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 bmr11296_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 -2.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 9.21 _LACS_plot.Line_2_terminator_val_y_2 7.42 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 LEU 9.22 5.15 0 117 LYS 4.39 1.06 0 10 ASP 0.14 0.15 1 11 TRP -3.73 -2.75 1 12 VAL 1.69 1.59 1 15 SER 4.23 2.98 1 16 GLU 3.12 3.27 1 17 VAL 6.54 4.90 1 18 GLU 3.72 3.38 1 19 VAL 5.96 4.40 1 20 LEU 3.37 3.38 1 21 GLU 3.31 3.46 1 22 SER 2.40 2.39 1 23 ILE 1.35 2.70 1 24 TYR -0.25 1.10 1 25 LEU 3.68 0.93 1 26 ASP 2.51 1.56 1 27 GLU 0.89 1.13 1 28 LEU -3.60 -0.86 1 29 GLN -2.34 -1.23 1 30 VAL -3.44 -1.46 1 31 ILE 0.13 -0.81 1 32 LYS 0.79 0.39 1 34 ASN 0.18 -0.58 1 36 ARG 0.85 0.28 1 37 THR 0.53 0.13 1 38 SER -0.37 0.14 1 40 TRP -2.67 -1.43 1 41 GLU -4.83 -1.23 1 42 ILE -3.97 -1.34 1 43 TYR -5.31 -2.45 1 44 ILE -3.01 -0.96 1 45 THR 2.29 1.31 1 46 LEU -3.39 -1.94 1 47 HIS -1.52 -0.31 1 49 ALA 0.79 0.59 1 50 THR -1.18 -0.78 1 51 ALA -0.66 -0.02 1 52 GLU 0.38 0.54 1 53 ASP 0.11 0.07 1 54 GLN 0.90 0.82 1 55 ASP 0.65 0.77 1 56 SER 0.89 0.85 1 57 GLN 0.45 0.13 1 58 TYR 0.83 1.02 1 59 VAL -2.34 -1.41 1 61 PHE -0.60 0.20 1 62 THR 0.68 0.44 1 63 LEU -1.92 -0.87 1 64 VAL -0.19 -1.00 1 65 LEU -4.16 -2.86 1 66 GLN -1.46 -0.97 1 67 VAL 0.30 0.77 1 69 ALA 2.78 2.26 1 70 GLU 1.23 0.89 1 71 TYR -1.27 1.79 1 73 HIS 1.46 2.31 1 74 GLU -6.03 -2.08 1 75 VAL 1.94 0.41 1 77 GLN -0.11 -0.08 1 78 ILE -1.00 0.15 1 79 SER -2.69 -0.89 1 80 ILE -3.37 -1.52 1 81 ARG -5.98 -2.29 1 82 ASN 2.84 2.63 1 84 ARG -2.23 0.00 1 86 LEU -5.65 -2.26 1 87 SER -3.63 -1.73 1 88 ASP 4.89 3.74 1 89 GLU 3.99 3.37 1 90 GLN 3.18 3.58 1 91 ILE 5.61 4.68 1 92 HIS 4.33 5.15 1 93 THR 6.58 5.48 1 94 ILE 6.14 5.23 1 95 LEU 4.23 3.24 1 96 GLN 3.55 3.06 1 97 VAL 5.49 4.39 1 98 LEU 4.92 3.40 1 100 HIS 3.36 4.67 1 101 VAL 5.47 4.11 1 102 ALA 2.99 2.12 1 103 LYS 3.82 3.05 1 104 ALA 2.74 1.55 1 106 LEU 2.06 2.55 1 108 THR -4.60 -2.06 1 109 ALA 2.09 0.21 1 110 MET -3.03 0.60 1 111 LEU 5.80 4.79 1 112 TYR 3.98 3.43 1 113 GLU 4.17 3.13 1 114 LEU 3.11 3.45 1 115 ILE 5.73 5.07 1 116 GLU 3.18 2.38 1 119 LYS 4.01 3.61 1 120 GLU 2.01 2.43 1 121 ILE 3.42 2.79 1 122 LEU 0.87 0.94 1 123 SER 1.06 1.29 1 126 SER 0.14 0.23 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11296_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 3.