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 bmr15071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.85 _LACS_plot.Line_1_terminator_val_y_1 -5.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.07 _LACS_plot.Line_2_terminator_val_x_2 8.91 _LACS_plot.Line_2_terminator_val_y_2 4.09 _LACS_plot.Y_axis_chem_shift_offset 2.62 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 HIS 2.66 4.03 0 72 LEU 2.98 -5.38 0 10 VAL 4.69 0.71 1 11 GLU 3.23 0.22 1 12 LEU 3.58 0.34 1 13 LYS 4.31 0.32 1 14 GLN 3.86 -0.06 1 15 SER 4.19 1.10 1 16 THR 1.83 -1.31 1 17 ALA 3.51 0.22 1 18 GLN 3.67 -0.45 1 19 ALA 2.03 -0.89 1 21 GLU -1.95 -1.99 1 30 SER 3.96 0.13 1 31 ASP 5.23 0.76 1 33 LEU 3.42 -0.36 1 34 LYS -0.09 -3.28 1 36 ARG 0.17 -2.53 1 37 LEU -0.52 -5.56 1 39 VAL 4.36 0.39 1 40 ALA 4.48 0.76 1 42 PHE 3.98 0.72 1 44 ARG 8.52 3.44 1 50 TRP 4.27 0.28 1 51 LEU 2.48 -1.35 1 52 PHE 8.91 3.92 1 53 TYR 1.84 -0.36 1 55 ALA 3.93 0.48 1 56 LEU 5.07 0.79 1 59 ALA 5.29 1.72 1 60 VAL 4.15 0.32 1 61 ASP 2.38 -0.33 1 62 ALA 4.85 1.28 1 63 VAL 5.09 1.53 1 64 ARG 3.07 -0.70 1 65 ALA -0.39 -1.68 1 66 SER -1.23 -2.82 1 68 PHE 1.26 -3.40 1 69 ALA 4.82 1.97 1 70 GLU 2.44 -1.30 1 71 SER 0.34 -1.28 1 73 LEU -2.22 -3.26 1 74 ASP 2.46 -1.24 1 76 ALA 2.23 -2.60 1 77 LEU 2.17 -1.36 1 78 ASN 6.42 3.19 1 80 ALA 3.67 -0.12 1 81 GLU 4.84 0.68 1 82 VAL 2.21 -0.36 1 83 LEU 4.53 0.88 1 85 ARG 5.21 1.27 1 86 ASP 3.91 0.18 1 87 LEU 4.54 0.39 1 88 ASP 2.44 -0.20 1 90 LEU 0.23 -0.98 1 91 ASN -1.25 -3.54 1 93 SER -0.34 -2.92 1 94 SER 2.45 -1.31 1 95 GLU 1.02 -2.61 1 96 TRP 4.56 0.28 1 97 ARG 0.43 -2.30 1 98 SER 0.43 -1.68 1 100 ILE -2.83 -4.19 1 101 THR -1.79 -3.42 1 102 ALA 2.93 -1.14 1 103 SER 5.57 1.75 1 106 VAL 5.33 1.32 1 107 ILE 3.80 0.44 1 108 ASP -0.79 -3.84 1 109 TYR 6.94 1.85 1 110 VAL 4.53 0.57 1 111 ASN 2.92 0.17 1 115 GLU 4.41 0.77 1 117 ARG 4.49 0.18 1 118 ASP 0.13 -2.88 1 119 ASN 4.62 -1.99 1 120 VAL -1.28 -4.69 1 121 ASP 2.22 -0.53 1 124 ALA 3.23 0.48 1 127 ALA 3.10 3.49 1 129 HIS 3.88 0.74 1 130 TYR 5.65 1.55 1 131 VAL 2.67 -0.40 1 132 ARG 5.39 1.26 1 133 TYR 6.08 0.07 1 134 LEU 3.96 0.67 1 136 ASP 1.53 -0.81 1 137 LEU 2.15 -0.84 1 138 SER 3.91 0.19 1 141 GLN 4.44 0.68 1 142 VAL 5.16 