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 bmr4973_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.53 _LACS_plot.Line_1_terminator_val_y_1 -2.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.34 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 5.10 _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 51 LYS 5.44 0.26 0 10 TYR -2.29 0.82 1 11 ALA -3.96 -0.82 1 12 ASN 0.57 0.63 1 13 ARG -6.40 -1.18 1 14 LYS -5.00 -3.29 1 15 TYR -5.14 -3.01 1 16 THR 3.74 1.97 1 17 ASP -2.64 -2.38 1 18 PHE 2.56 2.25 1 19 ASP 3.16 2.88 1 20 LYS 2.42 2.38 1 21 SER -0.51 1.10 1 22 PHE -3.40 -1.85 1 23 LYS -3.31 -1.17 1 24 LYS -5.73 -2.06 1 25 SER -2.25 -1.63 1 26 SER -0.18 0.01 1 27 ASP -3.69 -1.02 1 28 LEU 3.59 2.66 1 29 ASP 3.59 3.42 1 30 GLU 3.53 2.53 1 32 LYS 4.37 4.22 1 33 LYS 4.13 3.54 1 34 THR 6.69 4.70 1 36 PHE 2.77 2.79 1 37 LYS -1.09 -1.24 1 38 THR 0.63 1.15 1 39 GLU 2.87 1.98 1 40 TYR 3.83 2.46 1 42 TYR 0.73 0.89 1 43 ILE -3.65 -0.54 1 44 VAL -4.90 -2.12 1 45 PHE -5.89 -1.72 1 46 GLU -4.25 -1.64 1 47 ASP -2.36 -2.31 1 48 THR 3.08 2.18 1 49 VAL 3.03 2.53 1 50 ASN 0.23 0.29 1 52 GLU -6.52 -2.60 1 54 TYR -7.05 -2.19 1 55 TYR -5.35 -3.55 1 56 ASN 2.85 3.02 1 57 VAL -1.52 -2.46 1 58 VAL -6.11 -4.64 1 59 ASP -0.84 0.08 1 61 GLU 2.10 1.43 1 62 GLU -0.04 -0.27 1 63 LEU 0.67 -0.69 1 64 ASP -2.10 -1.29 1 65 GLN 4.02 3.09 1 66 GLU 1.60 0.82 1 67 LYS 1.47 0.33 1 68 PHE -0.18 -0.49 1 69 VAL -6.04 -3.48 1 70 VAL 2.78 1.84 1 71 ASP -1.88 0.90 1 72 GLU 2.64 2.19 1 73 ASN 0.24 0.63 1 74 PHE -7.53 -1.72 1 75 THR -2.50 -1.10 1 76 GLU -3.12 -0.62 1 77 ASN -5.22 -1.01 1 78 TYR -5.08 -2.19 1 79 LEU -0.09 -0.14 1 80 THR -4.04 -1.99 1 81 ASP 0.57 0.62 1 83 GLU -0.01 0.20 1 85 LYS 0.39 0.13 1 86 ASP -0.14 0.01 1 87 ALA 0.08 0.27 1 89 ASN -0.29 -0.12 1 90 ALA -0.01 0.07 1 91 ALA -0.12 0.07 1 93 THR -0.17 -0.08 1 95 ASP -0.25 0.01 1 96 GLU -0.03 0.07 1 97 SER -0.25 -0.06 1 98 ASP -0.04 0.01 1 99 GLU -0.77 -0.34 1 100 VAL -0.64 -0.48 1 101 ASP -0.21 -0.06 1 102 GLU -1.52 -0.55 1 103 ASP 1.46 1.72 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4973_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.53 _LACS_plot.Line_1_terminator_val_y_1 4.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.66 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _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 51 LYS 5.44 -5.18 0 10 TYR -2.29 3.11 1 11 ALA -3.96 3.14 1 12 ASN 0.57 0.06 1 13 ARG -6.40 5.22 1 14 LYS -5.00 1.71 1 15 TYR -5.14 2.13 1 16 THR 3.74 -1.77 1 17 ASP -2.64 0.26 1 18 PHE 2.56 -0.31 1 19 ASP 3.16 -0.28 1 20 LYS 2.42 -0.04 1 21 SER -0.51 1.61 1 22 PHE -3.40 