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 bmr11505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -2.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.22 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 5.73 _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 68 HIS -2.70 1.30 0 23 ILE 5.83 1.57 0 11 LYS -0.39 0.10 1 12 THR 0.88 0.74 1 13 ILE -2.96 -1.05 1 14 THR 0.34 0.26 1 15 LEU -6.86 -2.03 1 16 GLU -1.50 -1.54 1 17 VAL -7.28 -3.58 1 18 GLU -3.13 -1.37 1 20 SER -0.44 -0.74 1 21 ASP 1.66 1.59 1 22 THR -3.42 -2.00 1 24 GLU 4.61 3.89 1 25 ASN 3.34 3.09 1 26 VAL 7.48 5.52 1 27 LYS 5.44 4.71 1 28 ALA 4.23 3.01 1 29 LYS 3.33 3.58 1 30 ILE 5.64 4.71 1 31 GLN 5.59 4.23 1 32 ASP 2.98 3.15 1 33 LYS 1.25 2.15 1 34 GLU -4.60 -1.33 1 36 ILE -1.61 -0.26 1 39 ASP 2.03 1.07 1 40 GLN -0.33 0.18 1 41 ASN -4.12 -0.31 1 42 ARG -3.43 -1.53 1 43 LEU -5.15 -1.66 1 44 ILE -4.67 -2.37 1 45 PHE -5.37 -1.31 1 46 ALA 2.68 0.08 1 48 LYS -2.41 -1.19 1 49 GLN 0.84 0.53 1 50 LEU -0.34 -1.02 1 51 GLU -2.02 -0.37 1 52 ASP 2.88 2.81 1 54 ARG -3.11 -1.41 1 55 THR -4.59 -1.96 1 56 LEU 5.53 3.68 1 57 SER 3.97 2.87 1 58 ASP 4.01 3.29 1 59 TYR -0.80 0.41 1 60 ASN 2.45 1.06 1 61 ILE 3.37 1.34 1 62 GLN -4.18 -1.98 1 63 LYS 1.98 1.60 1 64 GLU 5.64 1.81 1 65 SER 1.40 2.62 1 66 THR 0.45 0.81 1 67 LEU -3.29 -1.09 1 69 LEU -2.76 -0.81 1 70 VAL -4.37 -2.03 1 71 LEU -0.43 0.17 1 72 ARG -0.16 0.16 1 73 LEU -0.22 -0.10 1 74 ARG 0.70 0.55 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 4.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.78 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 -1.74 _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 68 HIS -2.70 4.00 0 23 ILE 5.83 -4.26 0 11 LYS -0.39 0.49 1 12 THR 0.88 -0.14 1 13 ILE -2.96 1.91 1 14 THR 0.34 -0.08 1 15 LEU -6.86 4.83 1 16 GLU -1.50 -0.04 1 17 VAL -7.28 3.70 1 18 GLU -3.13 1.76 1 20 SER -0.44 -0.30 1 21 ASP 1.66 -0.07 1 22 THR -3.42 1.42 1 24 GLU 4.61 -0.72 1 25 ASN 3.34 -0.25 1 26 VAL 7.48 -1.96 1 27 LYS 5.44 -0.73 1 28 ALA 4.23 -1.22 1 29 LYS 3.33 0.25 1 30 ILE 5.64 -0.93 1 31 GLN 5.59 -1.36 1 32 ASP 2.98 0.17 1 33 LYS 1.25 0.90 1 34 GLU -4.60 3.27 1 36 ILE -1.61 1.35 1 39 ASP 2.03 -0.96 1 40 GLN -0.33 0.51 1 41 ASN -4.12 3.81 1 42 ARG -3.43 1.90 1 43 LEU -5.15 3.49 1 44 ILE -4.67 2.30 1 45 PHE -5.37 4.06 1 46 ALA 2.68 -2.60 1 48 LYS -2.41 1.22 1 49 GLN 0.84 -0.31 1 50 LEU -0.34 -0.68 1 51 GLU -2.02 1.65 1 52 ASP 2.88 -0.07 1 54 ARG -3.11 1.70 1 55 THR -4.59 2.63 1 56 LEU 5.53 -1.85 1 57 SER 3.97 -1.10 1 58 ASP 4.01 -0.72 1 59 TYR -0.80 1.21 1 60 ASN 2.45 -1.39 1 61 ILE 3.37 -2.03 1 62 GLN -4.18 2.20 1 63 LYS 1.98 -0.38 1 64 GLU 5.64 -3.83 1 65 SER 1.40 1.22 1 66 THR 0.45 0.36 1 67 LEU -3.29 2.20 1 69 LEU -2.76 1.95 1 70 VAL -4.37 2.34 1 71 LEU -0.43 0.60 1 72 ARG -0.16 0.32 1 73 LEU -0.22 0.12 1 74 ARG 0.70 -0.15 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 0.