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 bmr25945_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.98 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 6.70 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 ASP 0.72 -1.22 0 55 TYR 1.64 -0.74 0 26 ARG 4.40 1.26 0 88 ASN 2.10 4.32 0 63 ASP -3.98 -2.39 0 11 ALA -0.40 -0.41 1 12 LEU -1.13 -0.53 1 13 GLU 0.63 0.69 1 15 PHE 4.86 2.10 1 16 SER 4.60 2.95 1 17 HIS 0.49 1.66 1 18 LEU -1.31 -1.10 1 21 GLU 4.36 3.20 1 22 GLN 2.16 2.44 1 23 ARG 5.40 4.66 1 24 ARG 4.66 4.08 1 25 LYS 3.78 3.16 1 27 LEU 2.21 3.09 1 28 GLN 4.21 3.42 1 29 GLN 4.74 3.54 1 30 ARG 3.58 2.65 1 31 ILE 6.06 5.67 1 32 ASP 4.37 3.82 1 33 GLU 3.17 3.14 1 34 LEU 1.43 2.75 1 35 SER 5.48 4.37 1 36 ARG 4.33 3.62 1 37 GLU 3.36 3.02 1 38 LEU 4.15 3.21 1 39 GLN 4.23 3.13 1 40 LYS 4.48 3.46 1 41 GLU 1.99 2.22 1 42 MET 4.92 4.07 1 43 ASP 4.43 3.18 1 44 GLN 4.15 3.08 1 45 LYS 5.77 4.54 1 46 ASP 3.75 3.38 1 47 ALA 4.02 2.97 1 48 LEU 1.90 2.88 1 49 ASN 3.65 3.07 1 50 LYS 4.25 3.35 1 51 MET 3.10 2.31 1 52 LYS 5.75 4.59 1 53 ASP 3.36 3.42 1 54 VAL 5.99 4.59 1 56 GLU 2.85 2.89 1 57 LYS 0.77 1.43 1 58 ASN -1.47 -0.40 1 60 GLN 3.46 1.75 1 61 MET 0.89 1.19 1 65 SER 3.94 2.78 1 66 SER 2.54 2.27 1 67 LEU -0.12 0.05 1 68 HIS 8.37 7.74 1 70 LYS 2.77 2.21 1 71 ILE 5.74 5.38 1 72 ALA 4.33 3.02 1 73 GLU 2.83 2.89 1 74 THR 5.96 5.33 1 75 THR 7.13 6.02 1 76 SER 4.78 3.60 1 77 ASN 4.40 3.01 1 78 ILE 5.55 5.24 1 79 GLU 3.28 2.84 1 80 ARG 4.51 3.66 1 81 LEU 2.24 3.32 1 82 ARG 5.35 4.65 1 83 MET 4.24 3.28 1 84 GLU 2.93 3.02 1 85 ILE 6.72 6.40 1 86 HIS 3.79 4.47 1 87 LYS 3.99 2.89 1 89 GLU 3.48 3.34 1 90 ALA 4.55 2.70 1 91 TRP 2.35 1.90 1 92 LEU 3.45 2.89 1 93 SER 3.82 3.11 1 94 GLU 1.69 1.81 1 95 VAL 3.00 2.11 1 96 GLU 0.94 1.21 1 98 LYS 0.06 0.15 1 99 VAL 0.33 0.28 1 100 SER 0.26 0.27 1 101 GLN 0.08 0.22 1 102 ARG -0.14 0.11 1 103 SER -0.11 -0.03 1 104 GLU 0.17 1.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25945_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.98 _LACS_plot.Line_1_terminator_val_y_1 1.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.83 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 -1.67 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 ASP 0.72 -1.94 0 55 TYR 1.64 -2.38 0 26 ARG 4.40 -3.14 0 88 ASN 2.10 2.22 0 63 ASP -3.98 1.59 0 11 ALA -0.40 -0.01 1 12 LEU -1.13 0.60 1 13 GLU 0.63 0.06 1 15 PHE 4.86 -2.76 1 16 SER 4.60 -1.65 1 17 HIS 0.49 1.17 1 18 LEU -1.31 0.21 1 21 GLU 4.36 -1.16 1 22 GLN 2.16 0.28 1 23 ARG 5.40 -0.74 1 24 ARG 4.66 -0.58 1 25 LYS 3.78 -0.62 1 27 LEU 2.21 0.88 1 28 GLN 4.21 -0.79 1 29 GLN 4.74 -1.20 1 30 ARG 3.58 -0.93 