1.85 1 143 ILE 4.03 0.31 1 144 ALA 4.34 0.75 1 145 ARG 3.30 0.86 1 148 GLN 3.24 0.19 1 149 ARG 2.01 0.33 1 150 HIS -3.52 -5.46 1 151 TYR 2.09 -1.56 1 153 VAL -1.30 -2.31 1 154 ASP 2.25 -1.38 1 156 GLU -1.38 -4.06 1 157 ALA -1.60 -4.50 1 158 LEU 2.45 0.42 1 160 PHE 0.67 -1.89 1 161 TYR -3.70 -3.05 1 162 HIS -0.80 -4.19 1 163 PHE 2.29 -0.85 1 164 GLU -0.29 -3.52 1 166 ILE 1.30 -1.51 1 167 ALA -1.55 -4.26 1 168 LYS 3.51 -0.14 1 171 VAL 3.72 1.44 1 172 TYR 3.46 -0.06 1 175 GLU 3.79 1.17 1 176 TYR 5.38 1.67 1 177 ARG 3.47 -0.21 1 178 GLU 2.96 -0.35 1 180 LEU 2.54 -1.21 1 181 ASN -1.17 -2.84 1 182 ASN 1.02 -2.23 1 183 LEU 0.78 -2.78 1 184 GLU -5.85 -5.39 1 185 LEU -2.73 -4.04 1 186 SER 5.39 1.33 1 187 ASP 3.51 0.28 1 188 GLU 1.80 0.05 1 189 GLN 4.60 1.15 1 190 ARG 3.78 0.36 1 191 GLU 3.96 0.42 1 194 LEU 3.95 0.05 1 197 ALA 4.43 0.25 1 200 ALA 5.20 2.39 1 201 PHE 3.63 1.56 1 204 ASN 3.80 0.43 1 210 ASP 1.14 -1.38 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.85 _LACS_plot.Line_1_terminator_val_y_1 0.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.07 _LACS_plot.Line_2_terminator_val_x_2 8.91 _LACS_plot.Line_2_terminator_val_y_2 -4.82 _LACS_plot.Y_axis_chem_shift_offset 2.62 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 HIS 2.66 1.37 0 72 LEU 2.98 -8.36 0 10 VAL 4.69 -3.98 1 11 GLU 3.23 -3.01 1 12 LEU 3.58 -3.24 1 13 LYS 4.31 -3.99 1 14 GLN 3.86 -3.92 1 15 SER 4.19 -3.09 1 16 THR 1.83 -3.14 1 17 ALA 3.51 -3.29 1 18 GLN 3.67 -4.12 1 19 ALA 2.03 -2.92 1 21 GLU -1.95 -0.04 1 30 SER 3.96 -3.83 1 31 ASP 5.23 -4.47 1 33 LEU 3.42 -3.78 1 34 LYS -0.09 -3.19 1 36 ARG 0.17 -2.70 1 37 LEU -0.52 -5.04 1 39 VAL 4.36 -3.97 1 40 ALA 4.48 -3.72 1 42 PHE 3.98 -3.26 1 44 ARG 8.52 -5.08 1 50 TRP 4.27 -3.99 1 51 LEU 2.48 -3.83 1 52 PHE 8.91 -4.99 1 53 TYR 1.84 -2.20 1 55 ALA 3.93 -3.45 1 56 LEU 5.07 -4.28 1 59 ALA 5.29 -3.57 1 60 VAL 4.15 -3.83 1 61 ASP 2.38 -2.71 1 62 ALA 4.85 -3.57 1 63 VAL 5.09 -3.56 1 64 ARG 3.07 -3.77 1 65 ALA -0.39 -1.29 1 66 SER -1.23 -1.59 1 68 PHE 1.26 -4.66 1 69 ALA 4.82 -2.85 1 70 GLU 2.44 -3.74 1 71 SER 0.34 -1.62 1 73 LEU -2.22 -1.04 1 74 ASP 2.46 -3.70 1 76 ALA 2.23 -4.83 1 77 LEU 2.17 -3.53 1 78 ASN 6.42 -3.23 1 80 ALA 3.67 -3.79 1 81 GLU 