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 bmr36059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -2.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.52 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 5.45 _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 37 MET 1.23 -2.55 0 12 LEU -1.74 -0.81 1 13 SER -1.57 -0.79 1 14 VAL 4.29 2.99 1 15 ASN 0.87 0.00 1 16 THR 3.08 2.55 1 17 THR -5.24 -2.31 1 18 VAL 4.89 3.49 1 19 GLU 5.05 3.65 1 20 ASP 2.36 3.02 1 21 VAL 5.88 4.78 1 22 LYS 5.53 5.24 1 23 HIS 3.64 3.13 1 24 TYR 4.99 4.28 1 25 PHE 6.90 5.98 1 26 GLU 1.85 1.11 1 27 GLN 2.11 1.93 1 28 PHE 1.21 1.57 1 30 LYS 2.03 1.75 1 31 VAL -0.75 -0.28 1 32 ASP 0.61 1.33 1 33 ASP -3.55 -0.38 1 34 ALA -3.72 -0.92 1 35 MET -3.16 -0.43 1 36 LEU -2.34 -1.79 1 38 PHE -1.90 0.79 1 39 ASP -2.13 -1.26 1 40 LYS 2.76 2.08 1 41 THR 3.90 3.03 1 42 THR -0.89 -0.14 1 43 ASN 2.89 1.67 1 44 ARG -3.22 -1.24 1 45 HIS -0.80 1.04 1 46 ARG -1.84 -0.08 1 48 PHE -6.13 -3.14 1 50 PHE -6.54 -1.59 1 51 VAL -3.14 -1.29 1 52 THR -0.75 -0.68 1 53 PHE -2.34 0.02 1 54 GLU 1.28 2.05 1 55 SER -3.20 -2.01 1 56 GLU 2.76 2.51 1 57 ASP 3.76 2.63 1 58 ILE 3.64 0.74 1 59 VAL 6.22 4.80 1 60 GLU 3.66 2.64 1 61 LYS 3.65 2.89 1 62 VAL 5.88 4.30 1 64 GLU 3.34 2.60 1 65 ILE 4.10 4.38 1 66 HIS 6.57 5.43 1 67 PHE -1.94 -0.35 1 68 HIS -5.98 -0.19 1 69 GLU -1.96 -0.91 1 70 ILE -1.12 -0.20 1 71 ASN 3.56 1.46 1 72 ASN 3.18 1.77 1 73 LYS -4.63 -1.76 1 74 MET 1.02 -0.63 1 75 VAL -3.11 -2.85 1 76 GLU -4.69 -1.70 1 78 LYS -5.84 -1.71 1 79 LYS 3.74 2.85 1 80 ALA -0.01 -0.23 1 81 GLN -1.87 -1.58 1 83 LYS 2.80 2.37 1 84 GLU 1.14 0.85 1 85 VAL 0.70 0.27 1 86 MET 0.03 -0.30 1 87 SER -0.20 -0.20 1 89 THR 0.27 0.20 1 91 SER -0.13 0.04 1 92 ALA 0.25 0.26 1 93 ARG 0.52 0.32 1 95 ARG -0.10 -0.07 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 4.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.48 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -1.45 _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 37 MET 1.23 -3.78 0 12 LEU -1.74 0.93 1 13 SER -1.57 0.78 1 14 VAL 4.29 -1.30 1 15 ASN 0.87 -0.87 1 16 THR 3.08 -0.53 1 17 THR -5.24 2.93 1 18 VAL 4.89 -1.40 1 19 GLU 5.05 -1.40 1 20 ASP 2.36 0.66 1 21 VAL 5.88 -1.10 1 22 LYS 5.53 -0.29 1 23 HIS 3.64 -0.51 1 24 TYR 4.99 -0.71 1 25 PHE 6.90 -0.92 