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 bmr11321_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.25 _LACS_plot.Line_1_terminator_val_y_1 -2.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 4.25 _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 58 LYS 6.05 1.71 0 10 PHE 0.27 0.18 1 11 HIS -0.45 1.57 1 12 LYS 0.52 0.45 1 13 LYS 0.64 0.45 1 14 LEU 0.63 0.47 1 15 THR 0.29 0.24 1 16 GLU -0.13 0.31 1 18 VAL 0.69 0.45 1 19 LEU 0.50 0.26 1 20 MET 0.04 -0.04 1 21 ARG 0.20 0.03 1 22 ASP -0.77 0.20 1 24 LYS -0.54 -0.69 1 25 PHE -1.18 0.02 1 26 LEU -4.04 -1.81 1 27 TRP -3.13 -1.96 1 29 ALA 1.01 1.32 1 30 GLN 1.97 2.39 1 32 SER 5.50 3.50 1 33 PHE -0.97 1.70 1 35 PHE -3.80 -2.54 1 36 ILE -1.30 -1.19 1 37 TYR -3.68 -1.37 1 38 GLU -1.63 -0.80 1 39 ARG 0.98 0.85 1 40 GLU 1.09 0.28 1 41 GLN -0.37 -0.11 1 42 LEU 1.40 1.37 1 43 GLU -2.55 -2.99 1 44 ALA -5.10 -1.95 1 45 THR -1.78 -1.07 1 48 GLN 1.43 1.90 1 50 HIS 4.62 2.17 1 51 GLN 0.37 0.81 1 52 THR -0.27 -0.45 1 53 PHE -5.12 -2.15 1 55 VAL 4.32 3.04 1 56 ARG 1.81 2.74 1 59 ARG -0.38 0.04 1 60 GLN 2.39 1.63 1 61 TRP 0.24 1.17 1 62 GLU -6.25 -2.54 1 63 GLU 3.03 2.31 1 64 GLN 5.41 2.42 1 65 HIS 1.63 -0.30 1 66 ARG 4.60 3.12 1 68 ARG -5.12 -1.55 1 69 SER -2.00 -0.99 1 71 GLU 4.40 3.50 1 72 ASP 3.86 3.00 1 73 PHE 4.84 3.36 1 74 GLN 4.81 3.18 1 75 ASN 3.81 3.21 1 76 TRP 6.20 4.73 1 77 LYS 3.86 1.55 1 78 ARG 3.49 2.70 1 79 MET 1.36 1.08 1 80 ASN 0.24 0.50 1 81 SER 0.00 0.36 1 84 SER -0.06 0.13 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11321_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.25 _LACS_plot.Line_1_terminator_val_y_1 3.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.92 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -1.94 _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 58 LYS 6.05 -4.34 0 10 PHE 0.27 -0.09 1 11 HIS -0.45 2.02 1 12 LYS 0.52 -0.07 1 13 LYS 0.64 -0.19 1 14 LEU 0.63 -0.16 1 15 THR 0.29 -0.05 1 16 GLU -0.13 0.44 1 18 VAL 0.69 -0.24 1 19 LEU 0.50 -0.24 1 20 MET 0.04 -0.08 1 21 ARG 0.20 -0.17 1 22 ASP -0.77 0.97 1 24 LYS -0.54 -0.15 1 25 PHE -1.18 1.20 1 26 LEU -4.04 2.23 1 27 TRP -3.13 1.17 1 29 ALA 1.01 0.31 1 30 GLN 1.97 0.42 1 32 SER 5.50 -2.00 1 33 PHE -0.97 2.67 1 35 PHE -3.80 1.26 1 36 ILE -1.30 0.11 1 37 TYR -3.68 2.31 1 38 GLU -1.63 0.83 1 39 ARG 0.98 -0.13 1 40 GLU 1.09 -0.81 1 41 GLN -0.37 0.26 1 42 LEU 1.40 -0.03 1 43 GLU -2.55 -0.44 1 44 ALA -5.10 3.15 1 45 THR -1.78 0.71 1 48 GLN 1.43 0.47 1 50 HIS 4.62 -2.45 1 51 GLN 0.37 0.44 1 52 THR -0.27 -0.18 1 53 PHE -5.12 2.97 1 55 VAL 4.32 -1.28 1 56 ARG 1.81 0.93 1 59 ARG -0.38 0.42 1 60 GLN 2.39 -0.76 1 61 TRP 0.24 0.93 1 62 GLU -6.25 3.71 1 63 GLU 3.03 -0.72 1 64 GLN 5.41 -2.99 1 65 HIS 1.63 -1.93 1 66 ARG 4.60 -1.48 1 68 ARG -5.12 3.57 1 69 SER -2.00 1.01 1 71 GLU 4.40 -0.90 1 72 ASP 3.86 -0.86 1 73 PHE 4.84 -1.48 1 74 GLN 4.81 -1.63 1 75 ASN 3.81 -0.60 1 76 TRP 6.20 -1.47 1 77 LYS 3.86 -2.31 1 78 ARG 3.49 -0.79 1 79 MET 1.36 -0.28 1 80 ASN 0.24 0.26 1 81 SER 0.00 0.36 1 84 SER -0.06 0.