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 bmr18713_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.26 _LACS_plot.Line_1_terminator_val_y_1 -2.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _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 8.19 _LACS_plot.Line_2_terminator_val_y_2 6.24 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 LYS 4.84 0.39 0 10 LEU 3.30 2.58 1 11 VAL 6.11 4.73 1 12 LYS 3.73 2.75 1 13 GLU 3.18 3.05 1 14 VAL 5.67 4.02 1 15 THR 6.40 5.19 1 16 ASP 4.43 3.21 1 17 GLU 3.50 2.45 1 18 PHE 2.74 3.02 1 19 THR 2.43 2.08 1 20 THR 2.60 2.05 1 21 LYS 1.25 0.98 1 22 ASP 0.68 -0.43 1 23 GLN 2.18 1.83 1 24 ASP 0.17 0.36 1 25 LEU -1.16 -0.04 1 26 ARG -4.26 -1.99 1 27 TRP -2.14 -1.39 1 28 GLN -2.28 1.15 1 29 SER 5.75 4.88 1 30 MET 3.14 2.36 1 31 ALA 3.44 2.93 1 32 ILE 4.87 2.19 1 33 MET 3.13 2.27 1 34 ALA 4.84 2.79 1 35 LEU 2.47 2.78 1 36 GLN 5.70 4.45 1 37 GLU 4.83 3.05 1 38 ALA 2.10 2.05 1 39 SER 3.47 4.25 1 40 GLU 5.04 3.29 1 41 ALA 3.38 2.43 1 42 TYR 2.80 2.45 1 43 LEU 2.84 2.43 1 44 VAL 6.60 4.95 1 46 LEU 2.36 2.31 1 47 LEU 2.40 1.85 1 48 GLU 0.74 0.85 1 49 HIS -0.12 0.76 1 50 THR -0.47 0.08 1 51 ASN 0.20 -0.23 1 52 LEU 1.94 1.78 1 53 LEU 1.54 0.91 1 54 ALA 1.03 0.75 1 55 LEU 0.37 0.32 1 56 HIS 0.17 0.42 1 57 LEU 0.24 0.31 1 58 VAL -0.39 -0.28 1 60 ARG 0.64 0.46 1 62 SER 0.15 0.45 1 63 LYS 0.19 -0.08 1 64 ARG 0.30 0.35 1 65 ILE 0.05 0.07 1 66 SER -0.03 0.28 1 68 LEU -0.00 0.31 1 70 TYR 4.30 3.75 1 71 GLU 4.34 3.52 1 72 GLU 1.77 1.75 1 73 VAL 4.61 3.25 1 74 ARG 4.78 3.95 1 75 ALA 3.82 3.04 1 76 VAL 3.83 2.75 1 77 LEU 1.54 2.15 1 78 LYS 5.80 5.15 1 79 SER 4.70 3.95 1 80 PHE 3.10 2.95 1 81 LEU 2.20 2.55 1 82 GLU 4.57 3.95 1 83 SER 3.90 2.85 1 84 VAL 4.42 3.55 1 85 ILE 8.20 5.61 1 86 ARG 5.23 3.98 1 87 ASP 3.52 2.94 1 88 SER -1.38 -1.13 1 89 VAL 5.45 3.79 1 90 THR 6.33 4.75 1 91 TYR 5.34 4.57 1 92 THR 6.20 5.59 1 93 GLU 2.70 1.69 1 94 HIS 4.14 3.25 1 95 ALA -0.36 -0.75 1 97 ARG -5.26 -0.99 1 98 LYS -2.19 -1.70 1 99 THR -1.67 -1.29 1 100 VAL 0.36 -0.25 1 101 THR -4.56 -1.81 1 102 SER 5.50 3.55 1 103 LEU 3.50 2.53 1 104 ASP 3.99 3.94 1 105 VAL 4.40 3.07 1 106 VAL 6.37 5.24 1 107 TYR 4.84 2.25 1 108 ALA 1.62 3.17 1 109 LEU 3.74 2.77 1 110 LYS 3.70 2.65 1 111 ARG 3.24 2.15 1 112 GLN 0.49 -0.15 1 114 ARG 1.34 1.95 1 115 THR -0.23 0.02 1 116 LEU -1.22 -0.34 1 117 TYR 0.19 