1 26 GLU 1.85 -0.74 1 27 GLN 2.11 -0.18 1 28 PHE 1.21 0.36 1 30 LYS 2.03 -0.28 1 31 VAL -0.75 0.47 1 32 ASP 0.61 0.72 1 33 ASP -3.55 3.17 1 34 ALA -3.72 2.80 1 35 MET -3.16 2.73 1 36 LEU -2.34 0.55 1 38 PHE -1.90 2.69 1 39 ASP -2.13 0.87 1 40 LYS 2.76 -0.68 1 41 THR 3.90 -0.87 1 42 THR -0.89 0.75 1 43 ASN 2.89 -1.22 1 44 ARG -3.22 1.98 1 45 HIS -0.80 1.84 1 46 ARG -1.84 1.76 1 48 PHE -6.13 2.99 1 50 PHE -6.54 4.95 1 51 VAL -3.14 1.85 1 52 THR -0.75 0.07 1 53 PHE -2.34 2.36 1 54 GLU 1.28 0.77 1 55 SER -3.20 1.19 1 56 GLU 2.76 -0.25 1 57 ASP 3.76 -1.13 1 58 ILE 3.64 -2.90 1 59 VAL 6.22 -1.42 1 60 GLU 3.66 -1.02 1 61 LYS 3.65 -0.76 1 62 VAL 5.88 -1.58 1 64 GLU 3.34 -0.74 1 65 ILE 4.10 0.28 1 66 HIS 6.57 -1.14 1 67 PHE -1.94 1.59 1 68 HIS -5.98 5.79 1 69 GLU -1.96 1.05 1 70 ILE -1.12 0.92 1 71 ASN 3.56 -2.10 1 72 ASN 3.18 -1.41 1 73 LYS -4.63 2.87 1 74 MET 1.02 -1.65 1 75 VAL -3.11 0.26 1 76 GLU -4.69 2.99 1 78 LYS -5.84 4.13 1 79 LYS 3.74 -0.89 1 80 ALA -0.01 -0.22 1 81 GLN -1.87 0.29 1 83 LYS 2.80 -0.43 1 84 GLU 1.14 -0.29 1 85 VAL 0.70 -0.43 1 86 MET 0.03 -0.33 1 87 SER -0.20 0.00 1 89 THR 0.27 -0.07 1 91 SER -0.13 0.17 1 92 ALA 0.25 0.01 1 93 ARG 0.52 -0.20 1 95 ARG -0.10 0.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 0.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.11 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _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 68 HIS -5.98 -0.23 0 80 ALA -0.01 1.01 0 12 LEU -1.74 -0.31 1 13 SER -1.57 -0.06 1 14 VAL 4.29 -0.63 1 15 ASN 0.87 0.02 1 16 THR 3.08 -0.21 1 17 THR -5.24 0.32 1 18 VAL 4.89 -0.63 1 19 GLU 5.05 -0.53 1 20 ASP 2.36 -0.31 1 21 VAL 5.88 -0.67 1 22 LYS 5.53 -0.64 1 23 HIS 3.64 -0.23 1 24 TYR 4.99 -0.51 1 25 PHE 6.90 -0.23 1 26 GLU 1.85 0.72 1 27 GLN 2.11 -0.35 1 28 PHE 1.21 -0.26 1 30 LYS 2.03 -0.12 1 31 VAL -0.75 -0.19 1 32 ASP 0.61 -0.03 1 33 ASP -3.55 0.03 1 34 ALA -3.72 0.66 1 35 MET -3.16 0.23 1 36 LEU -2.34 0.02 1 37 MET 1.23 0.42 1 38 PHE -1.90 -0.04 1 39 ASP -2.13 0.22 1 40 LYS 2.76 -0.10 1 41 THR 3.90 -0.08 1 42 THR -0.89 0.01 1 43 ASN 2.89 -0.27 1 44 ARG -3.22 0.34 1 45 HIS -0.80 -0.38 1 46 ARG -1.84 -0.38 1 48 PHE -6.13 0.65 1 50 PHE -6.54 1.02 1 51 VAL -3.14 0.18 1 52 THR -0.75 0.66 1 53 PHE -2.34 0.36 1 54 GLU 1.28 -0.13 1 55 SER -3.20 0.36 1 56 GLU 2.76 -0.32 1 