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 bmr5563_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.18 _LACS_plot.Line_1_terminator_val_y_1 -2.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.58 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 6.12 _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 41 PHE -6.18 -1.80 0 10 VAL 0.33 0.20 1 11 LYS 0.01 0.06 1 12 LYS 0.01 0.10 1 13 MET -0.11 0.01 1 14 THR -0.46 -0.26 1 15 PHE -0.03 0.32 1 17 GLU -0.29 0.04 1 18 ASN 0.46 0.25 1 19 ARG 0.88 0.48 1 20 ASP 0.79 0.56 1 21 LEU 0.54 0.36 1 22 GLU -0.10 0.09 1 23 ARG 0.27 0.06 1 24 VAL 0.49 0.25 1 25 VAL 0.42 0.16 1 26 THR -0.35 -0.32 1 27 ALA 0.00 0.00 1 29 VAL 0.31 0.20 1 30 SER -0.52 -0.32 1 31 SER 0.02 0.46 1 33 LYS -0.05 -0.07 1 34 ILE -2.24 -1.48 1 35 LYS -3.58 -2.43 1 36 ARG 1.23 0.45 1 37 VAL -2.52 -0.98 1 38 ASN -1.11 0.55 1 39 VAL -2.66 -1.00 1 40 ASN -0.87 -0.73 1 42 ASP -0.60 0.81 1 43 GLU 4.11 4.40 1 44 GLU 4.31 3.18 1 45 LYS 4.44 3.49 1 46 HIS 5.40 6.50 1 47 THR 6.22 5.21 1 48 ARG 2.79 3.37 1 49 PHE 0.59 -0.02 1 50 LYS 4.85 4.10 1 51 ALA 3.69 2.66 1 52 ALA 2.25 2.69 1 54 ALA 4.28 2.76 1 55 ARG 3.70 3.47 1 56 LYS -0.61 -0.78 1 58 THR -4.43 -3.97 1 59 SER -6.05 -2.51 1 60 ILE 5.84 4.61 1 61 THR 6.01 5.32 1 62 ASP 4.78 3.65 1 63 VAL 6.06 4.80 1 64 VAL 7.81 5.87 1 65 ASN 5.30 6.08 1 66 GLN 4.47 3.69 1 67 LEU 3.34 2.59 1 68 VAL 6.26 4.61 1 69 ASP 5.22 3.95 1 70 ASN 3.87 3.17 1 71 TRP 4.82 5.08 1 72 LEU 3.98 3.13 1 73 LYS 4.03 3.15 1 74 GLU -1.00 0.27 1 75 ASN -0.28 1.11 1 76 GLU 2.69 3.31 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5563_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.18 _LACS_plot.Line_1_terminator_val_y_1 3.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.42 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 -1.68 _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 41 PHE -6.18 4.38 0 10 VAL 0.33 -0.13 1 11 LYS 0.01 0.05 1 12 LYS 0.01 0.09 1 13 MET -0.11 0.12 1 14 THR -0.46 0.20 1 15 PHE -0.03 0.35 1 17 GLU -0.29 0.33 1 18 ASN 0.46 -0.21 1 19 ARG 0.88 -0.40 1 20 ASP 0.79 -0.23 1 21 LEU 0.54 -0.18 1 22 GLU -0.10 0.19 1 23 ARG 0.27 -0.21 1 24 VAL 0.49 -0.24 1 25 VAL 0.42 -0.26 1 26 THR -0.35 0.03 1 27 ALA 0.00 0.00 1 29 VAL 0.31 -0.11 1 30 SER -0.52 0.20 1 31 SER 0.02 0.44 1 33 LYS -0.05 -0.02 1 34 ILE -2.24 0.76 1 35 LYS -3.58 1.15 1 36 ARG 1.23 -0.78 1 37 VAL -2.52 1.54 1 38 ASN -1.11 1.66 1 39 VAL -2.66 1.66 1 40 ASN -0.87 0.14 1 42 ASP -0.60 1.41 1 43 GLU 4.11 0.29 1 44 GLU 4.31 -1.13 1 45 LYS 4.44 -0.95 1 46 HIS 5.40 1.10 1 47 THR 6.22 -1.01 1 48 ARG 2.79 0.58 1 49 PHE 0.59 -0.61 1 50 LYS 4.85 -0.75 1 51 ALA 3.69 -1.03 1 52 ALA 2.25 0.44 1 54 ALA 4.28 -1.52 1 55 ARG 3.70 -0.23 1 56 LYS -0.61 -0.17 1 58 THR -4.43 0.46 1 59 SER -6.05 3.54 1 60 ILE 5.84 -1.23 1 61 THR 6.01 -0.69 1 62 ASP 4.78 -1.13 1 63 VAL 6.06 -1.26 1 64 VAL 7.81 -1.94 1 65 ASN 5.30 0.78 1 66 GLN 4.47 -0.78 1 67 LEU 3.34 -0.75 1 68 VAL 6.26 -1.65 1 69 ASP 5.22 -1.27 1 70 ASN 3.87 -0.70 1 71 TRP 4.82 0.26 1 72 LEU 3.98 -0.85 1 73 LYS 4.03 -0.88 1 74 GLU -1.00 1.27 1 75 ASN -0.28 1.39 1 76 GLU 2.69 0.62 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5563_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.18 _LACS_plot.Line_1_terminator_val_y_1 0.