0.24 1 119 PHE -0.09 0.36 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18713_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.26 _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 -1.00 _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 8.19 _LACS_plot.Line_2_terminator_val_y_2 -1.95 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 LYS 4.84 -4.45 0 10 LEU 3.30 -0.72 1 11 VAL 6.11 -1.38 1 12 LYS 3.73 -0.98 1 13 GLU 3.18 -0.13 1 14 VAL 5.67 -1.65 1 15 THR 6.40 -1.21 1 16 ASP 4.43 -1.22 1 17 GLU 3.50 -1.05 1 18 PHE 2.74 0.28 1 19 THR 2.43 -0.35 1 20 THR 2.60 -0.55 1 21 LYS 1.25 -0.27 1 22 ASP 0.68 -1.11 1 23 GLN 2.18 -0.35 1 24 ASP 0.17 0.19 1 25 LEU -1.16 1.12 1 26 ARG -4.26 2.27 1 27 TRP -2.14 0.75 1 28 GLN -2.28 3.43 1 29 SER 5.75 -0.87 1 30 MET 3.14 -0.78 1 31 ALA 3.44 -0.51 1 32 ILE 4.87 -2.68 1 33 MET 3.13 -0.86 1 34 ALA 4.84 -2.05 1 35 LEU 2.47 0.31 1 36 GLN 5.70 -1.25 1 37 GLU 4.83 -1.78 1 38 ALA 2.10 -0.05 1 39 SER 3.47 0.78 1 40 GLU 5.04 -1.75 1 41 ALA 3.38 -0.95 1 42 TYR 2.80 -0.35 1 43 LEU 2.84 -0.41 1 44 VAL 6.60 -1.65 1 46 LEU 2.36 -0.05 1 47 LEU 2.40 -0.55 1 48 GLU 0.74 0.11 1 49 HIS -0.12 0.88 1 50 THR -0.47 0.55 1 51 ASN 0.20 -0.43 1 52 LEU 1.94 -0.16 1 53 LEU 1.54 -0.63 1 54 ALA 1.03 -0.28 1 55 LEU 0.37 -0.05 1 56 HIS 0.17 0.25 1 57 LEU 0.24 0.07 1 58 VAL -0.39 0.11 1 60 ARG 0.64 -0.18 1 62 SER 0.15 0.30 1 63 LYS 0.19 -0.27 1 64 ARG 0.30 0.05 1 65 ILE 0.05 0.02 1 66 SER -0.03 0.31 1 68 LEU -0.00 0.31 1 70 TYR 4.30 -0.55 1 71 GLU 4.34 -0.82 1 72 GLU 1.77 -0.02 1 73 VAL 4.61 -1.36 1 74 ARG 4.78 -0.83 1 75 ALA 3.82 -0.78 1 76 VAL 3.83 -1.08 1 77 LEU 1.54 0.61 1 78 LYS 5.80 -0.65 1 79 SER 4.70 -0.75 1 80 PHE 3.10 -0.15 1 81 LEU 2.20 0.35 1 82 GLU 4.57 -0.62 1 83 SER 3.90 -1.05 1 84 VAL 4.42 -0.87 1 85 ILE 8.20 -2.59 1 86 ARG 5.23 -1.25 1 87 ASP 3.52 -0.58 1 88 SER -1.38 0.25 1 89 VAL 5.45 -1.66 1 90 THR 6.33 -1.58 1 91 TYR 5.34 -0.77 1 92 THR 6.20 -0.61 1 93 GLU 2.70 -1.01 1 94 HIS 4.14 -0.89 1 95 ALA -0.36 -0.39 1 97 ARG -5.26 4.27 1 98 LYS -2.19 0.49 1 99 THR -1.67 0.38 1 100 VAL 0.36 -0.61 1 101 THR -4.56 2.75 1 102 SER 5.50 -1.95 1 103 LEU 3.50 -0.97 1 104 ASP 3.99 -0.05 1 105 VAL 4.40 -1.33 1 106 VAL 6.37 -1.13 1 107 TYR 4.84 -2.59 1 108 ALA 1.62 1.55 1 109 LEU 3.74 -0.97 1 110 LYS 3.70 -1.05 1 111 ARG 3.24 -1.09 1 112 GLN 0.49 -0.64 1 114 ARG 1.34 0.61 1 115 THR -0.23 0.25 1 116 LEU -1.22 0.88 1 117 TYR 0.19 0.05 1 119 PHE -0.09 0.