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.58 _LACS_plot.Line_2_terminator_val_x_2 9.21 _LACS_plot.Line_2_terminator_val_y_2 -1.79 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 LEU 9.22 -4.07 0 117 LYS 4.39 -3.33 0 10 ASP 0.14 0.01 1 11 TRP -3.73 0.98 1 12 VAL 1.69 -0.10 1 15 SER 4.23 -1.25 1 16 GLU 3.12 0.15 1 17 VAL 6.54 -1.64 1 18 GLU 3.72 -0.34 1 19 VAL 5.96 -1.56 1 20 LEU 3.37 0.01 1 21 GLU 3.31 0.15 1 22 SER 2.40 -0.01 1 23 ILE 1.35 1.35 1 24 TYR -0.25 1.35 1 25 LEU 3.68 -2.75 1 26 ASP 2.51 -0.95 1 27 GLU 0.89 0.24 1 28 LEU -3.60 2.74 1 29 GLN -2.34 1.11 1 30 VAL -3.44 1.98 1 31 ILE 0.13 -0.94 1 32 LYS 0.79 -0.40 1 34 ASN 0.18 -0.76 1 36 ARG 0.85 -0.57 1 37 THR 0.53 -0.40 1 38 SER -0.37 0.51 1 40 TRP -2.67 1.24 1 41 GLU -4.83 3.60 1 42 ILE -3.97 2.63 1 43 TYR -5.31 2.86 1 44 ILE -3.01 2.05 1 45 THR 2.29 -0.98 1 46 LEU -3.39 1.45 1 47 HIS -1.52 1.21 1 49 ALA 0.79 -0.20 1 50 THR -1.18 0.40 1 51 ALA -0.66 0.64 1 52 GLU 0.38 0.16 1 53 ASP 0.11 -0.04 1 54 GLN 0.90 -0.08 1 55 ASP 0.65 0.12 1 56 SER 0.89 -0.04 1 57 GLN 0.45 -0.32 1 58 TYR 0.83 0.19 1 59 VAL -2.34 0.93 1 61 PHE -0.60 0.80 1 62 THR 0.68 -0.24 1 63 LEU -1.92 1.05 1 64 VAL -0.19 -0.81 1 65 LEU -4.16 1.30 1 66 GLN -1.46 0.49 1 67 VAL 0.30 0.47 1 69 ALA 2.78 -0.52 1 70 GLU 1.23 -0.34 1 71 TYR -1.27 3.06 1 73 HIS 1.46 0.85 1 74 GLU -6.03 3.95 1 75 VAL 1.94 -1.53 1 77 GLN -0.11 0.03 1 78 ILE -1.00 1.15 1 79 SER -2.69 1.80 1 80 ILE -3.37 1.85 1 81 ARG -5.98 3.69 1 82 ASN 2.84 -0.21 1 84 ARG -2.23 2.23 1 86 LEU -5.65 3.39 1 87 SER -3.63 1.90 1 88 ASP 4.89 -1.15 1 89 GLU 3.99 -0.62 1 90 GLN 3.18 0.40 1 91 ILE 5.61 -0.93 1 92 HIS 4.33 0.82 1 93 THR 6.58 -1.10 1 94 ILE 6.14 -0.91 1 95 LEU 4.23 -0.99 1 96 GLN 3.55 -0.49 1 97 VAL 5.49 -1.10 1 98 LEU 4.92 -1.52 1 100 HIS 3.36 1.31 1 101 VAL 5.47 -1.36 1 102 ALA 2.99 -0.87 1 103 LYS 3.82 -0.77 1 104 ALA 2.74 -1.19 1 106 LEU 2.06 0.49 1 108 THR -4.60 2.54 1 109 ALA 2.09 -1.88 1 110 MET -3.03 3.63 1 111 LEU 5.80 -1.01 1 112 TYR 3.98 -0.55 1 113 GLU 4.17 -1.04 1 114 LEU 3.11 0.34 1 115 ILE 5.73 -0.66 1 116 GLU 3.18 -0.80 1 119 LYS 4.01 -0.40 1 120 GLU 2.01 0.42 1 121 ILE 3.42 -0.63 1 122 LEU 0.87 0.07 1 123 SER 1.06 0.23 1 126 SER 0.14 0.