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 bmr18291_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.41 _LACS_plot.Line_1_terminator_val_y_1 -3.07 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.65 _LACS_plot.Line_2_terminator_val_x_2 8.20 _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 132 GLN -1.56 2.58 0 10 LEU -1.98 -1.19 1 12 GLN 4.91 3.65 1 14 PHE 2.80 2.40 1 15 LEU 3.87 3.16 1 16 LEU 4.44 3.07 1 17 LYS 4.41 3.05 1 19 LEU 5.09 3.53 1 20 GLU 3.88 2.25 1 21 GLN 5.38 3.62 1 22 VAL 7.09 5.35 1 23 ARG 3.95 2.84 1 24 LYS 3.38 3.05 1 25 ILE 5.59 3.94 1 26 GLN 4.48 3.68 1 28 ASP 3.33 1.59 1 31 ALA 3.93 2.47 1 32 LEU 3.97 3.12 1 33 GLN 4.44 4.34 1 34 GLU 4.82 2.62 1 35 LYS 3.56 3.01 1 36 LEU 4.46 3.75 1 38 ALA 2.98 2.67 1 39 THR 4.29 3.86 1 40 TYR -1.66 -1.05 1 41 LYS 6.16 1.44 1 42 LEU -1.20 -1.69 1 46 GLU 4.88 2.62 1 47 GLU 0.85 0.36 1 48 LEU -1.11 -1.16 1 49 VAL 4.55 3.49 1 50 LEU 4.88 3.04 1 51 LEU 3.59 2.24 1 53 HIS 3.75 2.93 1 54 SER 3.68 2.78 1 55 LEU -0.22 0.29 1 57 ILE 1.01 0.49 1 59 TRP -3.17 -2.43 1 60 ALA -2.40 -0.45 1 62 LEU -0.70 -0.63 1 63 SER 1.41 1.07 1 64 SER 1.27 0.40 1 67 SER 2.66 2.03 1 68 GLN -0.70 -0.42 1 69 ALA 1.61 -0.01 1 70 LEU 1.79 1.46 1 71 GLN -0.45 -1.18 1 72 LEU 4.27 4.01 1 73 ALA 5.19 3.77 1 76 LEU 5.34 3.49 1 77 SER 1.66 1.21 1 78 GLN 4.47 4.07 1 79 LEU 3.95 3.74 1 80 HIS 8.21 7.58 1 83 LEU 3.20 3.08 1 84 PHE 3.51 2.63 1 85 LEU 5.03 3.53 1 86 TYR 8.07 6.83 1 87 GLN 5.21 4.62 1 89 LEU 2.15 2.81 1 90 LEU 3.26 2.49 1 91 GLN 4.27 3.08 1 92 ALA 2.89 1.48 1 93 LEU 1.82 0.61 1 94 GLU 3.30 -0.30 1 99 GLU 3.79 2.11 1 100 LEU -0.92 -0.93 1 103 THR 6.22 4.93 1 104 LEU 4.02 2.72 1 105 ASP 5.13 2.69 1 106 THR 5.71 5.16 1 107 LEU 3.03 2.78 1 108 GLN 4.77 4.78 1 109 LEU 3.84 3.02 1 110 ASP 5.07 2.75 1 111 VAL 6.70 5.49 1 113 ASP 4.25 2.53 1 114 PHE -0.72 -0.76 1 115 ALA 5.85 3.87 1 116 THR 6.25 5.16 1 117 THR 6.61 5.57 1 118 ILE 5.33 4.05 1 119 TRP 2.94 3.12 1 120 GLN 4.47 3.03 1 121 GLN 1.54 1.96 1 122 MET 4.65 4.63 1 123 GLU 4.23 2.02 1 124 GLU 3.94 2.09 1 125 LEU -0.53 -0.55 1 127 MET -0.99 -0.30 1 128 ALA -0.11 -0.55 1 130 ALA 0.52 0.35 1 131 LEU 0.51 