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 bmr7229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 -2.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.18 _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 5.42 _LACS_plot.Line_2_terminator_val_y_2 4.31 _LACS_plot.Y_axis_chem_shift_offset -0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 HIS -5.33 0.40 0 36 ILE -1.09 -2.96 0 12 LYS 0.91 -0.03 1 13 ILE -1.80 -0.53 1 14 ARG -1.34 -0.73 1 15 TYR 5.39 2.34 1 16 SER 2.72 1.82 1 17 ASP -0.40 1.20 1 18 VAL 3.26 3.34 1 19 LYS -0.65 1.09 1 20 LYS -3.68 -0.28 1 21 LEU -2.30 0.35 1 22 GLU -7.05 -1.55 1 23 MET -0.42 -1.49 1 24 LYS -0.56 0.29 1 26 LYS 1.95 3.52 1 27 TYR -4.23 -0.99 1 29 HIS 0.13 1.10 1 31 GLU -0.01 1.44 1 32 GLU -1.90 -0.53 1 33 LYS 0.50 1.18 1 34 MET -8.01 -3.38 1 35 VAL 2.55 0.76 1 37 ILE -3.60 -1.48 1 38 THR 0.84 0.76 1 39 THR -2.81 -0.79 1 42 VAL 0.01 -0.39 1 44 ARG 2.39 1.71 1 45 TYR -0.91 -0.07 1 46 ARG 1.99 0.71 1 48 GLN -1.76 0.35 1 49 GLU -3.46 -1.20 1 52 LEU -4.75 -1.21 1 53 HIS -0.68 2.48 1 55 LYS 1.23 0.98 1 56 LEU -0.41 -0.29 1 57 GLN 5.08 3.96 1 58 SER 4.64 2.77 1 59 THR 5.43 4.19 1 60 LYS 5.17 4.55 1 61 ARG 4.35 3.92 1 62 PHE 4.77 4.77 1 63 ILE 4.88 5.05 1 64 LYS 4.39 3.77 1 65 TRP 3.59 2.92 1 66 TYR 4.17 4.07 1 67 ASN 3.81 2.86 1 68 ALA 2.79 2.31 1 69 TRP 3.52 2.90 1 70 ASN 1.99 2.22 1 71 GLU 1.76 1.78 1 72 LYS 1.48 1.04 1 73 ARG 1.04 0.66 1 74 ARG 0.70 0.80 1 75 VAL 0.32 0.52 1 76 TYR -0.37 0.08 1 77 GLU -1.37 0.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 5.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.94 _LACS_plot.Line_2_terminator_val_x_2 5.42 _LACS_plot.Line_2_terminator_val_y_2 -1.11 _LACS_plot.Y_axis_chem_shift_offset -0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 HIS -5.33 5.73 0 36 ILE -1.09 -1.87 0 12 LYS 0.91 -0.94 1 13 ILE -1.80 1.27 1 14 ARG -1.34 0.61 1 15 TYR 5.39 -3.05 1 16 SER 2.72 -0.90 1 17 ASP -0.40 1.60 1 18 VAL 3.26 0.08 1 19 LYS -0.65 1.74 1 20 LYS -3.68 3.40 1 21 LEU -2.30 2.65 1 22 GLU -7.05 5.50 1 23 MET -0.42 -1.07 1 24 LYS -0.56 0.85 1 26 LYS 1.95 1.57 1 27 TYR -4.23 3.24 1 29 HIS 0.13 0.97 1 31 GLU -0.01 1.45 1 32 GLU -1.90 1.37 1 33 LYS 0.50 0.68 1 34 MET -8.01 4.63 1 35 VAL 2.55 -1.79 1 37 ILE -3.60 2.12 1 38 THR 0.84 -0.08 1 39 THR -2.81 2.02 1 42 VAL 0.01 -0.40 1 44 ARG 2.39 -0.68 1 45 TYR -0.91 0.84 1 46 ARG 1.99 -1.28 1 48 GLN -1.76 2.11 1 49 GLU -3.46 2.26 1 52 LEU -4.75 3.54 1 53 HIS -0.68 3.16 1 55 LYS 1.23 -0.25 1 56 LEU -0.41 0.12 1 57 GLN 5.08 -1.12 1 58 SER 4.64 -1.87 1 59 THR 5.43 -1.24 1 60 LYS 5.17 -0.62 1 61 ARG 4.35 -0.43 1 62 PHE 4.77 0.00 1 63 ILE 4.88 0.17 1 64 LYS 4.39 -0.62 1 65 TRP 3.59 -0.67 1 66 TYR 4.17 -0.10 1 67 ASN 3.81 -0.95 1 68 ALA 2.79 -0.48 1 69 TRP 3.52 -0.62 1 70 ASN 1.99 0.23 1 71 GLU 1.76 0.02 1 72 LYS 1.48 -0.44 1 73 ARG 1.04 -0.38 1 74 ARG 0.70 0.10 1 75 VAL 0.32 0.20 1 76 TYR -0.37 0.45 1 77 GLU -1.37 1.37 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 0.