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 bmr18462_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 -3.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.68 _LACS_plot.Line_2_terminator_val_x_2 9.35 _LACS_plot.Line_2_terminator_val_y_2 5.66 _LACS_plot.Y_axis_chem_shift_offset 0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 HIS -4.83 3.05 0 10 ASP 0.27 -1.29 1 11 ASP 0.97 -0.82 1 12 HIS -2.80 0.24 1 13 TYR -3.64 -2.66 1 14 GLU -3.27 -1.83 1 15 LEU -4.92 -1.45 1 16 ILE -0.03 -1.40 1 17 VAL -2.11 -1.33 1 18 ASP 2.37 0.34 1 20 ARG -3.53 -2.39 1 21 VAL 0.87 0.01 1 22 TYR -3.27 -1.59 1 23 TYR -1.06 -1.14 1 24 ILE -1.32 -3.39 1 26 ILE 1.61 2.35 1 27 VAL 3.05 2.42 1 29 LYS 6.20 1.39 1 30 ARG 3.50 2.29 1 31 SER -4.11 -2.82 1 32 TYR -3.75 -0.31 1 33 VAL -0.05 0.07 1 35 LEU 4.64 1.55 1 36 THR 5.89 2.35 1 37 SER 1.98 1.16 1 38 LEU 5.58 2.25 1 39 ARG 7.68 5.77 1 40 ARG 4.25 3.05 1 41 HIS 4.12 2.51 1 42 PHE 4.00 3.40 1 43 ASN 0.68 1.91 1 44 ILE 3.95 2.35 1 45 HIS 0.95 -0.46 1 46 SER 0.81 0.46 1 47 TRP 4.21 0.32 1 48 GLU 2.36 2.16 1 49 LYS -3.64 -2.36 1 50 LYS -3.88 -1.66 1 51 TYR -0.16 -1.26 1 54 ARG 5.36 2.04 1 55 TYR 1.32 0.15 1 57 GLU 1.08 0.79 1 58 LYS 1.28 1.39 1 59 VAL -2.82 -1.57 1 60 PHE -2.09 -0.01 1 62 LEU -1.22 -0.09 1 63 ALA 2.69 2.04 1 65 TYR 1.52 -1.72 1 66 ARG 6.85 3.13 1 67 THR 7.07 4.23 1 68 LYS 2.16 0.92 1 69 HIS 4.50 3.76 1 70 GLU 4.77 4.58 1 71 ILE 2.78 0.71 1 72 HIS 5.88 3.76 1 74 THR 1.67 0.71 1 76 GLU 0.59 -0.19 1 77 ARG 0.73 -0.94 1 78 ARG -0.73 1.35 1 79 TYR 0.08 0.27 1 80 GLN -3.84 -2.09 1 82 LEU 2.76 0.61 1 83 ALA 3.63 1.11 1 86 LYS 1.04 1.39 1 87 SER -3.41 -2.12 1 88 PHE -5.64 -1.01 1 89 ILE 0.43 0.94 1 90 ASN -3.18 -2.30 1 91 TYR 2.33 2.01 1 92 GLN 9.35 5.40 1 93 PHE 2.87 1.76 1 95 SER 4.09 2.33 1 96 SER 4.56 2.57 1 97 HIS 5.76 3.99 1 98 ILE 7.23 5.63 1 99 LYS 3.62 3.26 1 100 SER 2.45 1.63 1 101 VAL 3.28 1.72 1 102 HIS -0.83 -1.62 1 103 SER 2.45 -0.25 1 104 GLN -5.66 -2.32 1 105 ASP -2.51 -2.11 1 107 SER 0.10 -0.25 1 109 ASP 0.73 -0.36 1 110 SER 0.34 -0.25 1 111 LYS 1.97 -0.26 1 112 LEU -1.46 -0.80 1 113 TYR -7.22 -3.60 1 114 ARG -5.64 -2.62 1 115 LEU -1.91 -2.66 1 116 HIS 1.31 2.24 1 119 ARG -0.49 -0.76 1 120 SER 3.28 1.40 1 121 LEU -5.25 -2.25 1 122 GLN 1.12 -1.40 1 123 ILE -6.06 -2.27 1 124 ARG 0.77 0.39 1 125 GLN -3.55 -2.79 1 126 TYR -0.47 -0.43 1 127 ALA 2.89 1.54 1 128 TYR 2.64 0.27 1 129 LEU 0.18 -0.80 1 130 SER 0.34 -0.25 1 131 ASP 0.26 -0.36 1 132 ARG -0.02 -0.76 1 133 SER 0.81 1.16 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18462_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 4.