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 bmr4162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.85 _LACS_plot.Line_1_terminator_val_y_1 -3.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.68 _LACS_plot.Line_2_terminator_val_x_2 3.16 _LACS_plot.Line_2_terminator_val_y_2 2.26 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ARG 3.17 3.32 0 97 ILE -3.29 -3.95 0 10 SER 1.53 0.75 1 11 GLN -5.42 -1.07 1 13 GLU -3.12 -1.52 1 14 ILE -3.89 -1.25 1 15 SER -0.15 -0.61 1 16 VAL 3.10 2.13 1 18 GLU -2.00 -1.21 1 19 SER -4.81 -2.90 1 20 LYS -4.54 -0.65 1 21 PHE -6.66 -4.55 1 22 PHE -3.95 -1.32 1 23 LEU -3.78 -1.11 1 25 GLN -5.27 -2.01 1 26 VAL -3.41 -2.21 1 27 ALA -3.99 -1.77 1 29 ASP -0.83 -0.90 1 30 ALA -1.48 -0.58 1 31 LYS -0.06 0.11 1 32 ASP 0.18 -0.42 1 33 LYS -2.22 -1.48 1 34 ASP -4.47 -1.11 1 35 ILE -0.77 0.38 1 36 SER -4.02 -0.24 1 37 TRP -6.08 -2.00 1 38 PHE -5.28 -1.86 1 39 SER 0.27 -0.59 1 41 ASN 0.58 -0.90 1 43 GLU -2.04 -1.17 1 44 LYS 0.65 0.03 1 45 LEU -0.79 -0.90 1 46 SER -0.68 0.01 1 48 ASN 0.73 0.26 1 49 GLN -0.73 -0.85 1 50 GLN 1.27 1.36 1 52 ILE -0.95 -1.94 1 53 SER -2.86 -2.15 1 54 VAL -3.83 -2.08 1 55 VAL -5.22 -2.07 1 56 TRP 0.27 0.63 1 57 ASN -0.05 0.70 1 58 ASP 0.88 -0.14 1 59 ASP -0.30 0.35 1 60 ASP -0.14 -0.04 1 61 SER -2.93 -0.74 1 62 SER -3.51 -1.95 1 64 LEU -2.35 -2.12 1 66 ILE -1.79 -0.85 1 67 TYR -2.28 -1.54 1 68 ASN 1.35 -0.66 1 69 ALA -0.05 0.74 1 70 ASN -4.86 -2.10 1 71 ILE 3.06 2.65 1 72 ASP 2.45 1.17 1 73 ASP -0.36 0.39 1 74 ALA -1.66 0.27 1 76 ILE 0.35 -0.56 1 77 TYR -2.05 -1.06 1 78 LYS -5.97 -1.96 1 80 VAL -3.48 -1.39 1 81 VAL -4.17 -3.27 1 83 ALA -4.33 -1.80 1 84 GLU 2.81 2.02 1 85 ASP -0.56 -1.61 1 88 GLN -5.72 -1.62 1 89 SER -2.95 -1.24 1 90 GLU -7.85 -2.96 1 91 ALA -3.43 -1.78 1 93 VAL -4.78 -3.28 1 94 ASN -0.70 -1.05 1 95 VAL 0.68 0.16 1 96 LYS -3.61 -1.54 1 98 PHE -3.41 -1.85 1 99 GLN 0.11 1.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.85 _LACS_plot.Line_1_terminator_val_y_1 4.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 3.16 _LACS_plot.Line_2_terminator_val_y_2 -0.90 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ARG 3.17 0.15 0 97 ILE -3.29 -0.66 0 10 SER 1.53 -0.78 1 11 GLN -5.42 4.35 1 13 GLU -3.12 1.60 1 14 ILE -3.89 2.64 1 15 SER -0.15 -0.46 1 16 VAL 3.10 -0.97 1 18 GLU -2.00 0.79 1 19 SER -4.81 1.91 1 20 LYS -4.54 3.89 1 21 PHE -6.66 2.11 1 