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 bmr6717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 -2.72 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 4.77 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 LYS 3.50 5.21 0 56 TRP -3.67 1.26 0 10 VAL -3.19 -1.12 1 11 TYR -7.34 -3.34 1 12 ILE -3.89 -1.24 1 13 LEU -7.20 -2.61 1 14 GLU -3.97 -1.24 1 16 LYS 4.90 3.31 1 17 ASP 0.31 -0.80 1 19 SER 0.68 1.03 1 20 TRP -4.04 -2.52 1 21 TYR -3.25 -0.60 1 22 THR -0.50 -0.46 1 24 TYR -6.29 -2.73 1 25 THR -0.69 -1.74 1 26 THR -0.24 -0.10 1 27 ASP -0.43 0.43 1 28 VAL 5.60 4.40 1 29 ASP 3.58 3.51 1 30 ARG 3.45 2.80 1 31 ARG 2.82 0.89 1 32 ILE 6.16 4.46 1 33 LYS 4.22 3.34 1 34 LYS 4.02 2.95 1 35 HIS 4.26 4.39 1 36 ALA 2.55 2.13 1 37 SER -0.05 0.44 1 39 LYS -1.04 -0.90 1 41 ALA -0.15 0.27 1 42 LYS 0.49 0.35 1 43 TYR 2.20 2.90 1 44 THR 1.34 0.25 1 45 ARG 3.54 2.34 1 47 ARG -0.79 -0.26 1 50 PHE -4.32 -0.81 1 51 ARG -4.70 -1.32 1 52 LEU 0.98 0.62 1 53 VAL 2.34 2.04 1 54 ALA -4.75 -0.78 1 55 THR -3.62 -0.98 1 57 ALA -5.19 -1.83 1 58 PHE -3.87 0.38 1 60 SER -4.98 -1.89 1 61 LYS 3.40 3.10 1 62 GLU 5.08 3.90 1 63 GLU 2.23 2.73 1 64 ALA 1.91 2.09 1 65 MET 4.02 2.80 1 66 ARG 4.61 3.62 1 67 TRP 1.17 1.77 1 68 GLU 4.64 3.67 1 69 TYR 4.90 4.30 1 70 GLU 3.40 2.64 1 71 VAL 5.35 3.93 1 72 LYS 4.06 3.22 1 73 HIS 2.54 2.38 1 74 LEU -1.22 -0.56 1 75 SER -1.53 -0.98 1 76 ARG 5.48 3.28 1 77 ARG 4.09 3.06 1 78 LYS 3.29 2.93 1 80 GLU 4.16 3.31 1 81 GLN 3.90 3.23 1 82 LEU 2.91 3.09 1 83 VAL 4.58 3.89 1 84 SER 3.28 2.77 1 85 LEU 1.17 0.87 1 86 LYS 1.57 0.83 1 90 TYR 0.11 -0.43 1 91 GLU -0.41 0.19 1 92 ASN 0.45 0.34 1 93 THR 0.83 0.63 1 94 THR 0.94 0.79 1 95 LYS 0.39 0.17 1 96 LEU 0.19 0.22 1 97 SER 0.42 0.30 1 98 THR 0.62 0.41 1 99 THR 0.70 0.55 1 100 LEU 0.41 0.31 1 101 GLU -0.33 0.11 1 102 HIS -0.19 1.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 4.62 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -1.38 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 LYS 3.50 1.71 0 56 TRP -3.67 4.93 0 10 VAL -3.19 2.07 1 11 TYR -7.34 4.00 1 12 ILE -3.89 2.65 1 13 LEU -7.20 4.59 1 14 GLU -3.97 2.73 1 16 LYS 4.90 -1.59 1 17 ASP 0.31 -1.11 1 19 SER 0.68 0.35 1 20 TRP -4.04 1.52 1 21 TYR -3.25 2.65 1 22 THR -0.50 0.04 1 24 TYR -6.29 3.56 1 25 THR -0.69 -1.05 1 26 THR -0.24 0.14 1 27 ASP -0.43 0.86 1 28 VAL 5.60 -1.20 1 29 ASP 3.58 -0.07 1 30 ARG 3.45 -0.65 1 31 ARG 2.82 -1.93 1 32 ILE 6.16 -1.70 1 33 LYS 4.22 -0.88 1 34 LYS 4.02 -1.07 1 35 HIS 4.26 0.13 1 36 ALA 2.55 -0.42 1 37 SER -0.05 0.49 1 39 LYS -1.04 0.14 1 41 ALA -0.15 0.42 1 42 LYS 0.49 -0.14 1 43 TYR 2.20 0.70 1 44 THR 1.34 -1.09 1 45 ARG 3.54 -1.20 1 47 ARG -0.79 0.53 1 50 PHE -4.32 3.51 1 51 ARG -4.70 3.38 1 52 LEU 0.98 -0.36 1 53 VAL 2.34 -0.30 1 54 ALA -4.75 3.97 1 55 THR -3.62 2.64 1 57 ALA -5.19 3.36 1 58 PHE -3.87 4.25 1 60 SER -4.98 3.09 1 61 LYS 3.40 -0.30 1 62 GLU 5.08 -1.18 1 63 GLU 2.23 0.50 1 64 ALA 1.91 0.18 1 65 MET 4.02 -1.22 1 66 ARG 4.61 -0.99 1 67 TRP 1.17 0.60 1 68 GLU 4.64 -0.97 1 69 TYR 4.90 -0.60 1 70 GLU 3.40 -0.76 1 71 VAL 5.35 -1.42 1 72 LYS 4.06 -0.84 1 73 HIS 2.54 -0.16 1 74 LEU -1.22 0.66 1 75 SER -1.53 0.55 1 76 ARG 5.48 -2.20 1 77 ARG 4.09 -1.03 1 78 LYS 3.29 -0.36 1 80 GLU 4.16 -0.85 1 81 GLN 3.90 -0.67 1 82 LEU 2.91 0.18 1 83 VAL 4.58 -0.69 1 84 SER 3.28 -0.51 1 85 LEU 1.17 -0.30 1 86 LYS 1.57 -0.74 1 90 TYR 0.11 -0.54 1 91 GLU -0.41 0.60 1 92 ASN 0.45 -0.11 1 93 THR 0.83 -0.20 1 94 THR 0.94 -0.15 1 95 LYS 0.39 -0.22 1 96 LEU 0.19 0.03 1 97 SER 0.42 -0.12 1 98 THR 0.62 -0.21 1 99 THR 0.70 -0.15 1 100 LEU 0.41 -0.10 1 101 GLU -0.33 0.44 1 102 HIS -0.19 1.38 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 0.99 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 ALA 1.91 -1.32 0 10 VAL -3.19 1.43 1 11 TYR -7.34 1.46 1 12 ILE -3.89 0.91 1 13 LEU -7.20 0.74 1 14 GLU -3.97 1.12 1 16 LYS 4.90 -0.25 1 17 ASP 0.31 -0.13 1 19 SER 0.68 -0.13 1 20 TRP -4.04 1.41 1 21 TYR -3.25 0.07 1 22 THR -0.50 0.66 1 24 TYR -6.29 1.58 1 25 THR -0.69 0.05 1 26 THR -0.24 0.65 1 27 ASP -0.43 -0.03 1 28 VAL 5.60 -0.97 1 29 ASP 3.58 -0.43 1 30 ARG 3.45 -0.46 1 31 ARG 2.82 -0.22 1 32 ILE 6.16 -0.55 1 33 LYS 4.22 -0.24 1 34 LYS 4.02 -0.25 1 35 HIS 4.26 -0.40 1 36 ALA 2.55 0.14 1 37 SER -0.05 0.13 1 39 LYS -1.04 0.18 1 41 ALA -0.15 -0.05 1 43 TYR 2.20 -0.27 1 44 THR 1.34 -0.31 1 45 ARG 3.54 -0.06 1 47 ARG -0.79 0.17 1 50 PHE -4.32 0.85 1 51 ARG -4.70 0.36 1 52 LEU 0.98 0.07 1 53 VAL 2.34 -0.48 1 54 ALA -4.75 0.00 1 55 THR -3.62 1.08 1 56 TRP -3.67 0.12 1 57 ALA -5.19 0.77 1 58 PHE -3.87 0.02 1 60 SER -4.98 -0.02 1 61 LYS 3.40 -0.95 1 62 GLU 5.08 -0.59 1 63 GLU 2.23 -0.57 1 65 MET 4.02 -0.43 1 66 ARG 4.61 -0.26 1 67 TRP 1.17 -0.13 1 68 GLU 4.64 -1.03 1 69 TYR 4.90 -0.71 1 70 GLU 3.40 -0.51 1 71 VAL 5.35 -1.11 1 72 LYS 4.06 -0.65 1 73 HIS 2.54 -0.43 1 74 LEU -1.22 0.05 1 75 SER -1.53 -0.11 1 76 ARG 5.48 -0.47 1 77 ARG 4.09 -0.30 1 78 LYS 3.29 -0.08 1 79 LYS 3.50 -0.28 1 80 GLU 4.16 -0.16 1 81 GLN 3.90 -0.15 1 82 LEU 2.91 -0.01 1 83 VAL 4.58 -0.28 1 84 SER 3.28 -0.09 1 85 LEU 1.17 0.04 1 86 LYS 1.57 0.01 1 90 TYR 0.11 0.07 1 91 GLU -0.41 -0.10 1 92 ASN 0.45 0.04 1 93 THR 0.83 0.02 1 94 THR 0.94 -0.03 1 95 LYS 0.39 0.01 1 96 LEU 0.19 0.02 1 97 SER 0.42 0.01 1 98 THR 0.62 0.00 1 99 THR 0.70 -0.01 1 100 LEU 0.41 -0.03 1 101 GLU -0.33 -0.17 1 102 HIS -0.19 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 -2.99 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 2.65 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 THR -0.69 -3.99 0 10 VAL -3.19 -1.56 1 11 TYR -7.34 -3.29 1 12 ILE -3.89 -1.55 1 13 LEU -7.20 -3.35 1 14 GLU -3.97 0.00 1 16 LYS 4.90 0.18 1 17 ASP 0.31 0.54 1 19 SER 0.68 -1.04 1 20 TRP -4.04 -0.16 1 21 TYR -3.25 -2.70 1 22 THR -0.50 -1.70 1 24 TYR -6.29 -0.27 1 26 THR -0.24 0.18 1 27 ASP -0.43 -1.14 1 28 VAL 5.60 -0.08 1 29 ASP 3.58 2.39 1 30 ARG 3.45 2.27 1 31 ARG 2.82 1.89 1 32 ILE 6.16 1.63 1 33 LYS 4.22 2.65 1 34 LYS 4.02 3.09 1 35 HIS 4.26 4.42 1 36 ALA 2.55 0.40 1 37 SER -0.05 0.22 1 41 ALA -0.15 0.02 1 44 THR 1.34 0.24 1 45 ARG 3.54 1.24 1 47 ARG -0.79 -1.13 1 50 PHE -4.32 -0.05 1 51 ARG -4.70 -1.25 1 52 LEU 0.98 -2.10 1 53 VAL 2.34 -0.51 1 54 ALA -4.75 -2.74 1 55 THR -3.62 -2.22 1 56 TRP -3.67 -2.62 1 57 ALA -5.19 -1.42 1 58 PHE -3.87 0.61 1 60 SER -4.98 -1.99 1 61 LYS 3.40 1.16 1 62 GLU 5.08 2.90 1 63 GLU 2.23 1.76 1 64 ALA 1.91 0.87 1 65 MET 4.02 3.44 1 66 ARG 4.61 2.24 1 67 TRP 1.17 0.35 1 68 GLU 4.64 0.61 1 69 TYR 4.90 2.22 1 70 GLU 3.40 2.69 1 71 VAL 5.35 2.37 1 72 LYS 4.06 1.43 1 73 HIS 2.54 0.38 1 74 LEU -1.22 0.52 1 75 SER -1.53 -0.43 1 76 ARG 5.48 1.60 1 77 ARG 4.09 2.83 1 78 LYS 3.29 3.76 1 79 LYS 3.50 2.02 1 80 GLU 4.16 3.42 1 81 GLN 3.90 2.23 1 82 LEU 2.91 2.09 1 83 VAL 4.58 2.08 1 84 SER 3.28 1.25 1 85 LEU 1.17 0.28 1 86 LYS 1.57 0.59 1 90 TYR 0.11 0.03 1 91 GLU -0.41 -0.56 1 92 ASN 0.45 0.66 1 93 THR 0.83 0.29 1 94 THR 0.94 -0.15 1 95 LYS 0.39 -0.13 1 96 LEU 0.19 -0.03 1 97 SER 0.42 0.45 1 98 THR 0.62 0.23 1 99 THR 0.70 -0.13 1 100 LEU 0.41 -0.35 1 101 GLU -0.33 -0.34 1 102 HIS -0.19 0.82 1 stop_ save_