57 ASP 3.76 -0.30 1 58 ILE 3.64 -0.58 1 59 VAL 6.22 -1.18 1 60 GLU 3.66 -0.50 1 61 LYS 3.65 -0.20 1 62 VAL 5.88 -0.60 1 64 GLU 3.34 -0.31 1 65 ILE 4.10 -0.49 1 66 HIS 6.57 -0.63 1 67 PHE -1.94 0.99 1 69 GLU -1.96 0.41 1 70 ILE -1.12 -0.28 1 71 ASN 3.56 -0.55 1 72 ASN 3.18 -0.57 1 73 LYS -4.63 0.22 1 74 MET 1.02 0.38 1 75 VAL -3.11 0.57 1 76 GLU -4.69 0.34 1 78 LYS -5.84 0.42 1 79 LYS 3.74 -0.34 1 81 GLN -1.87 0.19 1 83 LYS 2.80 -0.35 1 84 GLU 1.14 -0.21 1 85 VAL 0.70 -0.08 1 86 MET 0.03 -0.10 1 87 SER -0.20 -0.07 1 89 THR 0.27 -0.04 1 92 ALA 0.25 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36059_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -2.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.73 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 1.95 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 PHE -6.13 -4.48 0 17 THR -5.24 1.41 0 12 LEU -1.74 0.46 1 13 SER -1.57 1.86 1 14 VAL 4.29 -0.56 1 15 ASN 0.87 -0.12 1 16 THR 3.08 -1.34 1 18 VAL 4.89 0.21 1 19 GLU 5.05 1.95 1 20 ASP 2.36 3.31 1 21 VAL 5.88 0.58 1 22 LYS 5.53 0.63 1 23 HIS 3.64 3.07 1 24 TYR 4.99 2.25 1 25 PHE 6.90 1.71 1 26 GLU 1.85 1.29 1 27 GLN 2.11 0.77 1 28 PHE 1.21 -0.40 1 30 LYS 2.03 0.25 1 31 VAL -0.75 -0.89 1 32 ASP 0.61 -0.32 1 33 ASP -3.55 -3.05 1 34 ALA -3.72 -3.41 1 35 MET -3.16 -2.88 1 36 LEU -2.34 -2.66 1 37 MET 1.23 -0.75 1 38 PHE -1.90 -0.49 1 39 ASP -2.13 0.49 1 40 LYS 2.76 1.03 1 41 THR 3.90 1.41 1 42 THR -0.89 0.86 1 43 ASN 2.89 -1.40 1 44 ARG -3.22 -0.62 1 45 HIS -0.80 1.25 1 46 ARG -1.84 0.74 1 50 PHE -6.54 -0.45 1 51 VAL -3.14 -2.87 1 52 THR -0.75 -0.51 1 53 PHE -2.34 -0.67 1 54 GLU 1.28 -0.17 1 55 SER -3.20 0.69 1 56 GLU 2.76 1.04 1 57 ASP 3.76 2.26 1 58 ILE 3.64 0.95 1 59 VAL 6.22 1.57 1 60 GLU 3.66 2.36 1 61 LYS 3.65 2.66 1 62 VAL 5.88 4.24 1 64 GLU 3.34 2.34 1 65 ILE 4.10 3.10 1 66 HIS 6.57 0.00 1 67 PHE -1.94 -1.09 1 68 HIS -5.98 -1.38 1 69 GLU -1.96 -2.20 1 70 ILE -1.12 -0.18 1 71 ASN 3.56 -0.73 1 72 ASN 3.18 -2.42 1 73 LYS -4.63 -2.78 1 74 MET 1.02 -0.51 1 75 VAL -3.11 -2.51 1 76 GLU -4.69 -0.93 1 78 LYS -5.84 -1.54 1 79 LYS 3.74 0.85 1 80 ALA -0.01 -0.42 1 83 LYS 2.80 0.72 1 84 GLU 1.14 0.09 1 85 VAL 0.70 -0.20 1 86 MET 0.03 -0.20 1 89 THR 0.27 0.68 1 91 SER -0.13 -0.17 1 92 ALA 0.25 -0.06 1 93 ARG 0.52 0.59 1 95 ARG -0.10 -0.73 1 stop_ save_