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 9.35 _LACS_plot.Line_2_terminator_val_y_2 -3.69 _LACS_plot.Y_axis_chem_shift_offset 0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 HIS -4.83 7.88 0 10 ASP 0.27 -1.56 1 11 ASP 0.97 -1.79 1 12 HIS -2.80 3.04 1 13 TYR -3.64 0.98 1 14 GLU -3.27 1.44 1 15 LEU -4.92 3.47 1 16 ILE -0.03 -1.37 1 17 VAL -2.11 0.78 1 18 ASP 2.37 -2.03 1 20 ARG -3.53 1.14 1 21 VAL 0.87 -0.86 1 22 TYR -3.27 1.68 1 23 TYR -1.06 -0.08 1 24 ILE -1.32 -2.07 1 26 ILE 1.61 0.74 1 27 VAL 3.05 -0.63 1 29 LYS 6.20 -4.81 1 30 ARG 3.50 -1.21 1 31 SER -4.11 1.29 1 32 TYR -3.75 3.44 1 33 VAL -0.05 0.12 1 35 LEU 4.64 -3.09 1 36 THR 5.89 -3.54 1 37 SER 1.98 -0.82 1 38 LEU 5.58 -3.33 1 39 ARG 7.68 -1.91 1 40 ARG 4.25 -1.20 1 41 HIS 4.12 -1.61 1 42 PHE 4.00 -0.60 1 43 ASN 0.68 1.23 1 44 ILE 3.95 -1.60 1 45 HIS 0.95 -1.41 1 46 SER 0.81 -0.35 1 47 TRP 4.21 -3.89 1 48 GLU 2.36 -0.20 1 49 LYS -3.64 1.28 1 50 LYS -3.88 2.22 1 51 TYR -0.16 -1.10 1 54 ARG 5.36 -3.32 1 55 TYR 1.32 -1.17 1 57 GLU 1.08 -0.29 1 58 LYS 1.28 0.11 1 59 VAL -2.82 1.25 1 60 PHE -2.09 2.08 1 62 LEU -1.22 1.13 1 63 ALA 2.69 -0.65 1 65 TYR 1.52 -3.24 1 66 ARG 6.85 -3.72 1 67 THR 7.07 -2.84 1 68 LYS 2.16 -1.24 1 69 HIS 4.50 -0.74 1 70 GLU 4.77 -0.19 1 71 ILE 2.78 -2.07 1 72 HIS 5.88 -2.12 1 74 THR 1.67 -0.96 1 76 GLU 0.59 -0.78 1 77 ARG 0.73 -1.67 1 78 ARG -0.73 2.08 1 79 TYR 0.08 0.19 1 80 GLN -3.84 1.75 1 82 LEU 2.76 -2.15 1 83 ALA 3.63 -2.52 1 86 LYS 1.04 0.35 1 87 SER -3.41 1.29 1 88 PHE -5.64 4.63 1 89 ILE 0.43 0.51 1 90 ASN -3.18 0.88 1 91 TYR 2.33 -0.32 1 92 GLN 9.35 -3.95 1 93 PHE 2.87 -1.11 1 95 SER 4.09 -1.76 1 96 SER 4.56 -1.99 1 97 HIS 5.76 -1.77 1 98 ILE 7.23 -1.60 1 99 LYS 3.62 -0.36 1 100 SER 2.45 -0.82 1 101 VAL 3.28 -1.56 1 102 HIS -0.83 -0.79 1 103 SER 2.45 -2.70 1 104 GLN -5.66 3.34 1 105 ASP -2.51 0.40 1 107 SER 0.10 -0.35 1 109 ASP 0.73 -1.09 1 110 SER 0.34 -0.59 1 111 LYS 1.97 -2.23 1 112 LEU -1.46 0.66 1 113 TYR -7.22 3.62 1 114 ARG -5.64 3.02 1 115 LEU -1.91 -0.75 1 116 HIS 1.31 0.93 1 119 ARG -0.49 -0.27 1 120 SER 3.28 -1.88 1 121 LEU -5.25 3.00 1 122 GLN 1.12 -2.52 1 123 ILE -6.06 3.79 1 124 ARG 0.77 -0.38 1 125 GLN -3.55 0.76 1 126 TYR -0.47 0.04 1 127 ALA 2.89 -1.35 1 128 TYR 2.64 -2.37 1 129 LEU 0.18 -0.98 1 130 SER 0.34 -0.59 1 131 ASP 0.26 -0.62 1 132 ARG -0.02 -0.74 1 133 SER 0.81 0.35 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18462_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 0.