22 PHE -3.95 2.63 1 23 LEU -3.78 2.67 1 25 GLN -5.27 3.26 1 26 VAL -3.41 1.20 1 27 ALA -3.99 2.22 1 29 ASP -0.83 -0.07 1 30 ALA -1.48 0.90 1 31 LYS -0.06 0.17 1 32 ASP 0.18 -0.60 1 33 LYS -2.22 0.74 1 34 ASP -4.47 3.36 1 35 ILE -0.77 1.15 1 36 SER -4.02 3.78 1 37 TRP -6.08 4.08 1 38 PHE -5.28 3.42 1 39 SER 0.27 -0.86 1 41 ASN 0.58 -1.48 1 43 GLU -2.04 0.87 1 44 LYS 0.65 -0.62 1 45 LEU -0.79 -0.11 1 46 SER -0.68 0.69 1 48 ASN 0.73 -0.47 1 49 GLN -0.73 -0.12 1 50 GLN 1.27 0.09 1 52 ILE -0.95 -0.99 1 53 SER -2.86 0.71 1 54 VAL -3.83 1.75 1 55 VAL -5.22 3.15 1 56 TRP 0.27 0.36 1 57 ASN -0.05 0.75 1 58 ASP 0.88 -1.02 1 59 ASP -0.30 0.65 1 60 ASP -0.14 0.10 1 61 SER -2.93 2.19 1 62 SER -3.51 1.56 1 64 LEU -2.35 0.23 1 66 ILE -1.79 0.94 1 67 TYR -2.28 0.74 1 68 ASN 1.35 -2.01 1 69 ALA -0.05 0.79 1 70 ASN -4.86 2.76 1 71 ILE 3.06 -0.41 1 72 ASP 2.45 -1.28 1 73 ASP -0.36 0.75 1 74 ALA -1.66 1.93 1 76 ILE 0.35 -0.91 1 77 TYR -2.05 0.99 1 78 LYS -5.97 4.01 1 80 VAL -3.48 2.09 1 81 VAL -4.17 0.90 1 83 ALA -4.33 2.53 1 84 GLU 2.81 -0.79 1 85 ASP -0.56 -1.05 1 88 GLN -5.72 4.10 1 89 SER -2.95 1.71 1 90 GLU -7.85 4.89 1 91 ALA -3.43 1.65 1 93 VAL -4.78 1.50 1 94 ASN -0.70 -0.35 1 95 VAL 0.68 -0.52 1 96 LYS -3.61 2.07 1 98 PHE -3.41 1.56 1 99 GLN 0.11 1.36 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.85 _LACS_plot.Line_1_terminator_val_y_1 1.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 3.16 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ASN 1.35 -0.89 0 76 ILE 0.35 0.61 0 20 LYS -4.54 -0.19 0 10 SER 1.53 -0.15 1 11 GLN -5.42 0.36 1 13 GLU -3.12 0.87 1 14 ILE -3.89 0.13 1 15 SER -0.15 0.29 1 16 VAL 3.10 -0.71 1 18 GLU -2.00 0.16 1 19 SER -4.81 1.13 1 21 PHE -6.66 1.07 1 22 PHE -3.95 0.15 1 23 LEU -3.78 0.66 1 25 GLN -5.27 0.52 1 26 VAL -3.41 0.74 1 27 ALA -3.99 0.33 1 29 ASP -0.83 -0.04 1 30 ALA -1.48 -0.04 1 31 LYS -0.06 -0.08 1 32 ASP 0.18 -0.02 1 33 LYS -2.22 0.40 1 34 ASP -4.47 0.23 1 35 ILE -0.77 0.27 1 36 SER -4.02 0.56 1 37 TRP -6.08 1.04 1 38 PHE -5.28 0.70 1 39 SER 0.27 -0.38 1 41 ASN 0.58 -0.07 1 43 GLU -2.04 0.00 1 44 LYS 0.65 -0.57 1 45 LEU -0.79 0.05 1 46 SER -0.68 0.11 1 48 ASN 0.73 -0.07 1 49 GLN -0.73 0.09 1 50 GLN 1.27 -0.24 1 51 ARG 3.17 -0.38 1 52 ILE -0.95 0.67 1 53 SER -2.86 0.29 1 54 VAL -3.83 0.63 1 55 VAL -5.22 0.38 1 56 TRP 0.27 0.20 1 57 ASN -0.05 -0.04 1 58 ASP 0.88 -0.50 1 59 ASP -0.30 -0.06 1 60 