1.55 1 23 LYS -3.31 2.14 1 24 LYS -5.73 3.67 1 25 SER -2.25 0.62 1 26 SER -0.18 0.19 1 27 ASP -3.69 2.67 1 28 LEU 3.59 -0.93 1 29 ASP 3.59 -0.17 1 30 GLU 3.53 -1.00 1 32 LYS 4.37 -0.15 1 33 LYS 4.13 -0.59 1 34 THR 6.69 -1.99 1 36 PHE 2.77 0.02 1 37 LYS -1.09 -0.15 1 38 THR 0.63 0.52 1 39 GLU 2.87 -0.89 1 40 TYR 3.83 -1.37 1 42 TYR 0.73 0.16 1 43 ILE -3.65 3.11 1 44 VAL -4.90 2.78 1 45 PHE -5.89 4.17 1 46 GLU -4.25 2.61 1 47 ASP -2.36 0.05 1 48 THR 3.08 -0.90 1 49 VAL 3.03 -0.50 1 50 ASN 0.23 0.06 1 52 GLU -6.52 3.92 1 54 TYR -7.05 4.86 1 55 TYR -5.35 1.80 1 56 ASN 2.85 0.17 1 57 VAL -1.52 -0.94 1 58 VAL -6.11 1.47 1 59 ASP -0.84 0.92 1 61 GLU 2.10 -0.67 1 62 GLU -0.04 -0.23 1 63 LEU 0.67 -1.36 1 64 ASP -2.10 0.81 1 65 GLN 4.02 -0.93 1 66 GLU 1.60 -0.78 1 67 LYS 1.47 -1.14 1 68 PHE -0.18 -0.31 1 69 VAL -6.04 2.56 1 70 VAL 2.78 -0.94 1 71 ASP -1.88 2.78 1 72 GLU 2.64 -0.45 1 73 ASN 0.24 0.39 1 74 PHE -7.53 5.81 1 75 THR -2.50 1.40 1 76 GLU -3.12 2.50 1 77 ASN -5.22 4.21 1 78 TYR -5.08 2.89 1 79 LEU -0.09 -0.05 1 80 THR -4.04 2.05 1 81 ASP 0.57 0.05 1 83 GLU -0.01 0.21 1 85 LYS 0.39 -0.26 1 86 ASP -0.14 0.15 1 87 ALA 0.08 0.19 1 89 ASN -0.29 0.17 1 90 ALA -0.01 0.08 1 91 ALA -0.12 0.19 1 93 THR -0.17 0.09 1 95 ASP -0.25 0.26 1 96 GLU -0.03 0.10 1 97 SER -0.25 0.19 1 98 ASP -0.04 0.05 1 99 GLU -0.77 0.43 1 100 VAL -0.64 0.16 1 101 ASP -0.21 0.15 1 102 GLU -1.52 0.97 1 103 ASP 1.46 0.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4973_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.53 _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 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 -0.49 _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 47 ASP -2.36 -1.04 0 55 TYR -5.35 2.01 0 10 TYR -2.29 -0.05 1 11 ALA -3.96 -0.19 1 12 ASN 0.57 1.12 1 13 ARG -6.40 0.87 1 14 LYS -5.00 -0.17 1 15 TYR -5.14 0.15 1 16 THR 3.74 -1.00 1 17 ASP -2.64 0.35 1 18 PHE 2.56 -0.26 1 19 ASP 3.16 -0.21 1 20 LYS 2.42 -0.02 1 21 SER -0.51 0.09 1 22 PHE -3.40 0.67 1 23 LYS -3.31 0.19 1 24 LYS -5.73 1.02 1 25 SER -2.25 0.19 1 26 SER -0.18 0.37 1 27 ASP -3.69 0.11 1 28 LEU 3.59 0.01 1 29 ASP 3.59 -0.28 1 30 GLU 3.53 -0.33 1 32 LYS 4.37 -0.95 1 33 LYS 4.13 -0.44 1 34 THR 6.69 -0.56 1 36 PHE 2.77 -0.30 1 37 LYS -1.09 0.05 1 38 THR 0.63 -0.04 1 39 GLU 2.87 -0.67 1 40 TYR 3.83 -0.34 1 42 TYR 0.73 0.37 1 43 ILE -3.65 0.85 1 44 VAL -4.90 1.27 1 45 PHE -5.89 1.65 1 46 GLU -4.25 0.41 1 48 THR 3.08 -0.35 1 49 VAL 3.03 -0.24 1 50 ASN 0.23 -0.22 1 51 LYS 5.44 -0.44 1 52 GLU -6.52 0.39 1 54 TYR -7.05 1.21 1 56 ASN 2.85 -0.91 1 57 VAL -1.52 0.66 1 58 VAL -6.11 0.30 1 59 ASP -0.84 -0.53 1 