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _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 9.35 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 HIS -4.83 -0.41 0 63 ALA 2.69 -1.33 0 10 ASP 0.27 -0.25 1 11 ASP 0.97 0.07 1 12 HIS -2.80 1.16 1 13 TYR -3.64 0.45 1 14 GLU -3.27 0.95 1 15 LEU -4.92 0.42 1 16 ILE -0.03 0.84 1 17 VAL -2.11 0.18 1 18 ASP 2.37 -0.34 1 20 ARG -3.53 0.26 1 21 VAL 0.87 0.01 1 22 TYR -3.27 0.08 1 23 TYR -1.06 0.21 1 24 ILE -1.32 0.61 1 26 ILE 1.61 0.01 1 27 VAL 3.05 -0.18 1 29 LYS 6.20 -0.01 1 30 ARG 3.50 -0.25 1 31 SER -4.11 0.53 1 32 TYR -3.75 0.45 1 33 VAL -0.05 0.26 1 35 LEU 4.64 -1.01 1 36 THR 5.89 -0.53 1 37 SER 1.98 -0.35 1 38 LEU 5.58 -1.12 1 39 ARG 7.68 -0.50 1 40 ARG 4.25 -0.26 1 41 HIS 4.12 -0.51 1 42 PHE 4.00 -1.00 1 43 ASN 0.68 0.25 1 44 ILE 3.95 -1.17 1 45 HIS 0.95 0.04 1 46 SER 0.81 -0.11 1 47 TRP 4.21 -0.66 1 48 GLU 2.36 -0.31 1 49 LYS -3.64 0.22 1 50 LYS -3.88 0.34 1 51 TYR -0.16 0.19 1 54 ARG 5.36 -0.05 1 55 TYR 1.32 -0.03 1 57 GLU 1.08 0.10 1 58 LYS 1.28 -0.28 1 59 VAL -2.82 0.42 1 62 LEU -1.22 -0.25 1 65 TYR 1.52 -0.18 1 66 ARG 6.85 -1.13 1 67 THR 7.07 -0.41 1 68 LYS 2.16 -0.27 1 69 HIS 4.50 -0.18 1 70 GLU 4.77 -0.14 1 71 ILE 2.78 0.16 1 72 HIS 5.88 -0.47 1 74 THR 1.67 -0.17 1 76 GLU 0.59 -0.44 1 77 ARG 0.73 0.10 1 78 ARG -0.73 -0.13 1 80 GLN -3.84 0.94 1 82 LEU 2.76 0.06 1 83 ALA 3.63 -0.03 1 86 LYS 1.04 -0.21 1 87 SER -3.41 1.19 1 88 PHE -5.64 0.16 1 89 ILE 0.43 0.30 1 90 ASN -3.18 -0.06 1 92 GLN 9.35 -0.62 1 93 PHE 2.87 -0.19 1 95 SER 4.09 -0.75 1 96 SER 4.56 -0.26 1 97 HIS 5.76 -0.40 1 98 ILE 7.23 -0.61 1 99 LYS 3.62 0.01 1 100 SER 2.45 -0.15 1 101 VAL 3.28 -0.33 1 102 HIS -0.83 0.37 1 103 SER 2.45 -0.05 1 104 GLN -5.66 0.32 1 105 ASP -2.51 0.06 1 107 SER 0.10 0.35 1 109 ASP 0.73 0.06 1 110 SER 0.34 -0.05 1 111 LYS 1.97 0.01 1 112 LEU -1.46 0.12 1 113 TYR -7.22 1.16 1 114 ARG -5.64 0.07 1 115 LEU -1.91 0.43 1 116 HIS 1.31 -0.38 1 119 ARG -0.49 0.35 1 120 SER 3.28 -0.13 1 121 LEU -5.25 0.44 1 122 GLN 1.12 0.22 1 123 ILE -6.06 0.58 1 124 ARG 0.77 -0.30 1 125 GLN -3.55 0.08 1 126 TYR -0.47 0.22 1 127 ALA 2.89 -0.13 1 128 TYR 2.64 0.01 1 129 LEU 0.18 -0.08 1 130 SER 0.34 -0.05 1 131 ASP 0.26 0.01 1 132 ARG -0.02 