4.84 -4.16 1 82 VAL 2.21 -2.57 1 83 LEU 4.53 -3.65 1 85 ARG 5.21 -3.94 1 86 ASP 3.91 -3.73 1 87 LEU 4.54 -4.15 1 88 ASP 2.44 -2.64 1 90 LEU 0.23 -1.21 1 91 ASN -1.25 -2.29 1 93 SER -0.34 -2.58 1 94 SER 2.45 -3.76 1 95 GLU 1.02 -3.63 1 96 TRP 4.56 -4.28 1 97 ARG 0.43 -2.73 1 98 SER 0.43 -2.11 1 100 ILE -2.83 -1.36 1 101 THR -1.79 -1.63 1 102 ALA 2.93 -4.07 1 103 SER 5.57 -3.82 1 106 VAL 5.33 -4.01 1 107 ILE 3.80 -3.36 1 108 ASP -0.79 -3.05 1 109 TYR 6.94 -5.09 1 110 VAL 4.53 -3.96 1 111 ASN 2.92 -2.75 1 115 GLU 4.41 -3.64 1 117 ARG 4.49 -4.31 1 118 ASP 0.13 -3.01 1 119 ASN 4.62 -6.61 1 120 VAL -1.28 -3.41 1 121 ASP 2.22 -2.75 1 124 ALA 3.23 -2.75 1 127 ALA 3.10 0.39 1 129 HIS 3.88 -3.14 1 130 TYR 5.65 -4.10 1 131 VAL 2.67 -3.07 1 132 ARG 5.39 -4.13 1 133 TYR 6.08 -6.01 1 134 LEU 3.96 -3.29 1 136 ASP 1.53 -2.34 1 137 LEU 2.15 -2.99 1 138 SER 3.91 -3.72 1 141 GLN 4.44 -3.76 1 142 VAL 5.16 -3.31 1 143 ILE 4.03 -3.72 1 144 ALA 4.34 -3.59 1 145 ARG 3.30 -2.44 1 148 GLN 3.24 -3.05 1 149 ARG 2.01 -1.68 1 150 HIS -3.52 -1.94 1 151 TYR 2.09 -3.65 1 153 VAL -1.30 -1.01 1 154 ASP 2.25 -3.63 1 156 GLU -1.38 -2.68 1 157 ALA -1.60 -2.90 1 158 LEU 2.45 -2.03 1 160 PHE 0.67 -2.56 1 161 TYR -3.70 0.65 1 162 HIS -0.80 -3.39 1 163 PHE 2.29 -3.14 1 164 GLU -0.29 -3.23 1 166 ILE 1.30 -2.81 1 167 ALA -1.55 -2.71 1 168 LYS 3.51 -3.65 1 171 VAL 3.72 -2.28 1 172 TYR 3.46 -3.52 1 175 GLU 3.79 -2.62 1 176 TYR 5.38 -3.71 1 177 ARG 3.47 -3.68 1 178 GLU 2.96 -3.31 1 180 LEU 2.54 -3.75 1 181 ASN -1.17 -1.67 1 182 ASN 1.02 -3.25 1 183 LEU 0.78 -3.56 1 184 GLU -5.85 0.46 1 185 LEU -2.73 -1.31 1 186 SER 5.39 -4.06 1 187 ASP 3.51 -3.23 1 188 GLU 1.80 -1.75 1 189 GLN 4.60 -3.45 1 190 ARG 3.78 -3.42 1 191 GLU 3.96 -3.54 1 194 LEU 3.95 -3.90 1 197 ALA 4.43 -4.18 1 200 ALA 5.20 -2.81 1 201 PHE 3.63 -2.07 1 204 ASN 3.80 -3.37 1 210 ASP 1.14 -2.52 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.85 _LACS_plot.Line_1_terminator_val_y_1 -3.