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18713_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.26 _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 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _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 81 LEU 2.20 -0.78 0 10 LEU 3.30 -0.11 1 11 VAL 6.11 -0.70 1 12 LYS 3.73 -0.32 1 13 GLU 3.18 -0.27 1 14 VAL 5.67 -0.11 1 15 THR 6.40 -0.58 1 16 ASP 4.43 -0.10 1 17 GLU 3.50 -0.26 1 18 PHE 2.74 -0.22 1 19 THR 2.43 0.16 1 20 THR 2.60 -0.09 1 21 LYS 1.25 -0.03 1 22 ASP 0.68 0.09 1 23 GLN 2.18 0.08 1 24 ASP 0.17 0.02 1 25 LEU -1.16 0.26 1 26 ARG -4.26 0.45 1 27 TRP -2.14 -0.05 1 28 GLN -2.28 -0.18 1 29 SER 5.75 -0.19 1 30 MET 3.14 -0.05 1 31 ALA 3.44 -0.31 1 32 ILE 4.87 -0.48 1 33 MET 3.13 -0.21 1 34 ALA 4.84 -0.38 1 35 LEU 2.47 -0.40 1 36 GLN 5.70 -0.62 1 37 GLU 4.83 -0.31 1 38 ALA 2.10 -0.09 1 39 SER 3.47 -0.31 1 40 GLU 5.04 -0.81 1 41 ALA 3.38 -0.31 1 42 TYR 2.80 -0.58 1 43 LEU 2.84 -0.53 1 44 VAL 6.60 -0.67 1 46 LEU 2.36 -0.34 1 47 LEU 2.40 -0.17 1 48 GLU 0.74 -0.21 1 49 HIS -0.12 0.15 1 50 THR -0.47 0.22 1 51 ASN 0.20 0.13 1 52 LEU 1.94 -0.20 1 53 LEU 1.54 -0.09 1 54 ALA 1.03 -0.10 1 55 LEU 0.37 -0.11 1 56 HIS 0.17 -0.06 1 57 LEU 0.24 0.07 1 58 VAL -0.39 0.05 1 60 ARG 0.64 -0.01 1 62 SER 0.15 0.00 1 63 LYS 0.19 0.05 1 64 ARG 0.30 0.05 1 65 ILE 0.05 0.08 1 66 SER -0.03 0.04 1 68 LEU -0.00 0.15 1 70 TYR 4.30 -0.51 1 71 GLU 4.34 -0.18 1 72 GLU 1.77 -0.18 1 73 VAL 4.61 -0.36 1 74 ARG 4.78 -0.69 1 75 ALA 3.82 -0.16 1 76 VAL 3.83 0.00 1 77 LEU 1.54 0.08 1 78 LYS 5.80 -0.41 1 79 SER 4.70 -0.20 1 80 PHE 3.10 -0.37 1 82 GLU 4.57 -0.56 1 83 SER 3.90 -0.30 1 84 VAL 4.42 -0.46 1 85 ILE 8.20 -0.63 1 86 ARG 5.23 -0.54 1 87 ASP 3.52 -0.10 1 88 SER -1.38 -0.30 1 89 VAL 5.45 -0.51 1 90 THR 6.33 -0.34 1 91 TYR 5.34 -0.39 1 92 THR 6.20 -0.67 1 93 GLU 2.70 -0.11 1 94 HIS 4.14 -0.27 1 95 ALA -0.36 0.01 1 96 LYS 4.84 -0.36 1 97 ARG -5.26 0.31 1 98 LYS -2.19 0.09 1 99 THR -1.67 0.42 1 100 VAL 0.36 -0.13 1 101 THR -4.56 0.45 1 102 SER 5.50 -0.56 1 103 LEU 3.50 -0.38 1 104 ASP 3.99 -0.40 1 105 VAL 4.40 -0.09 1 106 VAL 6.37 -0.61 1 107 TYR 4.84 -0.44 1 108 ALA 1.62 -0.30 1 109 LEU 3.74 -0.45 1 110 LYS 3.70 -0.16 1 111 ARG 3.24 -0.20 1 112 GLN 0.49 0.09 1 114 ARG 1.34 0.23 1 115 THR -0.23 -0.09 1 116 LEU -1.22 0.08 1 117 TYR 0.19 0.00 1 119 PHE -0.09 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18713_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.26 _LACS_plot.Line_1_terminator_val_y_1 -2.