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 bmr34103_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.45 _LACS_plot.Line_1_terminator_val_y_1 -3.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.51 _LACS_plot.Line_2_terminator_val_x_2 6.38 _LACS_plot.Line_2_terminator_val_y_2 5.10 _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 73 HIS 2.84 5.49 0 10 MET 3.45 3.02 1 11 LEU 2.33 1.84 1 12 ALA 1.52 1.12 1 13 ALA -0.22 0.13 1 14 ASN -1.53 0.25 1 17 LYS -1.33 -0.17 1 18 THR 1.07 0.31 1 20 ILE 4.27 5.14 1 21 SER 5.81 4.64 1 22 LEU 2.56 3.03 1 23 LEU 3.66 2.58 1 24 GLN 5.31 3.87 1 25 GLU 3.70 3.15 1 26 TYR 4.28 4.15 1 28 THR 5.81 4.85 1 29 ARG 3.91 2.93 1 30 ILE 0.30 0.16 1 32 LYS -4.42 -2.37 1 33 THR 0.98 1.09 1 35 VAL -2.72 -0.73 1 36 TYR -2.51 -0.53 1 37 ASP -4.72 -0.79 1 38 LEU 1.71 0.18 1 39 LEU -0.12 0.66 1 40 LYS -3.17 -0.20 1 41 ALA -3.23 -1.01 1 42 GLU -5.06 -1.77 1 44 GLN -1.01 0.21 1 45 ALA 2.71 2.39 1 47 GLN -0.54 0.12 1 49 ASN -2.76 0.02 1 50 PHE -2.09 0.29 1 51 THR -0.38 0.22 1 52 PHE -5.46 -0.72 1 53 ARG -5.59 -1.98 1 54 VAL -6.45 -3.84 1 55 THR -1.54 -0.39 1 56 VAL -2.35 -2.02 1 58 ASP 0.24 0.24 1 59 THR 0.83 1.39 1 60 SER -3.27 -1.51 1 62 THR -4.79 -2.18 1 64 GLN -6.10 -2.03 1 67 SER -5.81 -2.67 1 68 LYS 6.39 5.24 1 69 LYS 4.74 3.04 1 70 ALA 3.15 2.77 1 71 ALA 1.72 2.82 1 72 LYS 5.23 4.79 1 74 LYS 3.89 1.60 1 75 ALA 5.00 3.05 1 76 ALA 4.00 2.83 1 77 GLU 2.99 3.50 1 78 VAL 5.60 4.64 1 79 ALA 4.27 3.42 1 80 LEU 3.44 3.34 1 81 LYS 4.20 3.42 1 82 HIS 3.32 4.15 1 83 LEU 1.63 1.75 1 84 LYS 1.83 1.43 1 147 ASN -1.12 -1.62 1 149 VAL 3.91 3.57 1 151 ALA 2.07 1.71 1 152 LEU 3.18 1.97 1 153 GLN 4.98 3.99 1 154 GLU 2.98 2.43 1 155 LEU 1.84 2.06 1 156 VAL 5.10 3.58 1 157 VAL 4.05 2.99 1 158 GLN 3.27 2.17 1 159 LYS 0.45 -0.90 1 161 TRP -7.18 -4.95 1 162 ARG -0.14 -0.38 1 163 LEU 1.77 0.40 1 165 GLU -5.87 -2.80 1 166 TYR -3.57 -1.76 1 167 THR -2.55 -1.32 1 168 VAL 1.45 0.11 1 169 THR 1.24 -0.26 1 170 GLN -3.17 0.00 1 171 GLU -5.34 -2.62 1 172 SER -3.02 -1.85 1 175 ALA 2.77 2.37 1 177 ARG -1.13 -1.64 1 178 LYS -2.51 -1.14 1 179 GLU -5.08 -2.01 1 180 PHE -3.88 -0.86 1 181 THR -0.40 -0.59 1 182 MET -7.67 -2.74 1 183 THR -1.21 -1.38 1 185 ARG -4.96 -2.35 1 186 VAL -5.03 -1.77 1 187 GLU 3.92 0.98 1 188 ARG 0.25 -1.09 1 189 PHE -3.75 -2.07 1 190 ILE -4.41 -1.60 1 191 GLU -8.45 -3.21 1 192 ILE -4.41 -1.96 1 194 SER -4.66 -2.50 1 196 THR 2.49 0.02 1 197 SER -5.89 -3.54 1 198 LYS 5.50 4.20 1 199 LYS 