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 bmr34422_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.69 _LACS_plot.Line_1_terminator_val_y_1 -2.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.47 _LACS_plot.Line_2_terminator_val_x_2 5.52 _LACS_plot.Line_2_terminator_val_y_2 4.34 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 LYS 5.24 0.88 0 10 LEU 3.68 2.75 1 11 ALA 4.17 2.97 1 12 GLN 4.63 3.36 1 13 ILE 4.53 4.07 1 14 GLN 2.15 2.47 1 15 GLN 3.72 3.23 1 16 ALA 3.38 2.33 1 17 LYS 0.28 0.25 1 19 GLU -6.69 -2.29 1 20 LYS 1.00 0.96 1 21 GLU 2.75 1.33 1 23 GLU -4.60 -1.85 1 24 TYR -1.73 -0.28 1 25 THR -2.89 -0.42 1 26 LEU 0.97 0.45 1 27 LEU 0.67 0.89 1 28 THR -0.29 -0.18 1 29 GLU -2.99 -1.07 1 30 ARG -2.24 -1.15 1 32 LEU 0.12 0.18 1 34 ARG 1.73 0.44 1 35 ARG -0.38 -0.48 1 36 ARG -0.30 0.01 1 37 GLU -4.61 -1.40 1 38 PHE -1.82 0.01 1 39 VAL -1.12 -0.87 1 40 MET -5.15 -2.67 1 41 GLN -6.32 -1.89 1 42 VAL -6.54 -4.14 1 43 LYS -4.79 -1.45 1 44 VAL -2.90 -0.72 1 46 ASN 0.47 -0.21 1 47 HIS -2.43 0.88 1 48 THR -3.45 -1.24 1 49 ALA -5.45 -1.62 1 50 GLU -5.92 -2.02 1 52 THR -4.14 -2.09 1 54 THR 1.18 1.08 1 55 ASN -3.66 -1.13 1 56 LYS 5.53 4.88 1 57 LYS 5.31 3.98 1 58 VAL 4.63 3.80 1 59 ALA 4.08 3.34 1 60 LYS 4.31 4.44 1 61 ARG 4.67 4.10 1 62 ASN 3.52 2.59 1 63 ALA 5.40 3.23 1 64 ALA 4.44 3.27 1 65 GLU 3.59 3.51 1 66 ASN 3.85 2.42 1 67 MET 3.79 1.00 1 68 LEU 5.09 3.81 1 69 GLU 3.57 3.02 1 70 ILE 4.87 4.02 1 71 LEU 0.15 0.12 1 73 PHE -0.61 -0.01 1 74 LYS 0.71 1.69 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34422_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.69 _LACS_plot.Line_1_terminator_val_y_1 4.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.53 _LACS_plot.Line_2_terminator_val_x_2 5.52 _LACS_plot.Line_2_terminator_val_y_2 -1.18 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 LYS 5.24 -4.36 0 10 LEU 3.68 -0.93 1 11 ALA 4.17 -1.20 1 12 GLN 4.63 -1.27 1 13 ILE 4.53 -0.46 1 14 GLN 2.15 0.32 1 15 GLN 3.72 -0.49 1 16 ALA 3.38 -1.05 1 17 LYS 0.28 -0.03 1 19 GLU -6.69 4.40 1 20 LYS 1.00 -0.04 1 21 GLU 2.75 -1.42 1 23 GLU -4.60 2.75 1 24 TYR -1.73 1.45 1 25 THR -2.89 2.47 1 26 LEU 0.97 -0.52 1 27 LEU 0.67 0.22 1 28 THR -0.29 0.11 1 29 GLU -2.99 1.92 1 30 ARG -2.24 1.09 1 32 LEU 0.12 0.06 1 34 ARG 1.73 -1.29 1 35 ARG -0.38 -0.10 1 36 ARG -0.30 0.31 1 37 GLU -4.61 3.21 1 38 PHE -1.82 1.83 1 39 VAL -1.12 0.25 1 40 MET -5.15 2.48 1 41 GLN -6.32 4.43 1 42 VAL -6.54 2.40 1 43 LYS -4.79 3.34 1 44 VAL -2.90 2.18 1 46 ASN 0.47 -0.68 1 47 HIS -2.43 3.31 1 48 THR -3.45 2.21 1 49 ALA -5.45 3.83 1 50 GLU -5.92 3.90 1 52 THR -4.14 2.05 1 54 THR 1.18 -0.10 1 55 ASN -3.66 2.53 1 56 LYS 5.53 -0.65 1 57 LYS 5.31 -1.33 1 58 VAL 4.63 -0.83 1 59 ALA 4.08 -0.74 1 60 LYS 4.31 0.13 1 61 ARG 4.67 -0.57 1 62 ASN 3.52 -0.93 1 63 ALA 5.40 -2.17 1 64 ALA 4.44 -1.17 1 65 GLU 3.59 -0.08 1 66 ASN 3.85 -1.43 1 67 MET 3.79 -2.79 1 68 LEU 5.09 -1.28 1 69 GLU 3.57 -0.55 1 70 ILE 4.87 -0.85 1 71 LEU 0.15 -0.03 1 73 PHE -0.61 0.60 1 74 LYS 0.71 0.98 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34422_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.69 _LACS_plot.Line_1_terminator_val_y_1 0.