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 bmr17332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.94 _LACS_plot.Line_1_terminator_val_y_1 -1.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 8.73 _LACS_plot.Line_2_terminator_val_y_2 6.58 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 MET 4.07 5.25 0 10 THR 0.19 0.19 1 12 ALA -0.74 -0.25 1 15 ALA -0.36 -0.02 1 17 ARG 2.54 2.26 1 18 TYR -1.03 -2.05 1 19 ASP 4.60 3.55 1 20 GLN 4.88 3.49 1 21 ALA 1.59 2.50 1 22 THR 6.64 4.84 1 23 ASP 4.02 3.64 1 24 THR 6.72 5.46 1 25 ILE 5.51 5.15 1 26 LEU 5.07 3.36 1 27 THR 6.09 5.11 1 28 VAL 6.29 4.54 1 29 THR 8.74 6.95 1 30 GLU 3.82 2.71 1 31 ASN 3.51 2.09 1 32 ILE 7.21 5.61 1 33 PHE 5.10 3.91 1 34 SER 3.06 2.28 1 35 SER 0.16 0.04 1 36 MET 2.98 1.87 1 38 ASP -1.94 -2.15 1 39 ALA 3.41 3.30 1 41 GLU 1.30 0.99 1 43 VAL 5.75 4.42 1 44 ARG 4.31 4.37 1 45 GLN 3.72 2.38 1 46 ALA 4.33 2.86 1 47 ARG 4.87 3.63 1 48 ILE 5.43 4.22 1 49 LEU 3.99 2.82 1 50 ALA 3.94 2.57 1 51 GLN 3.79 2.77 1 52 ALA 3.83 2.51 1 53 THR 7.24 5.11 1 54 SER 5.06 3.78 1 55 ASP 4.40 3.27 1 56 LEU 4.21 2.70 1 57 VAL 6.90 5.44 1 58 ASN 4.29 2.99 1 59 ALA 4.15 2.89 1 60 ILE 5.32 4.51 1 61 LYS 5.33 4.44 1 62 ALA 3.90 2.51 1 63 ASP 4.23 2.76 1 64 ALA 3.37 2.66 1 65 GLU 2.27 1.88 1 67 GLU -1.21 -0.75 1 68 SER 1.36 1.18 1 69 ASP -1.67 -0.60 1 70 LEU 3.22 2.69 1 71 GLU 3.66 2.53 1 72 ASN 3.65 2.73 1 73 SER 5.54 4.44 1 74 ARG 4.75 3.89 1 75 LYS 4.42 3.79 1 76 LEU 3.24 3.05 1 77 LEU 4.31 2.99 1 78 SER 4.52 3.22 1 79 ALA 4.02 2.35 1 80 ALA 4.06 2.58 1 81 LYS 4.07 3.24 1 82 ILE 4.50 3.50 1 83 LEU 3.04 2.97 1 84 ALA 4.37 3.30 1 85 ASP 4.17 3.14 1 86 ALA 3.15 2.28 1 88 ALA 4.83 3.18 1 89 LYS 3.71 3.04 1 90 MET 3.65 2.72 1 91 VAL 6.54 5.33 1 92 GLU 3.10 2.65 1 93 ALA 3.23 2.06 1 94 ALA 4.20 2.86 1 95 LYS 4.68 3.87 1 97 ALA 2.66 1.84 1 98 ALA 1.98 1.58 1 99 ALA 0.67 0.65 1 100 HIS -0.94 -0.67 1 102 ASP -0.10 -0.84 1 103 SER -1.05 -1.90 1 104 GLU 3.71 2.95 1 105 GLU 3.61 3.03 1 106 GLN 4.30 2.27 1 107 GLN 5.34 3.62 1 108 GLN 5.29 3.21 1 109 ARG 3.79 3.17 1 110 LEU 3.64 3.10 1 111 ARG 5.54 4.59 1 112 GLU 2.94 2.65 1 113 ALA 3.13 1.96 1 114 ALA 3.89 3.18 1 115 GLU 3.61 2.71 1 117 LEU 2.84 2.59 1 118 ARG 5.83 4.60 1 119 MET 4.04 3.36 1 120 ALA 2.03 2.29 1 121 THR 7.11 5.42 1 122 ASN 3.63 3.05 1 123 ALA 3.20 2.28 1 124 ALA 3.68 2.16 1 125 ALA 2.06 1.68 1 126 GLN 2.07 1.26 1 127 ASN 0.40 0.98 1 128 ALA -0.69 -0.02 1 129 ILE 0.24 -0.08 1 130 LYS 0.25 0.04 1 131 LYS 0.81 1.42 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.94 _LACS_plot.Line_1_terminator_val_y_1 0.