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 2.92 _LACS_plot.Y_axis_chem_shift_offset 0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 101 THR -4.56 1.76 0 10 LEU 3.30 0.18 1 11 VAL 6.11 1.53 1 12 LYS 3.73 0.19 1 13 GLU 3.18 2.68 1 14 VAL 5.67 2.05 1 15 THR 6.40 3.49 1 16 ASP 4.43 2.15 1 17 GLU 3.50 1.62 1 18 PHE 2.74 1.33 1 19 THR 2.43 0.46 1 20 THR 2.60 0.58 1 21 LYS 1.25 -0.53 1 22 ASP 0.68 -1.22 1 23 GLN 2.18 -0.14 1 24 ASP 0.17 -1.46 1 25 LEU -1.16 -1.05 1 26 ARG -4.26 -2.26 1 27 TRP -2.14 0.18 1 28 GLN -2.28 0.28 1 30 MET 3.14 2.15 1 31 ALA 3.44 0.29 1 32 ILE 4.87 2.01 1 33 MET 3.13 1.67 1 34 ALA 4.84 1.88 1 35 LEU 2.47 2.03 1 36 GLN 5.70 1.85 1 37 GLU 4.83 2.59 1 38 ALA 2.10 1.94 1 39 SER 3.47 -0.11 1 40 GLU 5.04 0.48 1 41 ALA 3.38 2.57 1 42 TYR 2.80 1.32 1 43 LEU 2.84 0.19 1 44 VAL 6.60 1.66 1 46 LEU 2.36 1.92 1 47 LEU 2.40 0.61 1 48 GLU 0.74 0.52 1 49 HIS -0.12 -0.03 1 50 THR -0.47 -1.31 1 51 ASN 0.20 0.24 1 52 LEU 1.94 -0.16 1 53 LEU 1.54 -0.24 1 54 ALA 1.03 -0.18 1 55 LEU 0.37 -0.86 1 56 HIS 0.17 0.05 1 57 LEU 0.24 -1.84 1 58 VAL -0.39 -1.02 1 60 ARG 0.64 0.32 1 62 SER 0.15 -0.33 1 63 LYS 0.19 -0.65 1 64 ARG 0.30 -0.75 1 65 ILE 0.05 -0.52 1 66 SER -0.03 -0.11 1 68 LEU -0.00 -0.15 1 72 GLU 1.77 1.49 1 73 VAL 4.61 0.32 1 74 ARG 4.78 0.56 1 75 ALA 3.82 2.58 1 76 VAL 3.83 2.04 1 77 LEU 1.54 0.33 1 78 LYS 5.80 0.72 1 79 SER 4.70 2.72 1 80 PHE 3.10 0.68 1 81 LEU 2.20 0.68 1 82 GLU 4.57 1.27 1 83 SER 3.90 3.23 1 84 VAL 4.42 2.97 1 85 ILE 8.20 0.15 1 86 ARG 5.23 2.62 1 87 ASP 3.52 1.75 1 88 SER -1.38 0.75 1 89 VAL 5.45 1.14 1 90 THR 6.33 2.71 1 91 TYR 5.34 2.28 1 92 THR 6.20 1.18 1 93 GLU 2.70 4.74 1 94 HIS 4.14 1.29 1 95 ALA -0.36 -2.42 1 96 LYS 4.84 -1.58 1 97 ARG -5.26 -1.05 1 98 LYS -2.19 -2.28 1 99 THR -1.67 -2.53 1 100 VAL 0.36 -0.61 1 102 SER 5.50 0.61 1 103 LEU 3.50 0.18 1 104 ASP 3.99 0.93 1 105 VAL 4.40 1.25 1 106 VAL 6.37 2.22 1 107 TYR 4.84 2.05 1 108 ALA 1.62 2.55 1 109 LEU 3.74 1.69 1 110 LYS 3.70 2.87 1 111 ARG 3.24 0.94 1 112 GLN 0.49 0.06 1 114 ARG 1.34 -0.81 1 115 THR -0.23 -1.24 1 116 LEU -1.22 -1.77 1 117 TYR 0.19 -0.07 1 119 PHE -0.09 -0.52 1 stop_ save_