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 bmr19942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 -2.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 7.01 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 THR 8.60 8.07 0 10 ILE -3.05 -2.01 1 11 SER -2.95 -1.00 1 13 ILE -0.44 -0.01 1 14 ASN 1.89 0.49 1 15 THR -0.62 -0.74 1 16 ASN -3.19 -0.71 1 17 ILE -5.25 -1.61 1 18 ASN -2.25 -1.81 1 19 THR 1.94 0.90 1 20 THR 2.64 2.76 1 22 SER -1.12 -0.15 1 23 LYS -5.07 -1.25 1 24 GLN 0.31 0.43 1 25 PHE -2.57 -1.34 1 26 PHE -4.69 -1.55 1 27 ALA -5.34 -2.55 1 28 VAL -2.39 -0.99 1 30 THR 0.75 0.58 1 31 TYR -1.96 0.11 1 32 SER 4.13 3.11 1 33 ASP -0.94 -1.52 1 35 THR -0.32 0.96 1 36 LYS -5.49 -1.67 1 37 ALA -5.56 -1.12 1 38 ASP 1.36 1.03 1 39 LEU -3.04 -1.51 1 41 SER 1.82 1.66 1 42 SER 0.52 1.44 1 43 VAL -0.63 -1.13 1 44 THR 0.56 0.67 1 45 TRP -2.67 -0.77 1 46 SER -2.10 -0.29 1 47 SER -7.08 -4.71 1 48 SER 3.29 2.12 1 49 ASN 1.29 0.47 1 50 GLN 2.25 1.76 1 51 SER 2.64 1.67 1 52 GLN 0.24 0.42 1 53 ALA -3.12 -0.12 1 54 LYS -5.45 -2.44 1 55 VAL -6.10 -4.13 1 56 SER -0.73 -0.90 1 57 ASN -2.34 0.29 1 58 ALA -0.08 -0.27 1 59 SER 4.89 4.20 1 60 GLU 2.41 2.12 1 61 THR -2.03 -2.61 1 62 LYS 1.73 1.92 1 64 LEU -0.21 0.46 1 65 VAL -0.98 -0.88 1 66 THR -1.96 -0.57 1 68 ILE 0.16 0.51 1 69 ALA -3.60 -0.64 1 70 SER 0.01 0.32 1 72 ASN -1.16 0.11 1 74 THR -0.76 0.05 1 75 ILE 2.62 0.69 1 76 ILE -2.68 -0.56 1 77 ALA -5.28 -2.71 1 78 THR -2.29 -0.46 1 79 TYR -2.16 -0.39 1 81 SER 0.67 0.36 1 82 VAL -1.12 -0.55 1 83 SER -4.61 -1.68 1 85 ASN -4.56 -0.31 1 86 THR -0.92 -0.08 1 87 ILE -0.48 0.14 1 88 LEU -4.60 -1.36 1 89 THR 0.59 0.99 1 90 VAL -0.55 -1.79 1 91 ASN -2.20 -0.32 1 92 LYS 0.07 0.27 1 93 THR 0.34 0.26 1 94 ASP 0.30 0.32 1 95 THR 0.64 1.42 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 4.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 THR 8.60 -0.53 0 10 ILE -3.05 1.04 1 11 SER -2.95 1.95 1 13 ILE -0.44 0.43 1 14 ASN 1.89 -1.40 1 15 THR -0.62 -0.12 1 16 ASN -3.19 2.48 1 17 ILE -5.25 3.64 1 18 ASN -2.25 0.44 1 19 THR 1.94 -1.04 1 20 THR 2.64 0.12 1 22 SER -1.12 0.97 1 23 LYS -5.07 3.82 1 24 GLN 0.31 0.12 1 25 PHE -2.57 1.23 1 26 PHE -4.69 3.14 1 27 ALA -5.34 2.79 1 28 VAL -2.39 1.40 1 30 THR 0.75 -0.17 1 31 TYR -1.96 2.07 