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 8.73 _LACS_plot.Line_2_terminator_val_y_2 -2.15 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 MET 4.07 1.18 0 10 THR 0.19 0.00 1 12 ALA -0.74 0.49 1 15 ALA -0.36 0.34 1 17 ARG 2.54 -0.28 1 18 TYR -1.03 -1.02 1 19 ASP 4.60 -1.05 1 20 GLN 4.88 -1.39 1 21 ALA 1.59 0.91 1 22 THR 6.64 -1.80 1 23 ASP 4.02 -0.38 1 24 THR 6.72 -1.26 1 25 ILE 5.51 -0.36 1 26 LEU 5.07 -1.71 1 27 THR 6.09 -0.98 1 28 VAL 6.29 -1.75 1 29 THR 8.74 -1.79 1 30 GLU 3.82 -1.11 1 31 ASN 3.51 -1.42 1 32 ILE 7.21 -1.60 1 33 PHE 5.10 -1.19 1 34 SER 3.06 -0.78 1 35 SER 0.16 -0.12 1 36 MET 2.98 -1.11 1 38 ASP -1.94 -0.21 1 39 ALA 3.41 -0.11 1 41 GLU 1.30 -0.31 1 43 VAL 5.75 -1.33 1 44 ARG 4.31 0.06 1 45 GLN 3.72 -1.34 1 46 ALA 4.33 -1.47 1 47 ARG 4.87 -1.24 1 48 ILE 5.43 -1.21 1 49 LEU 3.99 -1.17 1 50 ALA 3.94 -1.37 1 51 GLN 3.79 -1.02 1 52 ALA 3.83 -1.32 1 53 THR 7.24 -2.13 1 54 SER 5.06 -1.28 1 55 ASP 4.40 -1.13 1 56 LEU 4.21 -1.51 1 57 VAL 6.90 -1.46 1 58 ASN 4.29 -1.30 1 59 ALA 4.15 -1.26 1 60 ILE 5.32 -0.81 1 61 LYS 5.33 -0.89 1 62 ALA 3.90 -1.39 1 63 ASP 4.23 -1.47 1 64 ALA 3.37 -0.71 1 65 GLU 2.27 -0.39 1 67 GLU -1.21 0.46 1 68 SER 1.36 -0.18 1 69 ASP -1.67 1.07 1 70 LEU 3.22 -0.53 1 71 GLU 3.66 -1.13 1 72 ASN 3.65 -0.92 1 73 SER 5.54 -1.10 1 74 ARG 4.75 -0.86 1 75 LYS 4.42 -0.63 1 76 LEU 3.24 -0.19 1 77 LEU 4.31 -1.32 1 78 SER 4.52 -1.30 1 79 ALA 4.02 -1.67 1 80 ALA 4.06 -1.48 1 81 LYS 4.07 -0.83 1 82 ILE 4.50 -1.00 1 83 LEU 3.04 -0.07 1 84 ALA 4.37 -1.07 1 85 ASP 4.17 -1.03 1 86 ALA 3.15 -0.87 1 88 ALA 4.83 -1.65 1 89 LYS 3.71 -0.67 1 90 MET 3.65 -0.93 1 91 VAL 6.54 -1.21 1 92 GLU 3.10 -0.45 1 93 ALA 3.23 -1.17 1 94 ALA 4.20 -1.34 1 95 LYS 4.68 -0.81 1 97 ALA 2.66 -0.82 1 98 ALA 1.98 -0.40 1 99 ALA 0.67 -0.02 1 100 HIS -0.94 0.27 1 102 ASP -0.10 -0.74 1 103 SER -1.05 -0.85 1 104 GLU 3.71 -0.76 1 105 GLU 3.61 -0.58 1 106 GLN 4.30 -2.03 1 107 GLN 5.34 -1.72 1 108 GLN 5.29 -2.08 1 109 ARG 3.79 -0.62 1 110 LEU 3.64 -0.54 1 111 ARG 5.54 -0.95 1 112 GLU 2.94 -0.29 1 113 ALA 3.13 -1.17 1 114 ALA 3.89 -0.71 1 115 GLU 3.61 -0.90 1 117 LEU 2.84 -0.25 1 118 ARG 5.83 -1.23 1 119 MET 4.04 -0.68 1 120 ALA 2.03 0.26 1 121 THR 7.11 -1.69 1 122 ASN 3.63 -0.58 1 123 ALA 3.20 -0.92 1 124 ALA 3.68 -1.52 1 125 ALA 2.06 -0.38 1 126 GLN 2.07 -0.81 1 127 ASN 0.40 0.58 1 128 ALA -0.69 0.67 1 129 ILE 0.24 -0.32 1 130 LYS 0.25 -0.21 1 131 LYS 0.81 0.61 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.94 _LACS_plot.Line_1_terminator_val_y_1 0.