57 TYR 4.99 1.82 1 58 ASN 3.86 2.68 1 59 ILE 4.55 1.79 1 60 LYS 4.27 2.83 1 62 GLN 3.54 2.51 1 63 ASN 3.15 1.88 1 64 ALA 3.57 2.00 1 65 GLU 3.04 1.96 1 66 LYS 4.04 1.62 1 67 GLN 3.68 2.32 1 68 LEU 3.31 0.98 1 69 LEU 3.31 1.54 1 70 VAL 3.72 1.98 1 71 ALA 2.50 1.82 1 72 LYS 2.66 1.61 1 73 GLU 2.21 1.98 1 75 ALA 1.95 1.35 1 76 GLU 1.50 1.21 1 77 LYS 2.15 1.02 1 78 ILE 1.27 0.15 1 79 LYS 0.87 -0.08 1 80 LYS 0.09 -0.53 1 81 LYS 0.33 -1.30 1 stop_ save_