ASP -0.14 -0.01 1 61 SER -2.93 0.90 1 62 SER -3.51 0.78 1 64 LEU -2.35 0.11 1 66 ILE -1.79 0.08 1 67 TYR -2.28 0.06 1 69 ALA -0.05 -0.46 1 70 ASN -4.86 0.20 1 71 ILE 3.06 -0.46 1 72 ASP 2.45 -0.03 1 73 ASP -0.36 -0.06 1 74 ALA -1.66 -0.29 1 77 TYR -2.05 0.14 1 78 LYS -5.97 0.86 1 80 VAL -3.48 0.40 1 81 VAL -4.17 1.04 1 83 ALA -4.33 0.44 1 84 GLU 2.81 -0.26 1 85 ASP -0.56 -0.11 1 88 GLN -5.72 1.32 1 89 SER -2.95 0.24 1 90 GLU -7.85 1.26 1 91 ALA -3.43 0.44 1 93 VAL -4.78 0.48 1 94 ASN -0.70 0.06 1 95 VAL 0.68 0.09 1 96 LYS -3.61 0.19 1 97 ILE -3.29 1.05 1 98 PHE -3.41 0.18 1 99 GLN 0.11 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.85 _LACS_plot.Line_1_terminator_val_y_1 -1.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _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 3.16 _LACS_plot.Line_2_terminator_val_y_2 1.13 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ARG 3.17 -0.80 0 20 LYS -4.54 -3.70 0 93 VAL -4.78 -3.80 0 10 SER 1.53 1.20 1 11 GLN -5.42 -0.50 1 13 GLU -3.12 -0.70 1 14 ILE -3.89 -0.70 1 15 SER -0.15 0.70 1 16 VAL 3.10 2.20 1 18 GLU -2.00 -2.00 1 19 SER -4.81 0.50 1 21 PHE -6.66 -1.40 1 22 PHE -3.95 -1.60 1 23 LEU -3.78 -1.90 1 25 GLN -5.27 -1.00 1 26 VAL -3.41 -0.90 1 27 ALA -3.99 -0.30 1 29 ASP -0.83 0.50 1 30 ALA -1.48 -0.10 1 31 LYS -0.06 0.60 1 32 ASP 0.18 -1.00 1 33 LYS -2.22 -1.10 1 34 ASP -4.47 -1.00 1 35 ILE -0.77 0.10 1 36 SER -4.02 -2.70 1 37 TRP -6.08 0.40 1 38 PHE -5.28 0.70 1 41 ASN 0.58 1.80 1 43 GLU -2.04 -0.30 1 44 LYS 0.65 1.40 1 45 LEU -0.79 -0.50 1 48 ASN 0.73 0.30 1 49 GLN -0.73 0.70 1 50 GLN 1.27 1.10 1 52 ILE -0.95 0.30 1 53 SER -2.86 -0.70 1 54 VAL -3.83 -0.40 1 55 VAL -5.22 -0.70 1 56 TRP 0.27 0.10 1 57 ASN -0.05 1.00 1 58 ASP 0.88 -0.30 1 59 ASP -0.30 0.80 1 60 ASP -0.14 -1.70 1 61 SER -2.93 -0.60 1 62 SER -3.51 0.50 1 64 LEU -2.35 -1.80 1 66 ILE -1.79 -1.20 1 67 TYR -2.28 -0.40 1 68 ASN 1.35 0.30 1 69 ALA -0.05 1.00 1 70 ASN -4.86 1.30 1 71 ILE 3.06 1.50 1 72 ASP 2.45 1.00 1 73 ASP -0.36 0.90 1 74 ALA -1.66 -0.50 1 76 ILE 0.35 0.80 1 77 TYR -2.05 0.20 1 78 LYS -5.97 -2.10 1 80 VAL -3.48 0.20 1 81 VAL -4.17 -1.20 1 83 ALA -4.33 1.70 1 84 GLU 2.81 0.50 1 85 ASP -0.56 1.50 1 88 GLN -5.72 0.80 1 89 SER -2.95 -2.10 1 90 GLU -7.85 -1.40 1 91 ALA -3.43 -1.70 1 94 ASN -0.70 -0.30 1 95 VAL 0.68 -0.10 1 96 LYS -3.61 -1.70 1 97 ILE -3.29 -0.20 1 98 PHE -3.41 -1.20 1 stop_ save_