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11296_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 0.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 9.21 _LACS_plot.Line_2_terminator_val_y_2 -0.94 _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 32 LYS 0.79 -1.47 0 10 ASP 0.14 0.03 1 11 TRP -3.73 0.49 1 12 VAL 1.69 -0.08 1 13 LEU 9.22 -0.66 1 15 SER 4.23 -0.18 1 16 GLU 3.12 -0.35 1 17 VAL 6.54 -0.66 1 18 GLU 3.72 -0.10 1 19 VAL 5.96 -0.41 1 20 LEU 3.37 -0.27 1 21 GLU 3.31 -0.34 1 22 SER 2.40 -0.10 1 23 ILE 1.35 -0.36 1 24 TYR -0.25 -0.04 1 25 LEU 3.68 -0.15 1 26 ASP 2.51 -0.10 1 27 GLU 0.89 -0.08 1 28 LEU -3.60 0.29 1 29 GLN -2.34 0.26 1 30 VAL -3.44 0.72 1 31 ILE 0.13 0.03 1 34 ASN 0.18 0.04 1 36 ARG 0.85 -0.04 1 37 THR 0.53 -0.03 1 38 SER -0.37 0.22 1 40 TRP -2.67 0.52 1 41 GLU -4.83 1.02 1 42 ILE -3.97 0.83 1 43 TYR -5.31 1.18 1 44 ILE -3.01 0.61 1 45 THR 2.29 0.31 1 46 LEU -3.39 0.08 1 47 HIS -1.52 -0.05 1 49 ALA 0.79 0.06 1 50 THR -1.18 0.07 1 51 ALA -0.66 0.09 1 52 GLU 0.38 -0.13 1 53 ASP 0.11 -0.13 1 54 GLN 0.90 -0.05 1 55 ASP 0.65 0.00 1 56 SER 0.89 -0.09 1 57 GLN 0.45 -0.02 1 58 TYR 0.83 -0.09 1 59 VAL -2.34 0.48 1 61 PHE -0.60 0.19 1 62 THR 0.68 0.51 1 63 LEU -1.92 0.28 1 64 VAL -0.19 0.50 1 65 LEU -4.16 0.74 1 66 GLN -1.46 0.78 1 67 VAL 0.30 -0.25 1 69 ALA 2.78 -0.27 1 70 GLU 1.23 -0.13 1 71 TYR -1.27 -0.09 1 73 HIS 1.46 -0.25 1 74 GLU -6.03 0.14 1 75 VAL 1.94 -0.07 1 77 GLN -0.11 0.11 1 78 ILE -1.00 0.58 1 79 SER -2.69 0.21 1 80 ILE -3.37 0.87 1 81 ARG -5.98 0.47 1 82 ASN 2.84 -0.54 1 84 ARG -2.23 0.29 1 86 LEU -5.65 0.67 1 87 SER -3.63 0.11 1 88 ASP 4.89 -0.32 1 89 GLU 3.99 -0.25 1 90 GLN 3.18 -0.30 1 91 ILE 5.61 -0.89 1 92 HIS 4.33 -0.53 1 93 THR 6.58 -0.49 1 94 ILE 6.14 -0.74 1 95 LEU 4.23 -0.56 1 96 GLN 3.55 -0.39 1 97 VAL 5.49 -0.41 1 98 LEU 4.92 -0.38 1 100 HIS 3.36 -0.27 1 101 VAL 5.47 -0.51 1 102 ALA 2.99 0.11 1 103 LYS 3.82 -0.49 1 104 ALA 2.74 -0.17 1 106 LEU 2.06 -0.47 1 108 THR -4.60 0.15 1 109 ALA 2.09 0.00 1 110 MET -3.03 0.51 1 111 LEU 5.80 -0.48 1 112 TYR 3.98 -0.36 1 113 GLU 4.17 -0.62 1 114 LEU 3.11 -0.45 1 115 ILE 5.73 -0.94 1 116 GLU 3.18 -0.61 1 117 LYS 4.39 -0.10 1 119 LYS 4.01 -0.51 1 120 GLU 2.01 -0.28 1 121 ILE 3.42 -0.24 1 122 LEU 0.87 -0.11 1 123 SER 1.06 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11296_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 -3.