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 -0.75 _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 66 THR 0.45 0.94 0 11 LYS -0.39 0.03 1 12 THR 0.88 0.66 1 13 ILE -2.96 0.36 1 14 THR 0.34 0.63 1 15 LEU -6.86 0.41 1 16 GLU -1.50 0.53 1 17 VAL -7.28 0.56 1 18 GLU -3.13 0.44 1 20 SER -0.44 -0.12 1 21 ASP 1.66 0.05 1 22 THR -3.42 0.55 1 23 ILE 5.83 -0.55 1 24 GLU 4.61 -0.46 1 25 ASN 3.34 -0.20 1 26 VAL 7.48 -0.72 1 27 LYS 5.44 -0.52 1 28 ALA 4.23 -0.12 1 29 LYS 3.33 -0.13 1 30 ILE 5.64 -0.67 1 31 GLN 5.59 -0.44 1 32 ASP 2.98 -0.29 1 33 LYS 1.25 -0.04 1 34 GLU -4.60 0.26 1 36 ILE -1.61 -0.09 1 39 ASP 2.03 -0.16 1 40 GLN -0.33 0.07 1 41 ASN -4.12 0.43 1 42 ARG -3.43 0.18 1 43 LEU -5.15 0.96 1 44 ILE -4.67 0.80 1 45 PHE -5.37 0.58 1 46 ALA 2.68 -0.62 1 48 LYS -2.41 0.26 1 49 GLN 0.84 0.08 1 50 LEU -0.34 -0.22 1 51 GLU -2.02 0.10 1 52 ASP 2.88 -0.26 1 54 ARG -3.11 0.34 1 55 THR -4.59 0.87 1 56 LEU 5.53 -0.29 1 57 SER 3.97 -0.22 1 58 ASP 4.01 -0.37 1 59 TYR -0.80 0.10 1 60 ASN 2.45 -0.40 1 61 ILE 3.37 -0.79 1 62 GLN -4.18 0.13 1 63 LYS 1.98 -0.33 1 64 GLU 5.64 -1.01 1 65 SER 1.40 0.17 1 67 LEU -3.29 0.80 1 68 HIS -2.70 0.38 1 69 LEU -2.76 0.79 1 70 VAL -4.37 0.44 1 71 LEU -0.43 0.31 1 72 ARG -0.16 -0.12 1 73 LEU -0.22 0.04 1 74 ARG 0.70 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -2.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.65 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 2.26 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 THR -4.59 1.78 0 64 GLU 5.64 -1.37 0 11 LYS -0.39 -0.78 1 12 THR 0.88 -0.33 1 13 ILE -2.96 -1.17 1 14 THR 0.34 -0.98 1 15 LEU -6.86 -3.13 1 16 GLU -1.50 -0.70 1 17 VAL -7.28 -2.23 1 18 GLU -3.13 1.38 1 20 SER -0.44 -0.05 1 21 ASP 1.66 0.09 1 22 THR -3.42 1.88 1 23 ILE 5.83 2.70 1 24 GLU 4.61 2.29 1 25 ASN 3.34 3.13 1 26 VAL 7.48 1.95 1 27 LYS 5.44 3.05 1 28 ALA 4.23 2.19 1 29 LYS 3.33 3.55 1 30 ILE 5.64 1.29 1 31 GLN 5.59 2.66 1 32 ASP 2.98 1.12 1 33 LYS 1.25 1.20 1 34 GLU -4.60 0.89 1 36 ILE -1.61 -1.32 1 39 ASP 2.03 0.62 1 40 GLN -0.33 -1.03 1 41 ASN -4.12 -1.10 1 42 ARG -3.43 -2.59 1 43 LEU -5.15 -2.24 1 44 ILE -4.67 -0.64 1 45 PHE -5.37 -1.08 1 46 ALA 2.68 -0.43 1 48 LYS -2.41 -1.78 1 49 GLN 0.84 -0.62 1 50 LEU -0.34 -0.80 1 51 GLU -2.02 -0.48 1 52 ASP 2.88 1.11 1 54 ARG -3.11 -1.13 1 56 LEU 5.53 3.26 1 57 SER 3.97 3.78 1 58 ASP 4.01 1.13 1 59 TYR -0.80 -1.26 1 60 ASN 2.45 -0.87 1 61 ILE 3.37 -1.71 1 62 GLN -4.18 0.06 1 63 LYS 1.98 -1.00 1 65 SER 1.40 -2.60 1 66 THR 0.45 -1.16 1 67 LEU -3.29 -2.42 1 68 HIS -2.70 -0.17 1 69 LEU -2.76 -1.41 1 70 VAL -4.37 -1.74 1 71 LEU -0.43 0.43 1 72 ARG -0.16 -0.85 1 73 LEU -0.22 -0.19 1 74 ARG 0.70 0.54 1 stop_ save_