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 bmr19314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.31 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _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 -1.72 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 5.32 _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 46 HIS -0.36 3.45 0 10 HIS -0.71 1.22 1 11 MET -1.20 -2.06 1 13 LYS 1.22 0.83 1 14 ALA 1.83 1.14 1 15 THR 2.99 2.09 1 16 ALA 3.23 2.29 1 17 GLN 3.77 2.80 1 18 MET 4.08 3.99 1 19 GLU 4.42 3.59 1 20 GLU 3.56 2.91 1 21 LYS 2.55 2.99 1 22 LEU 2.24 2.88 1 23 ARG 5.23 4.03 1 24 ASP 3.93 3.10 1 25 PHE 3.06 3.60 1 26 THR 5.14 3.82 1 27 ARG 3.00 2.21 1 28 ALA 2.91 1.54 1 29 TYR -2.00 -1.59 1 30 GLU 2.57 0.77 1 32 ASP 2.13 1.54 1 33 SER 0.14 0.86 1 34 VAL -4.45 -2.74 1 35 LEU 1.04 0.28 1 37 LEU 0.89 -0.50 1 41 VAL 5.06 3.84 1 42 LEU 4.18 2.65 1 43 SER 4.21 3.21 1 44 PHE 4.32 3.20 1 45 ILE 5.61 5.37 1 47 HIS 5.10 5.76 1 48 GLN 3.20 3.09 1 49 ILE 5.56 4.46 1 50 ILE 5.38 0.84 1 51 GLU 3.83 2.78 1 52 LEU 4.16 2.73 1 53 ALA 3.10 2.98 1 54 ARG 4.81 4.03 1 55 ASP 2.49 3.39 1 57 LEU 4.03 3.28 1 58 THR 6.01 4.69 1 59 LYS 4.30 3.24 1 60 SER 4.22 3.37 1 61 ARG 4.00 2.82 1 62 ASP 0.46 0.24 1 64 LEU -2.27 -1.41 1 65 ILE 3.16 0.94 1 66 THR -5.31 -2.66 1 67 THR 5.99 4.58 1 68 VAL 4.24 3.11 1 69 TYR 4.19 3.45 1 70 PHE 4.65 3.62 1 71 TYR 4.40 3.00 1 72 GLU 3.51 2.56 1 73 LEU 4.01 2.68 1 74 GLN 6.02 4.18 1 75 GLU 3.31 2.75 1 76 ASN 3.15 2.49 1 77 LEU 4.20 2.79 1 78 GLU 3.93 3.03 1 79 LYS 4.33 3.03 1 80 LEU 4.07 2.68 1 81 LEU 3.54 2.74 1 82 GLN 4.53 2.90 1 83 ASP 4.10 2.95 1 84 ALA 3.63 2.31 1 85 TYR 2.43 1.37 1 86 GLU 0.55 0.57 1 88 SER 0.55 0.25 1 91 LEU 3.82 2.66 1 92 GLU 4.25 3.08 1 93 VAL 5.50 4.69 1 94 ALA 4.29 2.75 1 95 PHE 4.03 3.22 1 96 VAL 5.81 4.62 1 97 THR 5.66 4.42 1 98 GLN 4.63 2.91 1 99 LEU 3.50 3.01 1 100 VAL 6.94 5.24 1 101 LYS 4.89 3.82 1 102 LYS 3.38 3.35 1 103 LEU 4.15 2.05 1 104 LEU 3.59 2.61 1 105 ILE 4.26 3.31 1 106 ILE 5.45 4.75 1 107 ILE 1.76 0.92 1 108 SER 0.89 0.67 1 109 ARG 0.45 -0.08 1 111 ALA -0.23 -0.25 1 112 ARG 0.86 1.25 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.31 _LACS_plot.Line_1_terminator_val_y_1 2.22 _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 0.28 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 -1.61 _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 46 HIS -0.36 3.81 0 10 HIS -0.71 1.93 1 11 MET -1.20 -0.86 1 13 LYS 1.22 -0.39 1 14 ALA 1.83 -0.69 1 15 THR 2.99 -0.90 1 16 ALA 3.23 -0.94 1 17 GLN 3.77 -0.97 1 18 MET 4.08 -0.09 1 19 GLU 4.42 -0.83 1 20 GLU 3.56 -0.65 1 21 LYS 2.55 0.44 1 22 LEU 2.24 0.64 1 23 ARG 5.23 -1.20 1 24 ASP 3.93 -0.83 1 25 PHE 3.06 0.54 1 26 THR 5.14 -1.32 