0.01 1 134 THR -0.44 -0.23 1 135 GLN -0.38 0.11 1 137 ALA 0.10 -0.19 1 138 MET -2.89 -1.12 1 140 ALA -2.13 -1.89 1 141 PHE -0.60 -1.27 1 142 ALA 0.67 1.55 1 143 SER -5.41 -2.44 1 144 ALA 4.82 3.26 1 145 PHE 4.66 4.06 1 146 GLN 5.32 4.16 1 147 ARG 4.02 3.92 1 148 ARG 4.64 3.77 1 149 ALA 2.55 2.07 1 152 VAL 5.97 4.28 1 153 LEU 2.12 3.06 1 154 VAL 6.33 5.26 1 155 ALA 5.16 3.38 1 156 SER 4.30 3.28 1 157 HIS 5.45 4.19 1 158 LEU 4.02 2.65 1 159 GLN 5.32 3.60 1 160 SER 5.38 3.96 1 161 PHE 3.78 3.53 1 162 LEU 2.97 1.81 1 163 GLU 4.35 2.83 1 164 VAL 6.13 4.29 1 166 TYR 4.90 4.33 1 167 ARG 4.88 3.91 1 168 VAL 4.40 3.65 1 169 LEU 3.72 3.04 1 170 ARG 4.77 2.76 1 171 HIS 4.08 2.78 1 172 LEU 1.57 1.38 1 173 ALA 0.35 0.25 1 174 GLN -1.88 -2.28 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18291_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.41 _LACS_plot.Line_1_terminator_val_y_1 2.34 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.35 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 -1.89 _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 132 GLN -1.56 4.14 0 10 LEU -1.98 0.79 1 12 GLN 4.91 -1.26 1 14 PHE 2.80 -0.40 1 15 LEU 3.87 -0.71 1 16 LEU 4.44 -1.37 1 17 LYS 4.41 -1.36 1 19 LEU 5.09 -1.56 1 20 GLU 3.88 -1.63 1 21 GLN 5.38 -1.76 1 22 VAL 7.09 -1.74 1 23 ARG 3.95 -1.11 1 24 LYS 3.38 -0.33 1 25 ILE 5.59 -1.65 1 26 GLN 4.48 -0.80 1 28 ASP 3.33 -1.74 1 31 ALA 3.93 -1.46 1 32 LEU 3.97 -0.85 1 33 GLN 4.44 -0.10 1 34 GLU 4.82 -2.20 1 35 LYS 3.56 -0.55 1 36 LEU 4.46 -0.71 1 38 ALA 2.98 -0.31 1 39 THR 4.29 -0.43 1 40 TYR -1.66 0.61 1 41 LYS 6.16 -4.72 1 42 LEU -1.20 -0.49 1 46 GLU 4.88 -2.26 1 47 GLU 0.85 -0.49 1 48 LEU -1.11 -0.05 1 49 VAL 4.55 -1.06 1 50 LEU 4.88 -1.84 1 51 LEU 3.59 -1.35 1 53 HIS 3.75 -0.82 1 54 SER 3.68 -0.90 1 55 LEU -0.22 0.51 1 57 ILE 1.01 -0.52 1 59 TRP -3.17 0.74 1 60 ALA -2.40 1.95 1 62 LEU -0.70 0.07 1 63 SER 1.41 -0.34 1 64 SER 1.27 -0.87 1 67 SER 2.66 -0.63 1 68 GLN -0.70 0.28 1 69 ALA 1.61 -1.62 1 70 LEU 1.79 -0.33 1 71 GLN -0.45 -0.73 1 72 LEU 4.27 -0.26 1 73 ALA 5.19 -1.42 1 76 LEU 5.34 -1.85 1 77 SER 1.66 -0.45 1 78 GLN 4.47 -0.40 1 79 LEU 3.95 -0.21 1 80 HIS 