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 bmr18293_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.32 _LACS_plot.Line_1_terminator_val_y_1 -3.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.64 _LACS_plot.Line_2_terminator_val_x_2 8.31 _LACS_plot.Line_2_terminator_val_y_2 6.31 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 91 GLN -2.21 3.08 0 10 LEU -1.93 -1.18 1 12 GLN 4.96 3.67 1 13 SER 5.00 2.72 1 14 PHE 2.89 2.51 1 15 LEU 3.96 3.19 1 16 LEU 4.42 3.07 1 17 LYS 4.35 2.96 1 19 LEU 5.15 3.54 1 20 GLU 4.22 2.19 1 21 GLN 5.37 3.64 1 22 VAL 7.11 5.31 1 23 ARG 4.04 2.79 1 24 LYS 3.53 3.07 1 25 ILE 5.44 3.90 1 26 GLN 4.44 3.63 1 28 ASP 3.58 1.78 1 31 ALA 3.82 2.35 1 32 LEU 4.14 3.32 1 33 GLN 4.50 4.37 1 34 GLU 5.06 2.69 1 35 LYS 3.60 3.08 1 36 LEU 4.47 3.76 1 38 ALA 2.95 2.61 1 39 THR 4.33 3.85 1 40 TYR -1.73 -1.14 1 41 LYS 6.19 1.43 1 42 LEU -1.16 -1.71 1 46 GLU 4.68 2.29 1 47 GLU 1.11 0.28 1 48 LEU -0.94 -1.00 1 49 VAL 4.53 3.49 1 50 LEU 4.76 2.99 1 51 LEU 3.53 2.12 1 53 HIS 3.91 3.04 1 54 SER 3.60 2.74 1 55 LEU -0.17 0.31 1 57 ILE 0.88 0.40 1 59 TRP -3.02 -2.45 1 60 ALA -2.45 -0.50 1 62 LEU -0.68 -0.61 1 63 SER 1.35 1.04 1 64 SER 1.21 0.34 1 67 SER 2.68 2.01 1 68 GLN -0.57 -0.38 1 69 ALA 1.69 -0.01 1 70 LEU 1.82 1.45 1 71 GLN -0.30 -1.20 1 72 LEU 4.37 4.05 1 73 ALA 5.21 3.74 1 76 LEU 5.30 3.42 1 77 SER 1.59 1.14 1 78 GLN 4.61 4.08 1 79 LEU 3.97 3.77 1 80 HIS 8.23 7.42 1 83 LEU 3.24 3.09 1 84 PHE 3.52 2.60 1 85 LEU 7.12 3.53 1 86 TYR 8.31 7.03 1 87 GLN 5.26 4.60 1 89 LEU 2.21 2.86 1 90 LEU 3.11 2.51 1 92 ALA 2.94 1.51 1 93 LEU 1.85 0.61 1 94 GLU 3.56 -0.30 1 99 GLU 3.81 2.03 1 100 LEU -0.86 -0.85 1 103 THR 6.35 5.00 1 104 LEU 3.97 2.66 1 105 ASP 5.41 2.37 1 106 THR 5.76 5.16 1 107 LEU 3.11 2.84 1 108 GLN 4.80 4.76 1 109 LEU 3.88 2.98 1 110 ASP 4.97 2.69 1 114 PHE -0.58 -0.73 1 115 ALA 5.86 3.86 1 116 THR 6.25 5.17 1 117 THR 6.56 5.50 1 118 ILE 5.51 4.22 1 119 TRP 2.77 3.02 1 120 GLN 4.52 3.02 1 121 GLN 1.81 1.98 1 122 MET 4.58 4.59 1 123 GLU 4.24 2.01 1 124 GLU 4.18 2.00 1 125 LEU -0.50 -0.58 1 127 MET -0.95 -0.28 1 128 ALA -0.19 -0.61 1 130 ALA 0.53 0.31 1 131 LEU -1.13 -0.59 1 