1 31 ILE 6.06 -0.39 1 32 ASP 4.37 -0.55 1 33 GLU 3.17 -0.03 1 34 LEU 1.43 1.32 1 35 SER 5.48 -1.11 1 36 ARG 4.33 -0.71 1 37 GLU 3.36 -0.34 1 38 LEU 4.15 -0.94 1 39 GLN 4.23 -1.10 1 40 LYS 4.48 -1.02 1 41 GLU 1.99 0.23 1 42 MET 4.92 -0.85 1 43 ASP 4.43 -1.25 1 44 GLN 4.15 -1.07 1 45 LYS 5.77 -1.23 1 46 ASP 3.75 -0.37 1 47 ALA 4.02 -1.05 1 48 LEU 1.90 0.98 1 49 ASN 3.65 -0.58 1 50 LYS 4.25 -0.90 1 51 MET 3.10 -0.79 1 52 LYS 5.75 -1.16 1 53 ASP 3.36 0.06 1 54 VAL 5.99 -1.40 1 56 GLU 2.85 0.04 1 57 LYS 0.77 0.66 1 58 ASN -1.47 1.07 1 60 GLN 3.46 -1.71 1 61 MET 0.89 0.30 1 65 SER 3.94 -1.16 1 66 SER 2.54 -0.27 1 67 LEU -0.12 0.17 1 68 HIS 8.37 -0.63 1 70 LYS 2.77 -0.56 1 71 ILE 5.74 -0.36 1 72 ALA 4.33 -1.31 1 73 GLU 2.83 0.06 1 74 THR 5.96 -0.63 1 75 THR 7.13 -1.11 1 76 SER 4.78 -1.18 1 77 ASN 4.40 -1.39 1 78 ILE 5.55 -0.31 1 79 GLU 3.28 -0.44 1 80 ARG 4.51 -0.85 1 81 LEU 2.24 1.08 1 82 ARG 5.35 -0.70 1 83 MET 4.24 -0.96 1 84 GLU 2.93 0.09 1 85 ILE 6.72 -0.32 1 86 HIS 3.79 0.68 1 87 LYS 3.99 -1.10 1 89 GLU 3.48 -0.14 1 90 ALA 4.55 -1.85 1 91 TRP 2.35 -0.45 1 92 LEU 3.45 -0.56 1 93 SER 3.82 -0.71 1 94 GLU 1.69 0.12 1 95 VAL 3.00 -0.89 1 96 GLU 0.94 0.27 1 98 LYS 0.06 0.09 1 99 VAL 0.33 -0.05 1 100 SER 0.26 0.01 1 101 GLN 0.08 0.14 1 102 ARG -0.14 0.25 1 103 SER -0.11 0.08 1 104 GLU 0.17 1.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25945_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.98 _LACS_plot.Line_1_terminator_val_y_1 0.17 _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 0.05 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _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 14 ASP 0.72 -1.33 0 11 ALA -0.40 -0.69 1 12 LEU -1.13 -0.05 1 13 GLU 0.63 -0.55 1 15 PHE 4.86 -0.43 1 16 SER 4.60 -0.87 1 17 HIS 0.49 -0.20 1 18 LEU -1.31 -0.16 1 21 GLU 4.36 -0.35 1 22 GLN 2.16 -0.30 1 23 ARG 5.40 -0.86 1 24 ARG 4.66 -0.65 1 25 LYS 3.78 -0.32 1 26 ARG 4.40 -0.49 1 27 LEU 2.21 -0.18 1 28 GLN 4.21 -0.47 1 29 GLN 4.74 -0.25 1 30 ARG 3.58 -0.11 1 31 ILE 6.06 -0.71 1 32 ASP 4.37 -0.28 1 33 GLU 3.17 -0.37 1 34 LEU 1.43 -0.28 1 35 SER 5.48 -0.34 1 36 ARG 4.33 -0.21 1 37 GLU 3.36 -0.37 1 38 LEU 4.15 -0.40 1 39 GLN 4.23 -0.47 1 40 LYS 4.48 -0.21 1 41 GLU 1.99 -0.13 1 42 MET 4.92 -0.53 1 43 ASP 4.43 -0.27 1 44 GLN 4.15 -0.11 1 45 LYS 5.77 -0.55 1 46 ASP 3.75 -0.25 1 47 ALA 4.02 -0.29 1 48 LEU 1.90 -0.35 1 49 ASN 3.65 -0.33 1 50 LYS 4.25 -0.28 1 51 MET 3.10 -0.62 1 52 LYS 5.75 -0.83 1 53 ASP 3.36 -0.33 1 54 VAL 5.99 -0.54 1 55 TYR 1.64 -0.16 1 56 GLU 2.85 -0.39 1 57 LYS 0.77 -0.14 1 58 ASN -1.47 0.10 1 60 GLN 3.46 -0.23 1 61 MET 0.89 -0.32 1 63 ASP -3.98 0.17 1 65 SER 3.94 -0.87 1 66 