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 8.73 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 TYR -1.03 0.46 0 10 THR 0.19 -0.10 1 12 ALA -0.74 -0.02 1 15 ALA -0.36 -0.09 1 17 ARG 2.54 -0.48 1 19 ASP 4.60 -0.40 1 20 GLN 4.88 -0.27 1 21 ALA 1.59 -0.14 1 22 THR 6.64 -0.62 1 23 ASP 4.02 -0.26 1 24 THR 6.72 -0.48 1 25 ILE 5.51 -0.88 1 26 LEU 5.07 -0.39 1 27 THR 6.09 -0.45 1 28 VAL 6.29 -0.48 1 29 THR 8.74 -0.78 1 30 GLU 3.82 -0.21 1 31 ASN 3.51 -0.27 1 32 ILE 7.21 -0.81 1 33 PHE 5.10 -0.56 1 34 SER 3.06 -0.12 1 35 SER 0.16 0.08 1 36 MET 2.98 -0.02 1 38 ASP -1.94 0.14 1 39 ALA 3.41 -0.46 1 41 GLU 1.30 -0.04 1 42 MET 4.07 -0.78 1 43 VAL 5.75 -0.65 1 44 ARG 4.31 -0.48 1 45 GLN 3.72 -0.44 1 46 ALA 4.33 -0.44 1 47 ARG 4.87 -0.34 1 48 ILE 5.43 -0.54 1 49 LEU 3.99 -0.52 1 50 ALA 3.94 -0.46 1 51 GLN 3.79 -0.40 1 52 ALA 3.83 -0.12 1 53 THR 7.24 -0.50 1 54 SER 5.06 -0.47 1 55 ASP 4.40 -0.25 1 56 LEU 4.21 -0.09 1 57 VAL 6.90 -0.85 1 58 ASN 4.29 -0.38 1 59 ALA 4.15 -0.15 1 60 ILE 5.32 -0.44 1 61 LYS 5.33 -0.61 1 62 ALA 3.90 -0.20 1 63 ASP 4.23 -0.25 1 64 ALA 3.37 -0.42 1 65 GLU 2.27 -0.34 1 67 GLU -1.21 -0.09 1 68 SER 1.36 -0.20 1 69 ASP -1.67 0.05 1 70 LEU 3.22 -0.29 1 71 GLU 3.66 -0.27 1 72 ASN 3.65 -0.24 1 73 SER 5.54 -0.45 1 74 ARG 4.75 -0.43 1 75 LYS 4.42 -0.34 1 76 LEU 3.24 -0.38 1 77 LEU 4.31 -0.46 1 78 SER 4.52 -0.27 1 79 ALA 4.02 -0.27 1 80 ALA 4.06 -0.48 1 81 LYS 4.07 -0.34 1 82 ILE 4.50 -0.37 1 83 LEU 3.04 -0.44 1 84 ALA 4.37 -0.40 1 85 ASP 4.17 -0.29 1 86 ALA 3.15 -0.25 1 88 ALA 4.83 -0.32 1 89 LYS 3.71 -0.30 1 90 MET 3.65 -0.30 1 91 VAL 6.54 -0.75 1 92 GLU 3.10 -0.40 1 93 ALA 3.23 -0.21 1 94 ALA 4.20 -0.47 1 95 LYS 4.68 -0.56 1 97 ALA 2.66 -0.38 1 98 ALA 1.98 -0.35 1 99 ALA 0.67 -0.35 1 100 HIS -0.94 0.03 1 102 ASP -0.10 -0.11 1 103 SER -1.05 0.10 1 104 GLU 3.71 -0.39 1 105 GLU 3.61 -0.35 1 106 GLN 4.30 -0.35 1 107 GLN 5.34 -0.47 1 108 GLN 5.29 -0.37 1 109 ARG 3.79 -0.29 1 110 LEU 3.64 -0.36 1 111 ARG 5.54 -0.36 1 112 GLU 2.94 -0.33 1 113 ALA 3.13 -0.17 1 114 ALA 3.89 -0.16 1 115 GLU 3.61 -0.21 1 117 LEU 2.84 -0.23 1 118 ARG 5.83 -0.56 1 119 MET 4.04 -0.32 1 120 ALA 2.03 -0.26 1 121 THR 7.11 -0.65 1 122 ASN 3.63 -0.31 1 123 ALA 3.20 -0.24 1 124 ALA 3.68 -0.39 1 125 ALA 2.06 -0.15 1 126 GLN 2.07 -0.23 1 127 ASN 0.40 -0.14 1 128 ALA -0.69 -0.06 1 129 ILE 0.24 -0.14 1 130 LYS 0.25 -0.07 1 131 LYS 0.81 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.94 _LACS_plot.Line_1_terminator_val_y_1 -0.