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 59 SER -6.05 0.26 0 60 ILE 5.84 -1.03 0 10 VAL 0.33 0.00 1 11 LYS 0.01 -0.01 1 12 LYS 0.01 -0.04 1 13 MET -0.11 0.03 1 14 THR -0.46 -0.03 1 15 PHE -0.03 0.03 1 17 GLU -0.29 -0.07 1 18 ASN 0.46 -0.04 1 19 ARG 0.88 -0.01 1 20 ASP 0.79 -0.07 1 21 LEU 0.54 -0.05 1 22 GLU -0.10 -0.08 1 23 ARG 0.27 -0.05 1 24 VAL 0.49 0.00 1 25 VAL 0.42 0.07 1 26 THR -0.35 -0.03 1 27 ALA 0.00 -0.01 1 29 VAL 0.31 0.00 1 30 SER -0.52 0.07 1 31 SER 0.02 0.04 1 33 LYS -0.05 0.07 1 34 ILE -2.24 0.33 1 35 LYS -3.58 0.21 1 36 ARG 1.23 0.26 1 37 VAL -2.52 0.02 1 38 ASN -1.11 0.36 1 39 VAL -2.66 -0.14 1 40 ASN -0.87 0.43 1 41 PHE -6.18 0.50 1 42 ASP -0.60 0.17 1 43 GLU 4.11 -0.47 1 44 GLU 4.31 -0.17 1 45 LYS 4.44 -0.36 1 46 HIS 5.40 -0.87 1 47 THR 6.22 -0.70 1 48 ARG 2.79 -0.18 1 49 PHE 0.59 0.27 1 50 LYS 4.85 -0.88 1 51 ALA 3.69 -0.10 1 52 ALA 2.25 -0.01 1 54 ALA 4.28 -0.09 1 55 ARG 3.70 -0.19 1 56 LYS -0.61 0.10 1 58 THR -4.43 0.61 1 61 THR 6.01 -0.52 1 62 ASP 4.78 -0.22 1 63 VAL 6.06 -0.60 1 64 VAL 7.81 -0.73 1 65 ASN 5.30 -0.84 1 66 GLN 4.47 -0.19 1 67 LEU 3.34 -0.17 1 68 VAL 6.26 -0.83 1 69 ASP 5.22 -0.27 1 70 ASN 3.87 -0.25 1 71 TRP 4.82 -0.48 1 72 LEU 3.98 -0.47 1 73 LYS 4.03 -0.28 1 74 GLU -1.00 -0.09 1 75 ASN -0.28 -0.20 1 76 GLU 2.69 -0.46 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5563_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.18 _LACS_plot.Line_1_terminator_val_y_1 -3.35 _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 -1.06 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 3.63 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 VAL 7.81 1.26 0 76 GLU 2.69 4.47 0 41 PHE -6.18 -0.46 0 10 VAL 0.33 -0.21 1 11 LYS 0.01 -0.34 1 12 LYS 0.01 -0.21 1 13 MET -0.11 -0.21 1 14 THR -0.46 -0.70 1 15 PHE -0.03 0.42 1 17 GLU -0.29 -0.26 1 18 ASN 0.46 0.17 1 19 ARG 0.88 -0.06 1 20 ASP 0.79 0.13 1 21 LEU 0.54 0.04 1 22 GLU -0.10 -0.22 1 23 ARG 0.27 -0.28 1 24 VAL 0.49 -0.08 1 25 VAL 0.42 0.04 1 26 THR -0.35 -0.97 1 27 ALA 0.00 -0.58 1 29 VAL 0.31 0.11 1 30 SER -0.52 0.07 1 31 SER 0.02 0.57 1 33 LYS -0.05 -0.73 1 34 ILE -2.24 -0.68 1 35 LYS -3.58 -2.13 1 36 ARG 1.23 -0.18 1 37 VAL -2.52 -2.47 1 38 ASN -1.11 -0.61 1 39 VAL -2.66 -2.30 1 40 ASN -0.87 -0.25 1 42 ASP -0.60 1.21 1 43 GLU 4.11 1.32 1 44 GLU 4.31 2.33 1 45 LYS 4.44 1.89 1 46 HIS 5.40 2.40 1 47 THR 6.22 2.47 1 48 ARG 2.79 3.29 1 49 PHE 0.59 1.50 1 50 LYS 4.85 2.79 1 51 ALA 3.69 2.44 1 52 ALA 2.25 2.90 1 54 ALA 4.28 3.98 1 55 ARG 3.70 1.98 1 56 LYS -0.61 0.13 1 58 THR -4.43 -2.75 1 59 SER -6.05 -1.38 1 60 ILE 5.84 1.49 1 61 THR 6.01 1.69 1 62 ASP 4.78 2.53 1 63 VAL 6.06 1.99 1 65 ASN 5.30 1.56 1 66 GLN 4.47 2.69 1 67 LEU 3.34 2.83 1 68 VAL 6.26 0.81 1 69 ASP 5.22 3.31 1 70 ASN 3.87 1.92 1 71 TRP 4.82 4.39 1 72 LEU 3.98 1.06 1 73 LYS 4.03 1.96 1 74 GLU -1.00 0.64 1 75 ASN -0.28 -1.65 1 stop_ save_