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 bmr6727_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 -3.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.46 _LACS_plot.Line_2_terminator_val_x_2 8.31 _LACS_plot.Line_2_terminator_val_y_2 6.11 _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 40 LYS -6.85 3.59 0 10 ARG 0.99 0.28 1 11 ARG 0.35 0.19 1 12 ILE 0.55 -0.10 1 13 ARG -0.34 -0.50 1 14 ARG -0.28 -0.36 1 16 PHE 0.03 -0.05 1 17 SER -3.52 -1.72 1 18 VAL 7.67 5.38 1 19 ALA 3.79 2.53 1 20 GLU 0.72 3.42 1 21 VAL 8.32 6.13 1 22 GLU 5.09 4.01 1 23 ALA 3.74 2.48 1 24 LEU 3.21 3.62 1 25 VAL 6.67 5.33 1 26 GLN 3.87 3.01 1 27 ALA 1.82 2.48 1 28 VAL 5.48 3.49 1 29 GLU 4.79 4.25 1 30 LYS 1.59 2.25 1 31 LEU -1.37 0.14 1 33 THR 0.28 -1.18 1 35 ARG 2.72 2.56 1 36 TRP 3.34 2.56 1 37 ARG 6.22 4.05 1 38 ASP 3.76 2.92 1 39 VAL 6.81 4.82 1 41 LEU 2.67 2.54 1 43 ALA -1.96 5.54 1 44 PHE -2.41 -1.12 1 45 GLU 4.96 4.15 1 46 ASP -0.07 -0.83 1 47 ALA -1.63 -2.62 1 48 ASP 3.42 2.66 1 49 HIS 3.49 4.31 1 50 ARG -2.13 -3.71 1 51 THR -3.68 -1.47 1 52 TYR 5.18 2.96 1 53 VAL 4.39 3.05 1 54 ASP 2.97 2.92 1 55 LEU 4.60 2.54 1 56 LYS 4.84 2.75 1 57 ASP 3.61 2.85 1 58 LYS 3.91 0.37 1 59 TRP 3.05 3.36 1 60 LYS 5.30 4.04 1 61 THR 5.33 4.15 1 62 LEU 3.69 3.01 1 63 VAL 6.77 4.81 1 64 HIS 3.89 5.08 1 65 THR 5.95 4.95 1 66 ALA 1.84 1.67 1 67 LYS 1.08 1.46 1 68 ILE -0.16 -0.14 1 69 SER 0.94 0.57 1 71 GLN 3.78 2.37 1 72 GLN -0.72 -0.21 1 73 ARG 2.42 1.14 1 74 ARG -2.10 -1.09 1 80 GLN 4.20 3.07 1 81 GLU 5.05 3.42 1 82 LEU 2.79 2.08 1 83 LEU 4.95 2.81 1 84 ASN 4.26 2.69 1 85 ARG 2.97 3.68 1 86 VAL 6.18 4.38 1 87 LEU 4.03 3.07 1 88 ASN 3.98 2.95 1 89 ALA 3.83 2.84 1 90 HIS 3.10 5.94 1 92 TYR 3.98 3.60 1 93 TRP 3.07 2.56 1 94 THR 5.17 4.26 1 95 GLN 3.80 2.43 1 96 GLN 2.91 1.94 1 97 GLN 2.53 1.67 1 98 MET 2.23 1.44 1 99 GLN 1.88 1.18 1 100 GLN 1.41 0.83 1 101 LEU 0.61 0.48 1 102 GLN 0.53 0.22 1 103 GLN 0.05 0.07 1 104 ASN 0.47 0.27 1 105 VAL 1.56 1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6727_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 3.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.54 _LACS_plot.Line_2_terminator_val_x_2 8.31 _LACS_plot.Line_2_terminator_val_y_2 -2.20 _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 40 LYS -6.85 10.44 0 10 ARG 0.99 -0.71 1 11 ARG 0.35 -0.16 1 12 ILE 0.55 -0.65 1 13 ARG -0.34 -0.16 1 14 ARG -0.28 -0.08 1 16 PHE 0.03 -0.08 1 17 SER -3.52 1.80 1 18 VAL 7.67 -2.29 1 19 ALA 3.79 -1.26 1 20 GLU 0.72 2.70 1 21 VAL 8.32 -2.19 1 22 GLU 5.09 -1.08 1 23 ALA 3.74 -1.26 1 24 LEU 3.21 0.41 1 25 VAL 6.67 -1.34 1 26 GLN 3.87 -0.86 1 27 ALA 1.82 