1 32 SER 4.13 -1.02 1 33 ASP -0.94 -0.58 1 35 THR -0.32 1.28 1 36 LYS -5.49 3.82 1 37 ALA -5.56 4.44 1 38 ASP 1.36 -0.33 1 39 LEU -3.04 1.53 1 41 SER 1.82 -0.16 1 42 SER 0.52 0.92 1 43 VAL -0.63 -0.50 1 44 THR 0.56 0.11 1 45 TRP -2.67 1.90 1 46 SER -2.10 1.81 1 47 SER -7.08 2.37 1 48 SER 3.29 -1.17 1 49 ASN 1.29 -0.82 1 50 GLN 2.25 -0.49 1 51 SER 2.64 -0.97 1 52 GLN 0.24 0.18 1 53 ALA -3.12 3.00 1 54 LYS -5.45 3.01 1 55 VAL -6.10 1.97 1 56 SER -0.73 -0.17 1 57 ASN -2.34 2.63 1 58 ALA -0.08 -0.19 1 59 SER 4.89 -0.69 1 60 GLU 2.41 -0.29 1 61 THR -2.03 -0.58 1 62 LYS 1.73 0.19 1 64 LEU -0.21 0.67 1 65 VAL -0.98 0.10 1 66 THR -1.96 1.39 1 68 ILE 0.16 0.35 1 69 ALA -3.60 2.96 1 70 SER 0.01 0.31 1 72 ASN -1.16 1.27 1 74 THR -0.76 0.81 1 75 ILE 2.62 -1.93 1 76 ILE -2.68 2.12 1 77 ALA -5.28 2.57 1 78 THR -2.29 1.83 1 79 TYR -2.16 1.77 1 81 SER 0.67 -0.31 1 82 VAL -1.12 0.57 1 83 SER -4.61 2.93 1 85 ASN -4.56 4.25 1 86 THR -0.92 0.84 1 87 ILE -0.48 0.62 1 88 LEU -4.60 3.24 1 89 THR 0.59 0.40 1 90 VAL -0.55 -1.24 1 91 ASN -2.20 1.88 1 92 LYS 0.07 0.20 1 93 THR 0.34 -0.08 1 94 ASP 0.30 0.02 1 95 THR 0.64 0.78 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.34 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _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 40 THR 8.60 0.18 0 10 ILE -3.05 1.31 1 11 SER -2.95 -0.08 1 13 ILE -0.44 0.18 1 14 ASN 1.89 0.04 1 15 THR -0.62 0.24 1 16 ASN -3.19 1.07 1 17 ILE -5.25 0.55 1 18 ASN -2.25 0.80 1 20 THR 2.64 -0.07 1 22 SER -1.12 1.07 1 23 LYS -5.07 0.19 1 24 GLN 0.31 -0.66 1 25 PHE -2.57 0.38 1 26 PHE -4.69 0.91 1 27 ALA -5.34 0.89 1 28 VAL -2.39 0.55 1 30 THR 0.75 0.68 1 31 TYR -1.96 0.47 1 32 SER 4.13 -0.36 1 33 ASP -0.94 0.09 1 35 THR -0.32 -0.05 1 36 LYS -5.49 1.61 1 37 ALA -5.56 0.35 1 38 ASP 1.36 0.22 1 39 LEU -3.04 0.52 1 41 SER 1.82 -0.01 1 42 SER 0.52 0.24 1 43 VAL -0.63 0.19 1 44 THR 0.56 0.16 1 45 TRP -2.67 0.72 1 46 SER -2.10 0.15 1 47 SER -7.08 1.06 1 48 SER 3.29 -0.18 1 49 ASN 1.29 -0.01 1 50 GLN 2.25 0.20 1 51 SER 2.64 -0.17 1 52 GLN 0.24 0.22 1 53 ALA -3.12 0.59 1 54 LYS -5.45 0.59 1 55 VAL -6.10 0.81 1 56 SER -0.73 -0.11 1 57 ASN -2.34 0.52 1 58 ALA -0.08 0.02 1 59 SER 4.89 0.42 1 60 GLU 2.41 -0.12 1 61 THR -2.03 0.47 1 62 LYS 1.73 -0.63 1 64 LEU -0.21 -0.28 1 65 VAL -0.98 0.52 1 66 THR -1.96 0.42 1 68 ILE 0.16 -0.05 1 69 ALA -3.60 0.07 1 70 SER 0.01 -0.46 1 72 ASN -1.16 -0.16 1 74 THR -0.76 0.05 1 75 ILE 2.62 0.71 1 76 ILE -2.68 0.50 1 77 ALA -5.28 0.18 1 78 THR -2.29 0.50 1 79 TYR -2.16 0.08 1 81 SER 0.67 -0.12 1 82 VAL -1.12 0.13 1 83 SER -4.61 1.04 1 85 ASN -4.56 1.16 1 86 THR -0.92 0.33 1 87 ILE -0.48 0.37 1 88 LEU -4.60 0.34 1 89 THR 0.59 0.40 1 90 VAL -0.55 0.72 1 91 ASN -2.20 0.10 1 92 LYS 0.07 0.10 1 93 THR 0.34 -0.03 1 94 ASP 0.30 0.03 1 95 THR 0.64 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19942_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 -2.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 1.47 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 SER -7.08 1.54 0 95 THR 0.64 4.53 0 40 THR 8.60 -0.14 0 10 ILE -3.05 -1.14 1 11 SER -2.95 -2.81 1 13 ILE -0.44 0.13 1 14 ASN 1.89 0.09 1 15 THR -0.62 -1.36 1 16 ASN -3.19 -1.20 1 17 ILE -5.25 -2.84 1 18 ASN -2.25 1.41 1 19 THR 1.94 1.04 1 20 THR 2.64 -1.07 1 22 SER -1.12 -1.45 1 23 LYS -5.07 -2.75 1 24 GLN 0.31 -2.77 1 25 PHE -2.57 -1.53 1 26 PHE -4.69 -0.12 1 27 ALA -5.34 -2.83 1 28 VAL -2.39 1.07 1 30 THR 0.75 -0.85 1 31 TYR -1.96 3.54 1 32 SER 4.13 -0.42 1 33 ASP -0.94 0.80 1 35 THR -0.32 -1.63 1 36 LYS -5.49 0.25 1 37 ALA -5.56 -2.24 1 38 ASP 1.36 0.19 1 39 LEU -3.04 -0.04 1 41 SER 1.82 0.09 1 42 SER 0.52 0.64 1 43 VAL -0.63 -1.80 1 44 THR 0.56 0.41 1 45 TRP -2.67 0.46 1 46 SER -2.10 -3.27 1 48 SER 3.29 0.17 1 49 ASN 1.29 0.64 1 50 GLN 2.25 -0.06 1 51 SER 2.64 -1.08 1 52 GLN 0.24 0.70 1 53 ALA -3.12 -3.58 1 54 LYS -5.45 -2.71 1 55 VAL -6.10 -3.53 1 56 SER -0.73 0.03 1 57 ASN -2.34 -0.75 1 58 ALA -0.08 0.83 1 59 SER 4.89 2.13 1 60 GLU 2.41 0.87 1 61 THR -2.03 -1.63 1 62 LYS 1.73 1.62 1 64 LEU -0.21 -0.93 1 65 VAL -0.98 -1.34 1 66 THR -1.96 -0.43 1 68 ILE 0.16 -1.38 1 69 ALA -3.60 -3.69 1 70 SER 0.01 -0.42 1 72 ASN -1.16 -2.49 1 74 THR -0.76 -1.23 1 76 ILE -2.68 -2.53 1 77 ALA -5.28 -1.94 1 78 THR -2.29 -1.49 1 79 TYR -2.16 -0.98 1 81 SER 0.67 -1.32 1 82 VAL -1.12 -2.84 1 83 SER -4.61 -0.76 1 85 ASN -4.56 -0.65 1 86 THR -0.92 -3.81 1 87 ILE -0.48 -0.90 1 88 LEU -4.60 -2.62 1 89 THR 0.59 -1.43 1 90 VAL -0.55 0.16 1 91 ASN -2.20 -0.89 1 92 LYS 0.07 0.16 1 93 THR 0.34 -0.68 1 94 ASP 0.30 -0.84 1 stop_ save_