132 GLN -1.55 2.55 1 134 THR -0.36 -0.18 1 135 GLN -0.34 0.11 1 137 ALA 0.12 -0.18 1 138 MET -2.77 -1.09 1 140 ALA -2.02 -1.84 1 141 PHE -0.54 -1.26 1 142 ALA 0.76 1.59 1 143 SER -5.32 -2.39 1 144 ALA 4.66 3.14 1 145 PHE 4.74 4.07 1 146 GLN 5.32 4.15 1 147 ARG 4.29 4.00 1 148 ARG 4.62 3.74 1 149 ALA 2.74 2.08 1 152 VAL 5.97 4.25 1 153 LEU 2.18 3.05 1 154 VAL 6.82 5.28 1 155 ALA 5.33 3.43 1 156 SER 4.32 3.28 1 157 HIS 5.42 4.11 1 158 LEU 4.05 2.70 1 159 GLN 5.40 3.62 1 160 SER 5.38 3.94 1 161 PHE 4.02 3.77 1 162 LEU 2.94 1.79 1 163 GLU 4.54 2.78 1 164 VAL 6.19 4.39 1 166 TYR 4.88 4.30 1 167 ARG 4.98 3.94 1 168 VAL 4.40 3.66 1 169 LEU 3.71 3.04 1 170 ARG 4.78 2.72 1 171 HIS 4.25 2.93 1 172 LEU 1.59 1.40 1 173 ALA 0.40 0.23 1 174 GLN -1.87 -2.29 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18293_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.32 _LACS_plot.Line_1_terminator_val_y_1 2.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 8.31 _LACS_plot.Line_2_terminator_val_y_2 -2.00 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 91 GLN -2.21 5.29 0 10 LEU -1.93 0.75 1 12 GLN 4.96 -1.29 1 13 SER 5.00 -2.28 1 14 PHE 2.89 -0.38 1 15 LEU 3.96 -0.77 1 16 LEU 4.42 -1.35 1 17 LYS 4.35 -1.39 1 19 LEU 5.15 -1.61 1 20 GLU 4.22 -2.03 1 21 GLN 5.37 -1.73 1 22 VAL 7.11 -1.80 1 23 ARG 4.04 -1.25 1 24 LYS 3.53 -0.46 1 25 ILE 5.44 -1.54 1 26 GLN 4.44 -0.81 1 28 ASP 3.58 -1.80 1 31 ALA 3.82 -1.47 1 32 LEU 4.14 -0.82 1 33 GLN 4.50 -0.13 1 34 GLU 5.06 -2.37 1 35 LYS 3.60 -0.52 1 36 LEU 4.47 -0.71 1 38 ALA 2.95 -0.34 1 39 THR 4.33 -0.48 1 40 TYR -1.73 0.59 1 41 LYS 6.19 -4.76 1 42 LEU -1.16 -0.55 1 46 GLU 4.68 -2.39 1 47 GLU 1.11 -0.83 1 48 LEU -0.94 -0.06 1 49 VAL 4.53 -1.04 1 50 LEU 4.76 -1.77 1 51 LEU 3.53 -1.41 1 53 HIS 3.91 -0.87 1 54 SER 3.60 -0.86 1 55 LEU -0.17 0.48 1 57 ILE 0.88 -0.48 1 59 TRP -3.02 0.57 1 60 ALA -2.45 1.95 1 62 LEU -0.68 0.07 1 63 SER 1.35 -0.31 1 64 SER 1.21 -0.87 1 67 SER 2.68 -0.67 1 68 GLN -0.57 0.19 1 69 ALA 1.69 -1.70 1 70 LEU 1.82 -0.37 1 71 GLN -0.30 -0.90 1 72 LEU 4.37 -0.32 1 73 ALA 5.21 -1.47 1 76 LEU 5.30 -1.88 1 77 SER 1.59 -0.45 1 78 GLN 4.61 -0.53 1 79 LEU 3.97 -0.20 