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 8.91 _LACS_plot.Line_2_terminator_val_y_2 2.35 _LACS_plot.Y_axis_chem_shift_offset 0.83 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 LEU -0.52 -5.30 0 184 GLU -5.85 -1.30 0 10 VAL 4.69 0.80 1 11 GLU 3.23 2.50 1 12 LEU 3.58 0.50 1 13 LYS 4.31 1.10 1 14 GLN 3.86 2.50 1 15 SER 4.19 0.80 1 16 THR 1.83 -0.50 1 17 ALA 3.51 1.10 1 18 GLN 3.67 0.90 1 19 ALA 2.03 0.20 1 30 SER 3.96 1.00 1 33 LEU 3.42 -1.70 1 39 VAL 4.36 0.70 1 42 PHE 8.52 1.90 1 50 TRP 4.27 1.70 1 51 LEU 2.48 1.00 1 52 PHE 8.91 1.80 1 53 TYR 1.84 0.60 1 55 ALA 5.07 -0.10 1 59 ALA 5.29 0.40 1 60 VAL 4.15 2.00 1 61 ASP 2.38 1.30 1 62 ALA 4.85 2.60 1 63 VAL 5.09 2.40 1 64 ARG 3.07 -0.50 1 65 ALA -0.39 -0.90 1 66 SER -1.23 -4.30 1 68 PHE 1.26 -1.10 1 69 ALA 4.82 0.80 1 70 GLU 2.44 0.50 1 71 SER 0.34 0.00 1 72 LEU 2.98 -2.00 1 73 LEU 2.46 0.10 1 76 ALA 2.23 -1.90 1 77 LEU 2.17 2.10 1 78 ASN 6.42 0.00 1 80 ALA 3.67 1.80 1 81 GLU 4.84 0.20 1 82 VAL 2.21 -1.00 1 83 LEU 4.53 2.60 1 85 ARG 5.21 1.80 1 86 ASP 3.91 1.10 1 87 LEU 4.54 2.50 1 88 ASP 2.44 0.40 1 90 LEU 0.23 0.20 1 91 ASN -0.34 0.70 1 94 SER 2.45 -1.30 1 95 GLU 1.02 -0.20 1 96 TRP 4.56 0.20 1 97 ARG 0.43 -1.40 1 98 SER 0.43 -2.20 1 100 ILE -2.83 -2.30 1 101 THR -1.79 -1.30 1 102 ALA 5.57 -0.10 1 106 VAL 5.33 1.00 1 107 ILE 3.80 0.50 1 108 ASP 6.94 0.30 1 110 VAL 2.92 1.60 1 115 GLU 4.41 1.00 1 117 ARG 4.49 0.30 1 118 ASP 0.13 -2.40 1 119 ASN 4.62 -3.10 1 120 VAL -1.28 -2.10 1 121 ASP 2.22 0.30 1 124 ALA 3.23 -0.30 1 127 ALA 3.10 2.50 1 128 HIS 2.66 0.80 1 129 HIS 3.88 1.00 1 130 TYR 5.65 0.80 1 131 VAL 2.67 -0.40 1 132 ARG 6.08 1.90 1 134 LEU 3.96 1.70 1 136 ASP 1.53 -0.50 1 137 LEU 3.91 1.70 1 141 GLN 4.44 0.10 1 142 VAL 5.16 0.60 1 143 ILE 4.03 1.00 1 144 ALA 3.30 0.80 1 148 GLN -3.52 -0.60 1 151 TYR 2.09 -2.70 1 153 VAL 2.25 -1.90 1 156 GLU -1.38 -4.60 1 157 ALA -1.60 0.40 1 158 LEU 2.45 -1.80 1 160 PHE 0.67 -3.10 1 161 TYR -3.70 -1.90 1 162 HIS -0.80 -1.50 1 163 PHE 2.29 0.00 1 164 GLU -0.29 -3.10 1 166 ILE 1.30 -0.40 1 167 ALA 3.51 0.20 1 171 VAL 3.72 1.30 1 172 TYR 3.46 1.00 1 175 GLU 3.79 0.50 1 176 TYR 5.38 0.30 1 177 ARG 3.47 1.20 1 178 GLU 2.96 -0.20 1 180 LEU 2.54 0.20 1 181 ASN -1.17 -1.30 1 182 ASN 1.02 -2.30 1 183 LEU 0.78 -2.70 1 185 LEU -2.73 -0.90 1 186 SER 5.39 1.30 1 187 ASP 1.80 1.20 1 189 GLN 4.60 0.00 1 190 ARG 3.96 1.50 1 194 LEU 3.95 -0.10 1 197 ALA 4.43 0.70 1 200 ALA 5.20 2.00 1 201 PHE 3.63 -0.50 1 204 ASN 3.80 2.30 1 stop_ save_