8.21 -0.63 1 83 LEU 3.20 -0.12 1 84 PHE 3.51 -0.88 1 85 LEU 5.03 -1.50 1 86 TYR 8.07 -1.24 1 87 GLN 5.21 -0.59 1 89 LEU 2.15 0.66 1 90 LEU 3.26 -0.77 1 91 GLN 4.27 -1.19 1 92 ALA 2.89 -1.41 1 93 LEU 1.82 -1.21 1 94 GLU 3.30 -3.60 1 99 GLU 3.79 -1.68 1 100 LEU -0.92 -0.01 1 103 THR 6.22 -1.29 1 104 LEU 4.02 -1.30 1 105 ASP 5.13 -2.44 1 106 THR 5.71 -0.55 1 107 LEU 3.03 -0.25 1 108 GLN 4.77 0.01 1 109 LEU 3.84 -0.82 1 110 ASP 5.07 -2.32 1 111 VAL 6.70 -1.21 1 113 ASP 4.25 -1.72 1 114 PHE -0.72 -0.04 1 115 ALA 5.85 -1.98 1 116 THR 6.25 -1.09 1 117 THR 6.61 -1.04 1 118 ILE 5.33 -1.28 1 119 TRP 2.94 0.18 1 120 GLN 4.47 -1.44 1 121 GLN 1.54 0.42 1 122 MET 4.65 -0.02 1 123 GLU 4.23 -2.21 1 124 GLU 3.94 -1.85 1 125 LEU -0.53 -0.02 1 127 MET -0.99 0.69 1 128 ALA -0.11 -0.44 1 130 ALA 0.52 -0.17 1 131 LEU 0.51 -0.50 1 134 THR -0.44 0.21 1 135 GLN -0.38 0.49 1 137 ALA 0.10 -0.29 1 138 MET -2.89 1.77 1 140 ALA -2.13 0.24 1 141 PHE -0.60 -0.67 1 142 ALA 0.67 0.88 1 143 SER -5.41 2.97 1 144 ALA 4.82 -1.56 1 145 PHE 4.66 -0.60 1 146 GLN 5.32 -1.16 1 147 ARG 4.02 -0.10 1 148 ARG 4.64 -0.87 1 149 ALA 2.55 -0.48 1 152 VAL 5.97 -1.69 1 153 LEU 2.12 0.94 1 154 VAL 6.33 -1.07 1 155 ALA 5.16 -1.78 1 156 SER 4.30 -1.02 1 157 HIS 5.45 -1.26 1 158 LEU 4.02 -1.37 1 159 GLN 5.32 -1.72 1 160 SER 5.38 -1.42 1 161 PHE 3.78 -0.25 1 162 LEU 2.97 -1.16 1 163 GLU 4.35 -1.52 1 164 VAL 6.13 -1.84 1 166 TYR 4.90 -0.57 1 167 ARG 4.88 -0.97 1 168 VAL 4.40 -0.75 1 169 LEU 3.72 -0.68 1 170 ARG 4.77 -2.01 1 171 HIS 4.08 -1.30 1 172 LEU 1.57 -0.19 1 173 ALA 0.35 -0.10 1 174 GLN -1.88 -0.40 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18291_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.41 _LACS_plot.Line_1_terminator_val_y_1 -2.60 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 8.20 _LACS_plot.Line_2_terminator_val_y_2 3.20 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 143 SER -5.41 -0.42 0 12 GLN 4.91 2.10 1 14 PHE 2.80 0.88 1 15 LEU 3.87 0.83 1 16 LEU 4.44 2.33 1 17 LYS 4.41 2.52 1 19 LEU 5.09 1.42 1 20 GLU 3.88 2.70 1 21 GLN 5.38 2.63 1 22 VAL 7.09 1.09 1 23 ARG 3.95 3.45 1 24 LYS 3.38 2.43 1 25 ILE 5.59 0.77 1 26 