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 2.72 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 LEU -1.92 -4.05 0 100 HIS 3.36 4.27 0 86 LEU -5.65 -0.79 0 61 PHE -0.60 -3.98 0 15 SER 4.23 1.80 1 16 GLU 3.12 2.96 1 17 VAL 6.54 0.58 1 18 GLU 3.72 3.65 1 19 VAL 5.96 3.67 1 20 LEU 3.37 2.14 1 21 GLU 3.31 2.60 1 22 SER 2.40 -0.42 1 23 ILE 1.35 0.92 1 24 TYR -0.25 0.25 1 25 LEU 3.68 -0.15 1 26 ASP 2.51 0.48 1 27 GLU 0.89 -0.61 1 28 LEU -3.60 -2.66 1 29 GLN -2.34 -2.01 1 30 VAL -3.44 -0.94 1 31 ILE 0.13 -0.55 1 32 LYS 0.79 0.19 1 40 TRP -2.67 -0.81 1 41 GLU -4.83 -2.57 1 42 ILE -3.97 -2.73 1 43 TYR -5.31 -1.27 1 44 ILE -3.01 -3.54 1 45 THR 2.29 -2.25 1 46 LEU -3.39 -3.39 1 47 HIS -1.52 -0.32 1 49 ALA 0.79 0.07 1 50 THR -1.18 -0.66 1 51 ALA -0.66 -0.10 1 52 GLU 0.38 -0.23 1 53 ASP 0.11 0.07 1 54 GLN 0.90 0.10 1 55 ASP 0.65 0.48 1 56 SER 0.89 0.12 1 57 GLN 0.45 -0.51 1 58 TYR 0.83 -1.01 1 59 VAL -2.34 -1.10 1 62 THR 0.68 -2.29 1 64 VAL -0.19 -1.29 1 65 LEU -4.16 -2.36 1 66 GLN -1.46 -0.51 1 67 VAL 0.30 -1.94 1 69 ALA 2.78 0.92 1 70 GLU 1.23 0.65 1 71 TYR -1.27 -0.14 1 73 HIS 1.46 -0.39 1 74 GLU -6.03 -2.03 1 75 VAL 1.94 -1.29 1 77 GLN -0.11 0.30 1 78 ILE -1.00 -1.52 1 79 SER -2.69 -3.38 1 80 ILE -3.37 -1.03 1 81 ARG -5.98 -2.32 1 84 ARG -2.23 -0.67 1 87 SER -3.63 0.07 1 88 ASP 4.89 2.63 1 89 GLU 3.99 2.71 1 90 GLN 3.18 2.72 1 91 ILE 5.61 0.38 1 92 HIS 4.33 4.04 1 93 THR 6.58 0.88 1 94 ILE 6.14 0.99 1 95 LEU 4.23 2.94 1 96 GLN 3.55 3.00 1 97 VAL 5.49 2.84 1 98 LEU 4.92 1.22 1 101 VAL 5.47 2.27 1 102 ALA 2.99 0.60 1 103 LYS 3.82 3.22 1 104 ALA 2.74 1.02 1 106 LEU 2.06 0.13 1 108 THR -4.60 -3.93 1 109 ALA 2.09 0.45 1 110 MET -3.03 0.13 1 111 LEU 5.80 0.95 1 112 TYR 3.98 0.40 1 113 GLU 4.17 3.19 1 114 LEU 3.11 0.07 1 115 ILE 5.73 1.91 1 116 GLU 3.18 3.71 1 117 LYS 4.39 1.98 1 119 LYS 4.01 2.54 1 120 GLU 2.01 3.02 1 121 ILE 3.42 1.55 1 122 LEU 0.87 0.04 1 123 SER 1.06 -0.25 1 stop_ save_