0.11 1 133 SER 0.81 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18462_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 9.35 _LACS_plot.Line_2_terminator_val_y_2 2.42 _LACS_plot.Y_axis_chem_shift_offset 0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 TYR -3.64 4.14 0 73 HIS -4.83 3.96 0 10 ASP 0.27 -1.89 1 11 ASP 0.97 -1.20 1 12 HIS -2.80 1.17 1 14 GLU -3.27 -2.50 1 15 LEU -4.92 -1.99 1 16 ILE -0.03 -1.86 1 17 VAL -2.11 0.38 1 18 ASP 2.37 -0.22 1 20 ARG -3.53 -3.04 1 21 VAL 0.87 -2.83 1 22 TYR -3.27 -1.61 1 23 TYR -1.06 -2.09 1 24 ILE -1.32 -1.64 1 26 ILE 1.61 1.53 1 27 VAL 3.05 -0.17 1 29 LYS 6.20 -0.73 1 30 ARG 3.50 -0.71 1 31 SER -4.11 -0.18 1 32 TYR -3.75 -2.19 1 33 VAL -0.05 0.09 1 35 LEU 4.64 -2.87 1 36 THR 5.89 4.21 1 37 SER 1.98 3.87 1 38 LEU 5.58 -0.86 1 39 ARG 7.68 2.17 1 40 ARG 4.25 1.96 1 41 HIS 4.12 3.97 1 42 PHE 4.00 0.23 1 43 ASN 0.68 1.04 1 44 ILE 3.95 -0.11 1 45 HIS 0.95 1.77 1 46 SER 0.81 2.47 1 47 TRP 4.21 -0.97 1 48 GLU 2.36 -1.25 1 49 LYS -3.64 1.44 1 50 LYS -3.88 -1.43 1 51 TYR -0.16 0.22 1 54 ARG 5.36 0.09 1 55 TYR 1.32 0.76 1 57 GLU 1.08 -3.12 1 58 LYS 1.28 0.28 1 59 VAL -2.82 -1.18 1 60 PHE -2.09 -0.21 1 62 LEU -1.22 -2.51 1 63 ALA 2.69 -2.36 1 65 TYR 1.52 2.10 1 66 ARG 6.85 3.17 1 67 THR 7.07 2.84 1 68 LYS 2.16 -0.46 1 69 HIS 4.50 5.47 1 70 GLU 4.77 1.23 1 71 ILE 2.78 3.27 1 72 HIS 5.88 4.18 1 74 THR 1.67 2.58 1 76 GLU 0.59 -2.91 1 77 ARG 0.73 -1.12 1 78 ARG -0.73 -0.45 1 79 TYR 0.08 0.23 1 80 GLN -3.84 -0.92 1 82 LEU 2.76 -0.20 1 83 ALA 3.63 -0.14 1 86 LYS 1.04 -2.30 1 87 SER -3.41 -0.28 1 88 PHE -5.64 -2.17 1 89 ILE 0.43 -0.41 1 90 ASN -3.18 0.15 1 91 TYR 2.33 -3.17 1 92 GLN 9.35 0.33 1 93 PHE 2.87 3.63 1 95 SER 4.09 2.11 1 96 SER 4.56 2.25 1 97 HIS 5.76 3.55 1 98 ILE 7.23 -0.47 1 99 LYS 3.62 2.33 1 100 SER 2.45 4.66 1 101 VAL 3.28 -0.05 1 102 HIS -0.83 2.94 1 103 SER 2.45 -0.07 1 104 GLN -5.66 -2.01 1 105 ASP -2.51 -1.61 1 107 SER 0.10 1.70 1 109 ASP 0.73 -1.97 1 110 SER 0.34 1.51 1 111 LYS 1.97 -2.30 1 112 LEU -1.46 -0.68 1 113 TYR -7.22 -0.22 1 114 ARG -5.64 -3.96 1 115 LEU -1.91 -4.15 1 116 HIS 1.31 2.91 1 119 ARG -0.49 -1.21 1 120 SER 3.28 3.77 1 121 LEU -5.25 -4.34 1 122 GLN 1.12 -0.17 1 123 ILE -6.06 -1.31 1 124 ARG 0.77 -0.86 1 125 GLN -3.55 -1.37 1 126 TYR -0.47 -0.45 1 127 ALA 2.89 -0.37 1 128 TYR 2.64 -2.62 1 129 LEU 0.18 -1.44 1 130 SER 0.34 3.15 1 131 ASP 0.26 -2.21 1 132 ARG -0.02 -0.19 1 133 SER 0.81 0.94 1 stop_ save_