SER 2.54 -0.23 1 67 LEU -0.12 0.04 1 68 HIS 8.37 -0.58 1 70 LYS 2.77 -0.08 1 71 ILE 5.74 -0.72 1 72 ALA 4.33 -0.22 1 73 GLU 2.83 -0.32 1 74 THR 5.96 -0.20 1 75 THR 7.13 -0.57 1 76 SER 4.78 -0.23 1 77 ASN 4.40 -0.27 1 78 ILE 5.55 -0.74 1 79 GLU 3.28 -0.39 1 80 ARG 4.51 -0.29 1 81 LEU 2.24 -0.39 1 82 ARG 5.35 -0.56 1 83 MET 4.24 -0.29 1 84 GLU 2.93 -0.38 1 85 ILE 6.72 -0.77 1 86 HIS 3.79 -0.35 1 87 LYS 3.99 -0.83 1 88 ASN 2.10 -0.14 1 89 GLU 3.48 -0.48 1 90 ALA 4.55 -0.23 1 91 TRP 2.35 -0.03 1 92 LEU 3.45 -0.31 1 93 SER 3.82 -0.22 1 94 GLU 1.69 -0.17 1 95 VAL 3.00 -0.22 1 96 GLU 0.94 -0.18 1 98 LYS 0.06 -0.01 1 99 VAL 0.33 -0.03 1 100 SER 0.26 -0.15 1 101 GLN 0.08 -0.04 1 102 ARG -0.14 0.00 1 103 SER -0.11 -0.05 1 104 GLU 0.17 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25945_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.13 _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 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 7.12 _LACS_plot.Line_2_terminator_val_y_2 2.38 _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 13 GLU 0.63 -3.03 0 11 ALA -0.40 -1.26 1 12 LEU -1.13 -0.18 1 14 ASP 0.72 -0.31 1 15 PHE 4.86 -0.63 1 16 SER 4.60 -1.25 1 17 HIS 0.49 0.42 1 21 GLU 4.36 2.01 1 22 GLN 2.16 1.07 1 23 ARG 5.40 0.57 1 24 ARG 4.66 0.35 1 25 LYS 3.78 2.00 1 26 ARG 4.40 2.74 1 27 LEU 2.21 0.36 1 28 GLN 4.21 1.70 1 29 GLN 4.74 1.71 1 30 ARG 3.58 1.40 1 31 ILE 6.06 1.63 1 32 ASP 4.37 1.83 1 33 GLU 3.17 2.96 1 34 LEU 1.43 1.16 1 35 SER 5.48 1.76 1 36 ARG 4.33 2.29 1 37 GLU 3.36 1.35 1 38 LEU 4.15 -0.35 1 39 GLN 4.23 1.01 1 40 LYS 4.48 2.80 1 41 GLU 1.99 1.91 1 42 MET 4.92 2.28 1 43 ASP 4.43 2.49 1 44 GLN 4.15 1.10 1 45 LYS 5.77 0.81 1 46 ASP 3.75 1.66 1 47 ALA 4.02 2.79 1 48 LEU 1.90 0.70 1 49 ASN 3.65 2.53 1 50 LYS 4.25 1.74 1 51 MET 3.10 -0.29 1 52 LYS 5.75 0.17 1 53 ASP 3.36 1.52 1 54 VAL 5.99 2.35 1 55 TYR 1.64 1.35 1 56 GLU 2.85 1.75 1 57 LYS 0.77 -0.65 1 60 GLN 3.46 1.11 1 61 MET 0.89 -1.54 1 65 SER 3.94 1.91 1 66 SER 2.54 0.36 1 67 LEU -0.12 -0.34 1 70 LYS 2.77 2.61 1 71 ILE 5.74 1.70 1 72 ALA 4.33 1.77 1 73 GLU 2.83 1.39 1 74 THR 5.96 1.07 1 75 THR 7.13 0.89 1 76 SER 4.78 1.76 1 77 ASN 4.40 1.50 1 78 ILE 5.55 0.06 1 79 GLU 3.28 2.04 1 80 ARG 4.51 2.18 1 81 LEU 2.24 0.89 1 82 ARG 5.35 2.28 1 83 MET 4.24 1.94 1 84 GLU 2.93 3.26 1 85 ILE 6.72 0.15 1 86 HIS 3.79 3.27 1 87 LYS 3.99 0.57 1 88 ASN 2.10 1.76 1 89 GLU 3.48 2.23 1 90 ALA 4.55 3.04 1 91 TRP 2.35 1.90 1 92 LEU 3.45 0.51 1 93 SER 3.82 1.05 1 94 GLU 1.69 1.38 1 95 VAL 3.00 0.02 1 96 GLU 0.94 0.16 1 98 LYS 0.06 -0.42 1 99 VAL 0.33 -0.68 1 100 SER 0.26 -0.89 1 101 GLN 0.08 -1.02 1 102 ARG -0.14 -0.88 1 stop_ save_