0.66 1 28 VAL 5.48 -1.99 1 29 GLU 4.79 -0.54 1 30 LYS 1.59 0.66 1 31 LEU -1.37 1.51 1 33 THR 0.28 -1.46 1 35 ARG 2.72 -0.16 1 36 TRP 3.34 -0.78 1 37 ARG 6.22 -2.17 1 38 ASP 3.76 -0.84 1 39 VAL 6.81 -1.99 1 41 LEU 2.67 -0.13 1 43 ALA -1.96 7.50 1 44 PHE -2.41 1.29 1 45 GLU 4.96 -0.81 1 46 ASP -0.07 -0.76 1 47 ALA -1.63 -0.99 1 48 ASP 3.42 -0.76 1 49 HIS 3.49 0.82 1 50 ARG -2.13 -1.58 1 51 THR -3.68 2.21 1 52 TYR 5.18 -2.22 1 53 VAL 4.39 -1.34 1 54 ASP 2.97 -0.05 1 55 LEU 4.60 -2.06 1 56 LYS 4.84 -2.09 1 57 ASP 3.61 -0.76 1 58 LYS 3.91 -3.54 1 59 TRP 3.05 0.31 1 60 LYS 5.30 -1.26 1 61 THR 5.33 -1.18 1 62 LEU 3.69 -0.68 1 63 VAL 6.77 -1.96 1 64 HIS 3.89 1.19 1 65 THR 5.95 -1.00 1 66 ALA 1.84 -0.17 1 67 LYS 1.08 0.38 1 68 ILE -0.16 0.02 1 69 SER 0.94 -0.37 1 71 GLN 3.78 -1.41 1 72 GLN -0.72 0.51 1 73 ARG 2.42 -1.28 1 74 ARG -2.10 1.01 1 80 GLN 4.20 -1.13 1 81 GLU 5.05 -1.63 1 82 LEU 2.79 -0.71 1 83 LEU 4.95 -2.14 1 84 ASN 4.26 -1.57 1 85 ARG 2.97 0.71 1 86 VAL 6.18 -1.80 1 87 LEU 4.03 -0.96 1 88 ASN 3.98 -1.03 1 89 ALA 3.83 -0.99 1 90 HIS 3.10 2.84 1 92 TYR 3.98 -0.38 1 93 TRP 3.07 -0.51 1 94 THR 5.17 -0.91 1 95 GLN 3.80 -1.37 1 96 GLN 2.91 -0.97 1 97 GLN 2.53 -0.86 1 98 MET 2.23 -0.79 1 99 GLN 1.88 -0.70 1 100 GLN 1.41 -0.58 1 101 LEU 0.61 -0.13 1 102 GLN 0.53 -0.31 1 103 GLN 0.05 0.02 1 104 ASN 0.47 -0.20 1 105 VAL 1.56 -0.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6727_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 0.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _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 8.31 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 LYS 4.84 -2.49 0 10 ARG 0.99 -0.09 1 11 ARG 0.35 -0.08 1 12 ILE 0.55 -0.11 1 13 ARG -0.34 0.02 1 16 PHE 0.03 0.05 1 17 SER -3.52 0.22 1 18 VAL 7.67 -0.42 1 19 ALA 3.79 -0.05 1 20 GLU 0.72 -0.12 1 21 VAL 8.32 -0.45 1 22 GLU 5.09 -0.53 1 23 ALA 3.74 -0.20 1 24 LEU 3.21 -0.07 1 25 VAL 6.67 -0.37 1 26 GLN 3.87 0.03 1 27 ALA 1.82 -0.13 1 28 VAL 5.48 -1.02 1 29 GLU 4.79 -0.47 1 30 LYS 1.59 0.01 1 31 LEU -1.37 -0.28 1 33 THR 0.28 0.33 1 35 ARG 2.72 0.25 1 36 TRP 3.34 -0.65 1 37 ARG 6.22 -0.46 1 38 ASP 3.76 -0.22 1 39 VAL 6.81 -0.72 1 40 LYS -6.85 -0.27 1 41 LEU 2.67 -0.30 1 43 ALA -1.96 0.34 1 44 PHE -2.41 0.28 1 45 GLU 4.96 -0.53 1 46 ASP -0.07 0.05 1 47 ALA -1.63 0.39 1 48 ASP 3.42 -0.35 1 49 HIS 3.49 -0.29 1 50 ARG -2.13 0.31 1 51 THR -3.68 0.32 1 52 TYR 5.18 -0.34 1 53 VAL 4.39 -0.97 1 54 ASP 2.97 -0.46 1 55 LEU 4.60 -0.60 1 57 ASP 3.61 -0.44 1 58 LYS 3.91 -0.38 1 59 TRP 3.05 -0.53 1 60 LYS 5.30 -0.64 1 61 THR 5.33 -0.28 1 62 LEU 3.69 -0.61 1 63 VAL 6.77 -1.33 1 64 HIS 3.89 -0.72 1 65 THR 