1 80 HIS 8.23 -0.81 1 83 LEU 3.24 -0.15 1 84 PHE 3.52 -0.92 1 85 LEU 7.12 -3.59 1 86 TYR 8.31 -1.28 1 87 GLN 5.26 -0.66 1 89 LEU 2.21 0.65 1 90 LEU 3.11 -0.60 1 92 ALA 2.94 -1.43 1 93 LEU 1.85 -1.24 1 94 GLU 3.56 -3.86 1 99 GLU 3.81 -1.78 1 100 LEU -0.86 0.01 1 103 THR 6.35 -1.35 1 104 LEU 3.97 -1.31 1 105 ASP 5.41 -3.04 1 106 THR 5.76 -0.60 1 107 LEU 3.11 -0.27 1 108 GLN 4.80 -0.04 1 109 LEU 3.88 -0.90 1 110 ASP 4.97 -2.28 1 114 PHE -0.58 -0.15 1 115 ALA 5.86 -2.00 1 116 THR 6.25 -1.08 1 117 THR 6.56 -1.06 1 118 ILE 5.51 -1.29 1 119 TRP 2.77 0.25 1 120 GLN 4.52 -1.50 1 121 GLN 1.81 0.17 1 122 MET 4.58 0.01 1 123 GLU 4.24 -2.23 1 124 GLU 4.18 -2.18 1 125 LEU -0.50 -0.08 1 127 MET -0.95 0.67 1 128 ALA -0.19 -0.42 1 130 ALA 0.53 -0.22 1 131 LEU -1.13 0.54 1 132 GLN -1.55 4.10 1 134 THR -0.36 0.18 1 135 GLN -0.34 0.45 1 137 ALA 0.12 -0.30 1 138 MET -2.77 1.68 1 140 ALA -2.02 0.18 1 141 PHE -0.54 -0.72 1 142 ALA 0.76 0.83 1 143 SER -5.32 2.93 1 144 ALA 4.66 -1.52 1 145 PHE 4.74 -0.67 1 146 GLN 5.32 -1.17 1 147 ARG 4.29 -0.29 1 148 ARG 4.62 -0.88 1 149 ALA 2.74 -0.66 1 152 VAL 5.97 -1.72 1 153 LEU 2.18 0.87 1 154 VAL 6.82 -1.54 1 155 ALA 5.33 -1.90 1 156 SER 4.32 -1.04 1 157 HIS 5.42 -1.31 1 158 LEU 4.05 -1.35 1 159 GLN 5.40 -1.78 1 160 SER 5.38 -1.44 1 161 PHE 4.02 -0.25 1 162 LEU 2.94 -1.15 1 163 GLU 4.54 -1.76 1 164 VAL 6.19 -1.80 1 166 TYR 4.88 -0.58 1 167 ARG 4.98 -1.04 1 168 VAL 4.40 -0.74 1 169 LEU 3.71 -0.67 1 170 ARG 4.78 -2.06 1 171 HIS 4.25 -1.32 1 172 LEU 1.59 -0.19 1 173 ALA 0.40 -0.17 1 174 GLN -1.87 -0.42 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18293_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.32 _LACS_plot.Line_1_terminator_val_y_1 -2.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.80 _LACS_plot.Line_2_terminator_val_x_2 8.31 _LACS_plot.Line_2_terminator_val_y_2 3.11 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 143 SER -5.32 -0.43 0 85 LEU 7.12 -2.03 0 12 GLN 4.96 2.08 1 13 SER 5.00 2.42 1 14 PHE 2.89 0.85 1 15 LEU 3.96 0.82 1 16 LEU 4.42 2.18 1 17 LYS 4.35 2.50 1 19 LEU 5.15 1.40 1 20 GLU 4.22 2.56 1 21 GLN 5.37 2.60 1 22 VAL 7.11 1.07 1 23 ARG 4.04 3.43 1 