61 GLU 2.10 -0.18 1 62 GLU -0.04 -0.07 1 63 LEU 0.67 0.03 1 64 ASP -2.10 0.23 1 65 GLN 4.02 -0.05 1 66 GLU 1.60 -0.05 1 67 LYS 1.47 -0.39 1 68 PHE -0.18 0.52 1 69 VAL -6.04 0.52 1 70 VAL 2.78 0.02 1 71 ASP -1.88 -0.14 1 72 GLU 2.64 -0.21 1 73 ASN 0.24 -0.02 1 74 PHE -7.53 1.59 1 75 THR -2.50 0.78 1 76 GLU -3.12 0.01 1 77 ASN -5.22 1.07 1 78 TYR -5.08 1.24 1 79 LEU -0.09 -0.97 1 80 THR -4.04 0.23 1 81 ASP 0.57 -0.11 1 83 GLU -0.01 -0.12 1 85 LYS 0.39 0.00 1 86 ASP -0.14 0.00 1 87 ALA 0.08 0.01 1 89 ASN -0.29 -0.01 1 90 ALA -0.01 -0.01 1 91 ALA -0.12 -0.06 1 93 THR -0.17 0.06 1 95 ASP -0.25 0.02 1 96 GLU -0.03 0.02 1 97 SER -0.25 0.00 1 98 ASP -0.04 0.02 1 99 GLU -0.77 -0.04 1 100 VAL -0.64 0.06 1 101 ASP -0.21 0.02 1 103 ASP 1.46 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4973_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.53 _LACS_plot.Line_1_terminator_val_y_1 -1.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.47 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 1.66 _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 74 PHE -7.53 1.52 0 42 TYR 0.73 -4.79 0 10 TYR -2.29 -1.80 1 11 ALA -3.96 -2.67 1 12 ASN 0.57 -0.63 1 13 ARG -6.40 -3.79 1 15 TYR -5.14 0.77 1 16 THR 3.74 -0.61 1 17 ASP -2.64 -0.47 1 18 PHE 2.56 2.22 1 19 ASP 3.16 1.76 1 20 LYS 2.42 2.50 1 21 SER -0.51 -2.54 1 22 PHE -3.40 -0.42 1 23 LYS -3.31 -2.76 1 24 LYS -5.73 0.73 1 25 SER -2.25 -0.99 1 26 SER -0.18 -1.59 1 27 ASP -3.69 -0.78 1 28 LEU 3.59 0.79 1 29 ASP 3.59 2.19 1 30 GLU 3.53 1.38 1 32 LYS 4.37 4.12 1 33 LYS 4.13 3.82 1 34 THR 6.69 3.57 1 36 PHE 2.77 -0.18 1 37 LYS -1.09 -0.58 1 38 THR 0.63 -1.01 1 39 GLU 2.87 -0.15 1 40 TYR 3.83 0.62 1 43 ILE -3.65 -1.13 1 44 VAL -4.90 1.22 1 45 PHE -5.89 0.54 1 46 GLU -4.25 -2.13 1 47 ASP -2.36 1.78 1 48 THR 3.08 1.00 1 49 VAL 3.03 1.14 1 50 ASN 0.23 -0.94 1 51 LYS 5.44 -1.49 1 52 GLU -6.52 -2.47 1 54 TYR -7.05 -0.31 1 55 TYR -5.35 -1.07 1 56 ASN 2.85 -1.51 1 57 VAL -1.52 -0.51 1 58 VAL -6.11 -2.81 1 59 ASP -0.84 1.75 1 61 GLU 2.10 1.50 1 62 GLU -0.04 1.17 1 63 LEU 0.67 -1.60 1 64 ASP -2.10 2.21 1 65 GLN 4.02 2.67 1 66 GLU 1.60 1.07 1 67 LYS 1.47 -2.19 1 68 PHE -0.18 0.04 1 69 VAL -6.04 -1.44 1 70 VAL 2.78 0.33 1 71 ASP -1.88 -0.24 1 72 GLU 2.64 0.00 1 73 ASN 0.24 -0.64 1 75 THR -2.50 -2.83 1 76 GLU -3.12 -1.92 1 77 ASN -5.22 -2.12 1 78 TYR -5.08 0.32 1 79 LEU -0.09 -0.79 1 80 THR -4.04 -1.83 1 81 ASP 0.57 1.49 1 83 GLU -0.01 0.63 1 85 LYS 0.39 0.05 1 86 ASP -0.14 -0.12 1 95 ASP -0.25 -0.48 1 96 GLU -0.03 0.23 1 97 SER -0.25 -0.04 1 98 ASP -0.04 -0.22 1 99 GLU -0.77 -0.06 1 100 VAL -0.64 -0.40 1 101 ASP -0.21 -0.21 1 stop_ save_