1 27 ARG 3.00 -0.79 1 28 ALA 2.91 -1.37 1 29 TYR -2.00 0.41 1 30 GLU 2.57 -1.80 1 32 ASP 2.13 -0.59 1 33 SER 0.14 0.72 1 34 VAL -4.45 1.71 1 35 LEU 1.04 -0.76 1 37 LEU 0.89 -1.39 1 41 VAL 5.06 -1.22 1 42 LEU 4.18 -1.53 1 43 SER 4.21 -1.00 1 44 PHE 4.32 -1.12 1 45 ILE 5.61 -0.24 1 47 HIS 5.10 0.66 1 48 GLN 3.20 -0.11 1 49 ILE 5.56 -1.10 1 50 ILE 5.38 -4.54 1 51 GLU 3.83 -1.05 1 52 LEU 4.16 -1.43 1 53 ALA 3.10 -0.12 1 54 ARG 4.81 -0.78 1 55 ASP 2.49 0.90 1 57 LEU 4.03 -0.75 1 58 THR 6.01 -1.32 1 59 LYS 4.30 -1.06 1 60 SER 4.22 -0.85 1 61 ARG 4.00 -1.18 1 62 ASP 0.46 -0.22 1 64 LEU -2.27 0.86 1 65 ILE 3.16 -2.22 1 66 THR -5.31 2.65 1 67 THR 5.99 -1.41 1 68 VAL 4.24 -1.13 1 69 TYR 4.19 -0.74 1 70 PHE 4.65 -1.03 1 71 TYR 4.40 -1.40 1 72 GLU 3.51 -0.95 1 73 LEU 4.01 -1.33 1 74 GLN 6.02 -1.84 1 75 GLU 3.31 -0.56 1 76 ASN 3.15 -0.66 1 77 LEU 4.20 -1.41 1 78 GLU 3.93 -0.90 1 79 LYS 4.33 -1.30 1 80 LEU 4.07 -1.39 1 81 LEU 3.54 -0.80 1 82 GLN 4.53 -1.63 1 83 ASP 4.10 -1.15 1 84 ALA 3.63 -1.32 1 85 TYR 2.43 -1.06 1 86 GLU 0.55 0.02 1 88 SER 0.55 -0.30 1 91 LEU 3.82 -1.16 1 92 GLU 4.25 -1.17 1 93 VAL 5.50 -0.81 1 94 ALA 4.29 -1.54 1 95 PHE 4.03 -0.81 1 96 VAL 5.81 -1.19 1 97 THR 5.66 -1.24 1 98 GLN 4.63 -1.72 1 99 LEU 3.50 -0.49 1 100 VAL 6.94 -1.70 1 101 LYS 4.89 -1.07 1 102 LYS 3.38 -0.03 1 103 LEU 4.15 -2.10 1 104 LEU 3.59 -0.98 1 105 ILE 4.26 -0.95 1 106 ILE 5.45 -0.70 1 107 ILE 1.76 -0.84 1 108 SER 0.89 -0.22 1 109 ARG 0.45 -0.53 1 111 ALA -0.23 -0.02 1 112 ARG 0.86 0.39 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.31 _LACS_plot.Line_1_terminator_val_y_1 0.44 _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 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 TYR -2.00 -0.43 0 66 THR -5.31 0.58 0 10 HIS -0.71 -0.11 1 11 MET -1.20 0.24 1 13 LYS 1.22 -0.06 1 14 ALA 1.83 0.04 1 15 THR 2.99 -0.16 1 16 ALA 3.23 -0.16 1 17 GLN 3.77 -0.15 1 18 MET 4.08 -0.47 1 19 GLU 4.42 -0.54 1 20 GLU 3.56 -0.38 1 21 LYS 2.55 -0.10 1 22 LEU 2.24 -0.20 1 23 ARG 5.23 -0.39 1 24 ASP 3.93 -0.26 1 25 PHE 3.06 -0.30 1 26 THR 5.14 -0.50 1 27 ARG 3.00 -0.21 1 28 ALA 2.91 -0.45 1 30 GLU 2.57 -0.27 1 32 ASP 2.13 -0.06 1 33 SER 0.14 0.05 1 34 VAL -4.45 0.42 1 35 LEU 1.04 -0.24 1 37 LEU 0.89 -0.07 1 41 VAL 5.06 -0.17 1 42 LEU 4.18 -0.20 1 43 SER 4.21 -0.07 1 44 PHE 4.32 -0.13 1 45 ILE 5.61 -0.65 1 46 HIS -0.36 -0.46 1 47 HIS 5.10 -0.98 1 48 GLN 3.20 -0.45 1 49 ILE 5.56 -0.68 1 50 ILE 5.38 -0.24 1 51 GLU 3.83 -0.28 1 52 LEU 4.16 -0.21 1 53 ALA 3.10 -0.38 1 54 ARG 4.81 -0.42 1 55 ASP 2.49 -0.27 1 57 LEU 4.03 -0.38 1 58 THR 6.01 -0.60 1 59 LYS 4.30 -0.54 1 60 SER 4.22 -0.43 1 61 ARG 4.00 -0.29 1 62 ASP 0.46 0.05 1 64 LEU -2.27 0.11 1 65 ILE 3.16 -0.62 1 67 THR 5.99 -0.26 1 68 VAL 4.24 -0.18 1 69 TYR 4.19 -0.35 1 70 PHE 4.65 -0.44 1 71 TYR 4.40 -0.28 1 72 GLU 3.51 -0.42 1 73 LEU 4.01 -0.29 1 74 GLN 6.02 -0.69 1 75 GLU 3.31 -0.39 1 76 ASN 3.15 -0.26 1 77 LEU 4.20 -0.39 1 78 GLU 3.93 -0.43 1 79 LYS 4.33 -0.21 1 80 LEU 4.07 -0.24 1 81 LEU 3.54 -0.60 1 82 GLN 4.53 -0.29 1 83 ASP 4.10 -0.37 1 84 ALA 3.63 -0.48 1 85 TYR 2.43 -0.14 1 86 GLU 0.55 -0.08 1 88 SER 0.55 -0.10 1 91 LEU 3.82 -0.06 1 92 GLU 4.25 -0.43 1 93 VAL 5.50 -0.65 1 94 ALA 4.29 -0.22 1 95 PHE 4.03 -0.35 1 96 VAL 5.81 -0.94 1 97 THR 5.66 -0.67 1 98 GLN 4.63 -0.36 1 99 LEU 3.50 -0.64 1 100 VAL 6.94 -0.78 1 101 LYS 4.89 -0.44 1 102 LYS 3.38 -0.37 1 103 LEU 4.15 -0.69 1 104 LEU 3.59 -0.50 1 105 ILE 4.26 -0.49 1 106 ILE 5.45 -0.60 1 107 ILE 1.76 0.11 1 108 SER 0.89 -0.21 1 109 ARG 0.45 -0.18 1 111 ALA -0.23 -0.06 1 112 ARG 0.86 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19314_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.45 _LACS_plot.Line_1_terminator_val_y_1 -1.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.49 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 2.78 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 VAL -4.45 -1.33 0 15 THR 2.99 0.47 1 16 ALA 3.23 2.52 1 17 GLN 3.77 1.94 1 18 MET 4.08 2.01 1 19 GLU 4.42 1.94 1 20 GLU 3.56 2.15 1 21 LYS 2.55 4.61 1 22 LEU 2.24 1.69 1 23 ARG 5.23 2.52 1 24 ASP 3.93 1.86 1 25 PHE 3.06 0.63 1 26 THR 5.14 1.13 1 27 ARG 3.00 2.13 1 28 ALA 2.91 1.62 1 29 TYR -2.00 -1.28 1 32 ASP 2.13 0.99 1 33 SER 0.14 -0.80 1 37 LEU 0.89 1.68 1 41 VAL 5.06 2.13 1 42 LEU 4.18 1.28 1 43 SER 4.21 2.56 1 44 PHE 4.32 2.16 1 45 ILE 5.61 0.77 1 46 HIS -0.36 2.72 1 47 HIS 5.10 4.09 1 48 GLN 3.20 2.51 1 49 ILE 5.56 1.03 1 50 ILE 5.38 1.68 1 51 GLU 3.83 3.36 1 52 LEU 4.16 2.07 1 53 ALA 3.10 1.55 1 54 ARG 4.81 1.05 1 55 ASP 2.49 0.48 1 57 LEU 4.03 0.47 1 58 THR 6.01 1.34 1 59 LYS 4.30 2.42 1 60 SER 4.22 4.14 1 61 ARG 4.00 2.26 1 62 ASP 0.46 0.18 1 64 LEU -2.27 -0.89 1 65 ILE 3.16 -1.13 1 67 THR 5.99 1.89 1 68 VAL 4.24 0.82 1 69 TYR 4.19 1.96 1 70 PHE 4.65 2.49 1 71 TYR 4.40 2.54 1 72 GLU 3.51 2.27 1 73 LEU 4.01 0.81 1 74 GLN 6.02 1.70 1 75 GLU 3.31 2.78 1 76 ASN 3.15 3.29 1 77 LEU 4.20 0.49 1 78 GLU 3.93 2.99 1 79 LYS 4.33 1.81 1 80 LEU 4.07 1.33 1 81 LEU 3.54 -0.10 1 82 GLN 4.53 3.24 1 83 ASP 4.10 3.32 1 84 ALA 3.63 1.03 1 85 TYR 2.43 1.86 1 86 GLU 0.55 0.96 1 88 SER 0.55 -0.35 1 93 VAL 5.50 2.76 1 94 ALA 4.29 1.10 1 95 PHE 4.03 1.24 1 96 VAL 5.81 1.95 1 97 THR 5.66 2.27 1 98 GLN 4.63 2.27 1 99 LEU 3.50 1.14 1 100 VAL 6.94 1.33 1 101 LYS 4.89 3.02 1 102 LYS 3.38 2.59 1 103 LEU 4.15 0.50 1 104 LEU 3.59 2.28 1 105 ILE 4.26 2.73 1 106 ILE 5.45 1.53 1 107 ILE 1.76 -1.16 1 108 SER 0.89 -0.51 1 109 ARG 0.45 -0.80 1 111 ALA -0.23 -0.96 1 stop_ save_