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 5.42 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _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 34 MET -8.01 0.39 0 23 MET -0.42 1.03 0 12 LYS 0.91 -0.07 1 13 ILE -1.80 -0.09 1 14 ARG -1.34 -0.04 1 15 TYR 5.39 -0.60 1 16 SER 2.72 -0.39 1 17 ASP -0.40 0.21 1 18 VAL 3.26 -0.61 1 19 LYS -0.65 0.27 1 20 LYS -3.68 0.35 1 21 LEU -2.30 0.56 1 22 GLU -7.05 0.32 1 24 LYS -0.56 0.23 1 26 LYS 1.95 -0.87 1 27 TYR -4.23 0.01 1 29 HIS 0.13 -0.04 1 31 GLU -0.01 -0.09 1 32 GLU -1.90 -0.05 1 33 LYS 0.50 -0.62 1 35 VAL 2.55 0.35 1 36 ILE -1.09 0.73 1 37 ILE -3.60 0.58 1 38 THR 0.84 0.61 1 39 THR -2.81 0.74 1 42 VAL 0.01 0.26 1 44 ARG 2.39 -0.22 1 45 TYR -0.91 0.06 1 46 ARG 1.99 -0.01 1 48 GLN -1.76 0.08 1 49 GLU -3.46 0.78 1 50 HIS -5.33 0.01 1 52 LEU -4.75 0.47 1 53 HIS -0.68 -0.15 1 55 LYS 1.23 0.02 1 56 LEU -0.41 0.11 1 57 GLN 5.08 -0.30 1 58 SER 4.64 -0.33 1 59 THR 5.43 -0.32 1 60 LYS 5.17 -0.38 1 61 ARG 4.35 -0.37 1 62 PHE 4.77 -0.28 1 63 ILE 4.88 -0.59 1 64 LYS 4.39 -0.27 1 65 TRP 3.59 -0.29 1 66 TYR 4.17 -1.19 1 67 ASN 3.81 -0.45 1 68 ALA 2.79 -0.16 1 69 TRP 3.52 -0.53 1 70 ASN 1.99 -0.71 1 71 GLU 1.76 -0.33 1 72 LYS 1.48 -0.19 1 73 ARG 1.04 -0.26 1 74 ARG 0.70 -0.16 1 75 VAL 0.32 -0.08 1 76 TYR -0.37 0.06 1 77 GLU -1.37 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 -2.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.76 _LACS_plot.Line_2_terminator_val_x_2 5.42 _LACS_plot.Line_2_terminator_val_y_2 2.10 _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 53 HIS -0.68 5.09 0 27 TYR -4.23 4.08 0 12 LYS 0.91 -0.52 1 13 ILE -1.80 -0.75 1 14 ARG -1.34 2.24 1 15 TYR 5.39 2.47 1 16 SER 2.72 0.31 1 17 ASP -0.40 0.36 1 18 VAL 3.26 -0.92 1 19 LYS -0.65 -0.59 1 20 LYS -3.68 -4.09 1 21 LEU -2.30 -2.33 1 22 GLU -7.05 -2.82 1 23 MET -0.42 -1.14 1 24 LYS -0.56 -2.60 1 26 LYS 1.95 -0.92 1 29 HIS 0.13 1.70 1 31 GLU -0.01 0.37 1 32 GLU -1.90 -0.73 1 33 LYS 0.50 -0.97 1 34 MET -8.01 -1.60 1 35 VAL 2.55 -1.74 1 36 ILE -1.09 0.88 1 37 ILE -3.60 -0.56 1 38 THR 0.84 1.00 1 39 THR -2.81 0.17 1 42 VAL 0.01 0.35 1 44 ARG 2.39 -0.23 1 45 TYR -0.91 0.34 1 46 ARG 1.99 0.27 1 48 GLN -1.76 -0.29 1 49 GLU -3.46 -0.48 1 50 HIS -5.33 -0.78 1 52 LEU -4.75 -2.00 1 55 LYS 1.23 1.08 1 56 LEU -0.41 -2.01 1 58 SER 4.64 3.24 1 59 THR 5.43 0.71 1 60 LYS 5.17 3.36 1 61 ARG 4.35 1.45 1 62 PHE 4.77 1.97 1 63 ILE 4.88 1.22 1 64 LYS 4.39 3.62 1 65 TRP 3.59 2.35 1 66 TYR 4.17 1.71 1 67 ASN 3.81 2.60 1 68 ALA 2.79 1.77 1 69 TRP 3.52 2.18 1 70 ASN 1.99 1.63 1 71 GLU 1.76 1.05 1 72 LYS 1.48 0.51 1 73 ARG 1.04 0.18 1 74 ARG 0.70 0.04 1 75 VAL 0.32 -0.39 1 76 TYR -0.37 -0.34 1 77 GLU -1.37 -1.35 1 stop_ save_