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.01 _LACS_plot.Line_2_terminator_val_x_2 8.73 _LACS_plot.Line_2_terminator_val_y_2 3.45 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 ILE 7.21 0.47 0 35 SER 0.16 -1.90 0 38 ASP -1.94 -1.41 0 29 THR 8.74 1.34 0 10 THR 0.19 0.52 1 12 ALA -0.74 -0.01 1 15 ALA -0.36 0.40 1 17 ARG 2.54 0.84 1 18 TYR -1.03 1.26 1 19 ASP 4.60 1.11 1 20 GLN 4.88 2.74 1 21 ALA 1.59 2.73 1 22 THR 6.64 1.55 1 23 ASP 4.02 3.21 1 24 THR 6.72 0.79 1 25 ILE 5.51 2.34 1 26 LEU 5.07 2.24 1 27 THR 6.09 1.57 1 28 VAL 6.29 1.85 1 30 GLU 3.82 2.74 1 31 ASN 3.51 3.51 1 33 PHE 5.10 3.64 1 34 SER 3.06 0.47 1 36 MET 2.98 0.36 1 39 ALA 3.41 2.14 1 41 GLU 1.30 1.99 1 42 MET 4.07 2.09 1 43 VAL 5.75 1.63 1 44 ARG 4.31 3.64 1 45 GLN 3.72 1.94 1 46 ALA 4.33 1.18 1 47 ARG 4.87 3.38 1 48 ILE 5.43 2.55 1 49 LEU 3.99 0.63 1 50 ALA 3.94 2.40 1 51 GLN 3.79 1.16 1 52 ALA 3.83 3.84 1 53 THR 7.24 1.42 1 54 SER 5.06 1.96 1 55 ASP 4.40 2.67 1 56 LEU 4.21 0.08 1 57 VAL 6.90 1.45 1 58 ASN 4.29 2.94 1 59 ALA 4.15 1.80 1 60 ILE 5.32 2.30 1 61 LYS 5.33 2.42 1 62 ALA 3.90 3.37 1 63 ASP 4.23 3.07 1 64 ALA 3.37 2.56 1 65 GLU 2.27 1.10 1 67 GLU -1.21 -0.58 1 68 SER 1.36 -0.02 1 69 ASP -1.67 -0.16 1 70 LEU 3.22 1.74 1 71 GLU 3.66 3.74 1 72 ASN 3.65 2.86 1 73 SER 5.54 1.44 1 74 ARG 4.75 3.30 1 75 LYS 4.42 3.28 1 76 LEU 3.24 0.74 1 77 LEU 4.31 3.09 1 78 SER 4.52 1.60 1 79 ALA 4.02 2.57 1 80 ALA 4.06 0.73 1 81 LYS 4.07 1.75 1 82 ILE 4.50 3.20 1 83 LEU 3.04 1.22 1 84 ALA 4.37 3.25 1 85 ASP 4.17 2.49 1 86 ALA 3.15 3.92 1 88 ALA 4.83 2.87 1 89 LYS 3.71 2.69 1 90 MET 3.65 0.61 1 91 VAL 6.54 1.87 1 92 GLU 3.10 2.96 1 93 ALA 3.23 2.15 1 94 ALA 4.20 0.98 1 95 LYS 4.68 3.60 1 97 ALA 2.66 0.75 1 98 ALA 1.98 1.19 1 99 ALA 0.67 -0.19 1 102 ASP -0.10 -0.38 1 103 SER -1.05 1.30 1 104 GLU 3.71 2.27 1 105 GLU 3.61 2.76 1 106 GLN 4.30 3.37 1 107 GLN 5.34 2.58 1 108 GLN 5.29 2.43 1 109 ARG 3.79 3.29 1 110 LEU 3.64 0.27 1 111 ARG 5.54 3.10 1 112 GLU 2.94 3.35 1 113 ALA 3.13 3.16 1 114 ALA 3.89 1.52 1 115 GLU 3.61 3.04 1 117 LEU 2.84 1.54 1 118 ARG 5.83 2.47 1 119 MET 4.04 2.89 1 120 ALA 2.03 2.12 1 121 THR 7.11 1.34 1 122 ASN 3.63 2.32 1 123 ALA 3.20 2.08 1 124 ALA 3.68 0.62 1 125 ALA 2.06 1.76 1 126 GLN 2.07 0.87 1 127 ASN 0.40 -0.71 1 128 ALA -0.69 -0.91 1 129 ILE 0.24 -0.50 1 130 LYS 0.25 -1.30 1 stop_ save_