GLN 4.48 4.32 1 28 ASP 3.33 3.21 1 31 ALA 3.93 2.64 1 32 LEU 3.97 0.26 1 33 GLN 4.44 3.15 1 34 GLU 4.82 2.26 1 35 LYS 3.56 3.71 1 36 LEU 4.46 1.33 1 38 ALA 2.98 1.56 1 39 THR 4.29 0.54 1 40 TYR -1.66 -1.34 1 41 LYS 6.16 -0.54 1 42 LEU -1.20 -2.26 1 46 GLU 4.88 1.38 1 47 GLU 0.85 0.51 1 48 LEU -1.11 -1.03 1 49 VAL 4.55 1.98 1 50 LEU 4.88 2.09 1 51 LEU 3.59 1.76 1 53 HIS 3.75 3.13 1 54 SER 3.68 1.28 1 55 LEU -0.22 -0.18 1 59 TRP -3.17 0.17 1 62 LEU -0.70 0.43 1 63 SER 1.41 1.38 1 64 SER 1.27 -1.53 1 67 SER 2.66 0.02 1 68 GLN -0.70 -1.41 1 69 ALA 1.61 -1.62 1 70 LEU 1.79 -0.79 1 71 GLN -0.45 -0.04 1 72 LEU 4.27 0.18 1 73 ALA 5.19 2.85 1 76 LEU 5.34 1.21 1 77 SER 1.66 0.33 1 78 GLN 4.47 4.34 1 79 LEU 3.95 0.86 1 80 HIS 8.21 2.21 1 83 LEU 3.20 0.55 1 84 PHE 3.51 2.66 1 85 LEU 5.03 -2.01 1 86 TYR 8.07 2.77 1 87 GLN 5.21 2.61 1 89 LEU 2.15 0.43 1 90 LEU 3.26 2.66 1 91 GLN 4.27 2.73 1 92 ALA 2.89 0.05 1 93 LEU 1.82 -0.95 1 94 GLU 3.30 0.05 1 99 GLU 3.79 0.77 1 100 LEU -0.92 -0.62 1 103 THR 6.22 2.36 1 104 LEU 4.02 0.42 1 105 ASP 5.13 1.77 1 106 THR 5.71 -0.02 1 107 LEU 3.03 0.03 1 108 GLN 4.77 2.36 1 109 LEU 3.84 1.64 1 110 ASP 5.07 3.76 1 113 ASP 4.25 2.20 1 114 PHE -0.72 1.39 1 115 ALA 5.85 2.45 1 116 THR 6.25 1.21 1 117 THR 6.61 2.97 1 119 TRP 2.94 1.54 1 120 GLN 4.47 2.74 1 121 GLN 1.54 2.39 1 122 MET 4.65 2.13 1 123 GLU 4.23 3.50 1 124 GLU 3.94 1.13 1 125 LEU -0.53 -0.64 1 127 MET -0.99 -2.06 1 130 ALA 0.52 -0.12 1 131 LEU 0.51 -0.53 1 134 THR -0.44 -0.35 1 135 GLN -0.38 0.23 1 137 ALA 0.10 -0.17 1 140 ALA -2.13 -1.26 1 141 PHE -0.60 -0.55 1 142 ALA 0.67 -0.47 1 144 ALA 4.82 2.03 1 145 PHE 4.66 1.05 1 146 GLN 5.32 2.49 1 147 ARG 4.02 0.98 1 148 ARG 4.64 0.58 1 149 ALA 2.55 2.21 1 152 VAL 5.97 2.73 1 153 LEU 2.12 1.56 1 154 VAL 6.33 1.01 1 155 ALA 5.16 1.37 1 156 SER 4.30 2.73 1 157 HIS 5.45 2.96 1 158 LEU 4.02 0.40 1 159 GLN 5.32 3.52 1 160 SER 5.38 1.66 1 161 PHE 3.78 3.13 1 162 LEU 2.97 0.81 1 163 GLU 4.35 2.74 1 164 VAL 6.13 2.07 1 166 TYR 4.90 0.28 1 167 ARG 4.88 3.46 1 168 VAL 4.40 2.04 1 169 LEU 3.72 1.04 1 170 ARG 4.77 2.34 1 171 HIS 4.08 2.45 1 172 LEU 1.57 -0.22 1 173 ALA 0.35 -0.81 1 stop_ save_