5.95 0.24 1 66 ALA 1.84 -0.48 1 67 LYS 1.08 -0.29 1 68 ILE -0.16 0.04 1 71 GLN 3.78 -0.20 1 72 GLN -0.72 -0.03 1 73 ARG 2.42 -0.16 1 74 ARG -2.10 0.17 1 80 GLN 4.20 -0.61 1 81 GLU 5.05 -0.26 1 82 LEU 2.79 -0.11 1 83 LEU 4.95 -0.52 1 84 ASN 4.26 -0.31 1 85 ARG 2.97 -0.19 1 86 VAL 6.18 -0.28 1 87 LEU 4.03 -0.27 1 88 ASN 3.98 -0.15 1 89 ALA 3.83 0.25 1 90 HIS 3.10 -0.06 1 92 TYR 3.98 -0.49 1 93 TRP 3.07 -0.32 1 94 THR 5.17 -0.29 1 95 GLN 3.80 -0.26 1 96 GLN 2.91 -0.44 1 97 GLN 2.53 -0.21 1 98 MET 2.23 -0.17 1 99 GLN 1.88 -0.15 1 100 GLN 1.41 -0.14 1 101 LEU 0.61 -0.07 1 102 GLN 0.53 -0.08 1 103 GLN 0.05 -0.02 1 104 ASN 0.47 -0.01 1 105 VAL 1.56 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6727_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 -1.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.07 _LACS_plot.Line_2_terminator_val_x_2 8.31 _LACS_plot.Line_2_terminator_val_y_2 2.45 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 LYS -6.85 1.04 0 10 ARG 0.99 -0.28 1 11 ARG 0.35 -0.28 1 12 ILE 0.55 -0.29 1 13 ARG -0.34 -0.45 1 14 ARG -0.28 0.35 1 16 PHE 0.03 1.44 1 17 SER -3.52 0.88 1 18 VAL 7.67 1.54 1 19 ALA 3.79 3.82 1 20 GLU 0.72 2.51 1 21 VAL 8.32 1.31 1 22 GLU 5.09 1.33 1 23 ALA 3.74 2.60 1 24 LEU 3.21 -0.40 1 25 VAL 6.67 0.91 1 26 GLN 3.87 2.74 1 27 ALA 1.82 1.30 1 28 VAL 5.48 3.18 1 29 GLU 4.79 2.08 1 30 LYS 1.59 1.31 1 31 LEU -1.37 -0.36 1 33 THR 0.28 -0.90 1 35 ARG 2.72 0.17 1 36 TRP 3.34 2.36 1 37 ARG 6.22 2.32 1 38 ASP 3.76 2.48 1 39 VAL 6.81 1.18 1 41 LEU 2.67 0.11 1 43 ALA -1.96 -1.38 1 44 PHE -2.41 1.47 1 45 GLU 4.96 0.78 1 46 ASP -0.07 -1.28 1 47 ALA -1.63 -1.24 1 48 ASP 3.42 0.30 1 49 HIS 3.49 0.17 1 50 ARG -2.13 -1.54 1 51 THR -3.68 1.57 1 52 TYR 5.18 0.20 1 53 VAL 4.39 0.54 1 54 ASP 2.97 3.27 1 55 LEU 4.60 -1.62 1 56 LYS 4.84 1.89 1 57 ASP 3.61 2.47 1 58 LYS 3.91 1.77 1 59 TRP 3.05 0.27 1 60 LYS 5.30 3.39 1 61 THR 5.33 2.52 1 62 LEU 3.69 0.09 1 63 VAL 6.77 0.63 1 64 HIS 3.89 3.42 1 65 THR 5.95 0.37 1 66 ALA 1.84 0.36 1 67 LYS 1.08 0.40 1 68 ILE -0.16 -1.19 1 69 SER 0.94 1.12 1 71 GLN 3.78 0.83 1 72 GLN -0.72 -0.29 1 73 ARG 2.42 -0.19 1 74 ARG -2.10 0.22 1 80 GLN 4.20 1.46 1 81 GLU 5.05 2.81 1 82 LEU 2.79 1.17 1 83 LEU 4.95 1.19 1 84 ASN 4.26 3.14 1 85 ARG 2.97 4.06 1 86 VAL 6.18 0.96 1 87 LEU 4.03 3.12 1 88 ASN 3.98 2.71 1 89 ALA 3.83 1.43 1 90 HIS 3.10 5.46 1 92 TYR 3.98 2.28 1 93 TRP 3.07 2.78 1 94 THR 5.17 1.36 1 95 GLN 3.80 1.80 1 96 GLN 2.91 1.74 1 97 GLN 2.53 1.42 1 98 MET 2.23 1.06 1 99 GLN 1.88 0.74 1 100 GLN 1.41 0.44 1 101 LEU 0.61 0.01 1 102 GLN 0.53 -0.21 1 103 GLN 0.05 -0.48 1 104 ASN 0.47 -1.17 1 105 VAL 1.56 4.59 1 stop_ save_