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.27 _LACS_plot.Line_2_terminator_val_x_2 5.52 _LACS_plot.Line_2_terminator_val_y_2 -0.48 _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 52 THR -4.14 1.65 0 10 LEU 3.68 -0.30 1 11 ALA 4.17 -0.38 1 12 GLN 4.63 -0.14 1 13 ILE 4.53 -0.55 1 14 GLN 2.15 -0.45 1 15 GLN 3.72 -0.09 1 16 ALA 3.38 -0.15 1 17 LYS 0.28 -0.08 1 18 LYS 5.24 -0.34 1 19 GLU -6.69 0.26 1 20 LYS 1.00 -0.23 1 21 GLU 2.75 -0.18 1 23 GLU -4.60 0.41 1 24 TYR -1.73 1.01 1 25 THR -2.89 0.20 1 26 LEU 0.97 0.55 1 27 LEU 0.67 0.15 1 28 THR -0.29 0.15 1 29 GLU -2.99 0.40 1 30 ARG -2.24 0.38 1 32 LEU 0.12 -0.05 1 34 ARG 1.73 0.03 1 35 ARG -0.38 0.25 1 36 ARG -0.30 0.04 1 37 GLU -4.61 0.24 1 38 PHE -1.82 0.16 1 39 VAL -1.12 0.83 1 40 MET -5.15 0.84 1 41 GLN -6.32 1.16 1 42 VAL -6.54 1.04 1 43 LYS -4.79 0.91 1 44 VAL -2.90 0.09 1 46 ASN 0.47 -0.03 1 47 HIS -2.43 0.17 1 48 THR -3.45 0.97 1 49 ALA -5.45 0.44 1 50 GLU -5.92 1.34 1 54 THR 1.18 0.44 1 55 ASN -3.66 0.02 1 56 LYS 5.53 -1.02 1 57 LYS 5.31 -0.48 1 58 VAL 4.63 -0.45 1 59 ALA 4.08 -0.55 1 60 LYS 4.31 -0.67 1 61 ARG 4.67 -0.47 1 62 ASN 3.52 -0.11 1 63 ALA 5.40 -0.44 1 64 ALA 4.44 -0.38 1 65 GLU 3.59 -0.37 1 66 ASN 3.85 -0.09 1 67 MET 3.79 0.09 1 68 LEU 5.09 -0.45 1 69 GLU 3.57 -0.22 1 70 ILE 4.87 -0.46 1 71 LEU 0.15 -0.34 1 73 PHE -0.61 0.03 1 74 LYS 0.71 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34422_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.69 _LACS_plot.Line_1_terminator_val_y_1 -2.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 5.52 _LACS_plot.Line_2_terminator_val_y_2 1.78 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 19 GLU -6.69 1.07 0 10 LEU 3.68 0.16 1 11 ALA 4.17 2.80 1 12 GLN 4.63 3.02 1 13 ILE 4.53 2.00 1 14 GLN 2.15 2.35 1 15 GLN 3.72 4.51 1 16 ALA 3.38 1.65 1 17 LYS 0.28 -1.38 1 18 LYS 5.24 -0.79 1 20 LYS 1.00 -0.61 1 23 GLU -4.60 -0.97 1 24 TYR -1.73 0.36 1 25 THR -2.89 -2.35 1 26 LEU 0.97 -1.51 1 27 LEU 0.67 -0.11 1 28 THR -0.29 -2.98 1 29 GLU -2.99 -1.33 1 30 ARG -2.24 -1.02 1 34 ARG 1.73 -0.58 1 35 ARG -0.38 -1.78 1 36 ARG -0.30 -0.76 1 37 GLU -4.61 -2.47 1 38 PHE -1.82 -1.13 1 39 VAL -1.12 -1.12 1 40 MET -5.15 -2.55 1 41 GLN -6.32 -1.61 1 42 VAL -6.54 -4.75 1 43 LYS -4.79 -0.16 1 44 VAL -2.90 -0.96 1 46 ASN 0.47 -0.43 1 47 HIS -2.43 0.46 1 48 THR -3.45 -2.06 1 49 ALA -5.45 -2.77 1 50 GLU -5.92 -0.74 1 52 THR -4.14 -0.22 1 54 THR 1.18 -1.46 1 55 ASN -3.66 -0.52 1 56 LYS 5.53 -0.89 1 57 LYS 5.31 2.93 1 58 VAL 4.63 1.28 1 59 ALA 4.08 0.86 1 60 LYS 4.31 0.98 1 61 ARG 4.67 1.65 1 62 ASN 3.52 2.28 1 63 ALA 5.40 0.78 1 64 ALA 4.44 1.56 1 65 GLU 3.59 2.31 1 66 ASN 3.85 3.27 1 67 MET 3.79 1.01 1 68 LEU 5.09 1.14 1 69 GLU 3.57 3.54 1 70 ILE 4.87 1.88 1 71 LEU 0.15 -0.72 1 73 PHE -0.61 -1.59 1 stop_ save_