24 LYS 3.53 2.40 1 25 ILE 5.44 0.70 1 26 GLN 4.44 4.74 1 28 ASP 3.58 3.10 1 31 ALA 3.82 2.57 1 32 LEU 4.14 0.27 1 33 GLN 4.50 3.12 1 34 GLU 5.06 2.16 1 35 LYS 3.60 3.67 1 36 LEU 4.47 1.27 1 38 ALA 2.95 1.51 1 39 THR 4.33 0.51 1 40 TYR -1.73 -1.37 1 41 LYS 6.19 -0.55 1 42 LEU -1.16 -1.83 1 46 GLU 4.68 1.32 1 47 GLU 1.11 0.36 1 48 LEU -0.94 -0.99 1 49 VAL 4.53 1.90 1 50 LEU 4.76 1.99 1 51 LEU 3.53 1.66 1 53 HIS 3.91 2.91 1 54 SER 3.60 1.10 1 55 LEU -0.17 -0.26 1 59 TRP -3.02 0.01 1 62 LEU -0.68 0.34 1 63 SER 1.35 1.34 1 64 SER 1.21 -1.55 1 67 SER 2.68 -0.01 1 68 GLN -0.57 -1.42 1 69 ALA 1.69 -1.65 1 70 LEU 1.82 -0.86 1 71 GLN -0.30 -0.07 1 72 LEU 4.37 0.13 1 73 ALA 5.21 2.80 1 76 LEU 5.30 1.18 1 77 SER 1.59 0.32 1 78 GLN 4.61 4.33 1 79 LEU 3.97 0.82 1 80 HIS 8.23 2.16 1 83 LEU 3.24 0.47 1 84 PHE 3.52 2.60 1 86 TYR 8.31 2.75 1 87 GLN 5.26 2.55 1 89 LEU 2.21 0.42 1 90 LEU 3.11 2.59 1 91 GLN -2.21 2.69 1 92 ALA 2.94 -0.01 1 93 LEU 1.85 -0.96 1 94 GLU 3.56 0.00 1 99 GLU 3.81 0.72 1 100 LEU -0.86 -0.65 1 103 THR 6.35 2.31 1 104 LEU 3.97 0.40 1 105 ASP 5.41 1.63 1 106 THR 5.76 -0.05 1 107 LEU 3.11 0.03 1 108 GLN 4.80 2.33 1 109 LEU 3.88 1.52 1 110 ASP 4.97 3.73 1 114 PHE -0.58 1.31 1 115 ALA 5.86 2.45 1 116 THR 6.25 1.16 1 117 THR 6.56 2.94 1 119 TRP 2.77 1.51 1 120 GLN 4.52 2.71 1 121 GLN 1.81 1.94 1 122 MET 4.58 2.09 1 123 GLU 4.24 3.47 1 124 GLU 4.18 1.04 1 125 LEU -0.50 -0.68 1 127 MET -0.95 -2.11 1 130 ALA 0.53 -0.14 1 131 LEU -1.13 -0.49 1 134 THR -0.36 -0.42 1 135 GLN -0.34 0.14 1 137 ALA 0.12 -0.22 1 140 ALA -2.02 -1.26 1 141 PHE -0.54 -0.60 1 142 ALA 0.76 -0.48 1 144 ALA 4.66 2.01 1 145 PHE 4.74 1.07 1 146 GLN 5.32 2.50 1 147 ARG 4.29 0.97 1 148 ARG 4.62 0.46 1 149 ALA 2.74 2.16 1 152 VAL 5.97 2.71 1 153 LEU 2.18 1.61 1 154 VAL 6.82 1.00 1 155 ALA 5.33 1.26 1 156 SER 4.32 2.75 1 157 HIS 5.42 2.90 1 158 LEU 4.05 0.37 1 159 GLN 5.40 3.58 1 160 SER 5.38 1.64 1 161 PHE 4.02 3.08 1 162 LEU 2.94 0.79 1 163 GLU 4.54 2.63 1 164 VAL 6.19 2.03 1 166 TYR 4.88 0.24 1 167 ARG 4.98 3.44 1 168 VAL 4.40 1.96 1 169 LEU 3.71 1.01 1 170 ARG 4.78 2.30 1 171 HIS 4.25 2.36 1 172 LEU 1.59 -0.26 1 173 ALA 0.40 -0.84 1 stop_ save_