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11321_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.25 _LACS_plot.Line_1_terminator_val_y_1 0.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 THR -0.27 1.13 0 10 PHE 0.27 -0.12 1 11 HIS -0.45 -0.26 1 12 LYS 0.52 -0.13 1 13 LYS 0.64 -0.08 1 14 LEU 0.63 0.00 1 15 THR 0.29 -0.07 1 16 GLU -0.13 -0.11 1 18 VAL 0.69 -0.10 1 19 LEU 0.50 -0.07 1 20 MET 0.04 -0.31 1 21 ARG 0.20 -0.13 1 22 ASP -0.77 -0.15 1 24 LYS -0.54 -0.03 1 25 PHE -1.18 -0.14 1 26 LEU -4.04 -0.11 1 27 TRP -3.13 0.29 1 29 ALA 1.01 -0.29 1 30 GLN 1.97 -0.04 1 32 SER 5.50 -0.35 1 33 PHE -0.97 -0.12 1 35 PHE -3.80 0.04 1 36 ILE -1.30 0.23 1 37 TYR -3.68 0.34 1 38 GLU -1.63 -0.07 1 39 ARG 0.98 -0.30 1 40 GLU 1.09 -0.15 1 41 GLN -0.37 -0.02 1 42 LEU 1.40 -0.20 1 43 GLU -2.55 -0.23 1 44 ALA -5.10 -0.04 1 45 THR -1.78 0.49 1 48 GLN 1.43 -0.39 1 50 HIS 4.62 -0.37 1 51 GLN 0.37 0.15 1 53 PHE -5.12 0.84 1 55 VAL 4.32 -0.36 1 56 ARG 1.81 0.10 1 58 LYS 6.05 0.04 1 59 ARG -0.38 0.21 1 60 GLN 2.39 -0.08 1 61 TRP 0.24 -0.64 1 62 GLU -6.25 0.06 1 63 GLU 3.03 -0.57 1 64 GLN 5.41 -0.57 1 65 HIS 1.63 -0.98 1 66 ARG 4.60 -0.22 1 68 ARG -5.12 0.61 1 69 SER -2.00 0.28 1 71 GLU 4.40 -0.32 1 72 ASP 3.86 -0.13 1 73 PHE 4.84 -0.50 1 74 GLN 4.81 -0.73 1 75 ASN 3.81 -0.37 1 76 TRP 6.20 -0.74 1 77 LYS 3.86 -1.05 1 78 ARG 3.49 -0.44 1 79 MET 1.36 -0.26 1 80 ASN 0.24 -0.23 1 81 SER 0.00 -0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11321_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.25 _LACS_plot.Line_1_terminator_val_y_1 -2.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 2.66 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 LEU -4.04 -4.45 0 68 ARG -5.12 0.17 0 65 HIS 1.63 3.91 0 58 LYS 6.05 -1.13 0 10 PHE 0.27 -0.27 1 11 HIS -0.45 1.22 1 12 LYS 0.52 -0.20 1 13 LYS 0.64 0.21 1 14 LEU 0.63 0.10 1 15 THR 0.29 -0.10 1 16 GLU -0.13 0.32 1 18 VAL 0.69 -0.06 1 19 LEU 0.50 -0.53 1 20 MET 0.04 -0.55 1 21 ARG 0.20 -0.41 1 22 ASP -0.77 -1.00 1 24 LYS -0.54 -2.19 1 25 PHE -1.18 -1.32 1 27 TRP -3.13 -0.43 1 30 GLN 1.97 1.58 1 35 PHE -3.80 -4.09 1 36 ILE -1.30 -0.78 1 39 ARG 0.98 -0.29 1 40 GLU 1.09 -0.36 1 41 GLN -0.37 -0.56 1 42 LEU 1.40 -2.25 1 43 GLU -2.55 -2.46 1 44 ALA -5.10 -2.83 1 45 THR -1.78 -1.60 1 48 GLN 1.43 -0.08 1 50 HIS 4.62 -0.21 1 51 GLN 0.37 -0.69 1 52 THR -0.27 -0.09 1 53 PHE -5.12 -2.79 1 55 VAL 4.32 -0.32 1 56 ARG 1.81 1.02 1 59 ARG -0.38 0.29 1 60 GLN 2.39 0.52 1 61 TRP 0.24 -0.84 1 62 GLU -6.25 -1.20 1 63 GLU 3.03 1.85 1 64 GLN 5.41 -0.34 1 66 ARG 4.60 0.85 1 69 SER -2.00 0.26 1 71 GLU 4.40 1.99 1 72 ASP 3.86 3.35 1 73 PHE 4.84 0.05 1 74 GLN 4.81 2.43 1 75 ASN 3.81 1.61 1 76 TRP 6.20 2.69 1 77 LYS 3.86 2.42 1 78 ARG 3.49 2.03 1 79 MET 1.36 0.35 1 80 ASN 0.24 -0.79 1 81 SER 0.00 -0.23 1 84 SER -0.06 0.03 1 stop_ save_