3.73 2.82 1 200 LEU 1.94 1.71 1 201 ALA 3.07 2.49 1 202 LYS 2.95 3.40 1 203 ARG 3.01 3.04 1 204 ASN 2.12 2.11 1 205 ALA 2.89 2.22 1 206 ALA 2.04 1.90 1 207 ALA 2.79 2.04 1 208 LYS 2.65 2.46 1 209 MET 0.20 0.27 1 210 LEU 2.21 2.24 1 211 LEU 1.51 1.02 1 212 ARG 0.77 -0.01 1 213 VAL 0.11 -0.41 1 214 HIS -0.77 0.31 1 215 THR 1.17 1.14 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34103_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.45 _LACS_plot.Line_1_terminator_val_y_1 4.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.49 _LACS_plot.Line_2_terminator_val_x_2 6.38 _LACS_plot.Line_2_terminator_val_y_2 -1.28 _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 73 HIS 2.84 2.65 0 10 MET 3.45 -0.43 1 11 LEU 2.33 -0.49 1 12 ALA 1.52 -0.40 1 13 ALA -0.22 0.35 1 14 ASN -1.53 1.78 1 17 LYS -1.33 1.16 1 18 THR 1.07 -0.76 1 20 ILE 4.27 0.87 1 21 SER 5.81 -1.17 1 22 LEU 2.56 0.47 1 23 LEU 3.66 -1.08 1 24 GLN 5.31 -1.44 1 25 GLU 3.70 -0.55 1 26 TYR 4.28 -0.13 1 28 THR 5.81 -0.96 1 29 ARG 3.91 -0.98 1 30 ILE 0.30 -0.14 1 32 LYS -4.42 2.05 1 33 THR 0.98 0.11 1 35 VAL -2.72 1.99 1 36 TYR -2.51 1.98 1 37 ASP -4.72 3.93 1 38 LEU 1.71 -1.53 1 39 LEU -0.12 0.78 1 40 LYS -3.17 2.97 1 41 ALA -3.23 2.22 1 42 GLU -5.06 3.29 1 44 GLN -1.01 1.22 1 45 ALA 2.71 -0.32 1 47 GLN -0.54 0.66 1 49 ASN -2.76 2.78 1 50 PHE -2.09 2.38 1 51 THR -0.38 0.60 1 52 PHE -5.46 4.74 1 53 ARG -5.59 3.61 1 54 VAL -6.45 2.61 1 55 THR -1.54 1.15 1 56 VAL -2.35 0.33 1 58 ASP 0.24 0.00 1 59 THR 0.83 0.56 1 60 SER -3.27 1.76 1 62 THR -4.79 2.61 1 64 GLN -6.10 4.07 1 67 SER -5.81 3.14 1 68 LYS 6.39 -1.15 1 69 LYS 4.74 -1.70 1 70 ALA 3.15 -0.38 1 71 ALA 1.72 1.10 1 72 LYS 5.23 -0.44 1 74 LYS 3.89 -2.29 1 75 ALA 5.00 -1.95 1 76 ALA 4.00 -1.17 1 77 GLU 2.99 0.51 1 78 VAL 5.60 -0.96 1 79 ALA 4.27 -0.85 1 80 LEU 3.44 -0.10 1 81 LYS 4.20 -0.78 1 82 HIS 3.32 0.83 1 83 LEU 1.63 0.12 1 84 LYS 1.83 -0.40 1 147 ASN -1.12 -0.50 1 149 VAL 3.91 -0.34 1 151 ALA 2.07 -0.36 1 152 LEU 3.18 -1.21 1 153 GLN 4.98 -0.99 1 154 GLU 2.98 -0.55 1 155 LEU 1.84 0.22 1 156 VAL 5.10 -1.52 1 157 VAL 4.05 -1.06 1 158 GLN 3.27 -1.10 1 159 LYS 0.45 -1.35 1 161 TRP -7.18 2.23 1 162 ARG -0.14 -0.24 1 163 LEU 1.77 -1.37 1 165 GLU -5.87 3.07 1 166 TYR -3.57 1.81 1 167 THR -2.55 1.23 1 168 VAL 1.45 -1.34 1 169 THR 1.24 -1.50 1 170 GLN -3.17 3.17 1 171 GLU -5.34 2.72 1 172 SER -3.02 1.17 1 175 ALA 2.77 -0.40 1 177 ARG -1.13 -0.51 1 178 LYS -2.51 1.37 1 179 GLU -5.08 3.07 1 180 PHE -3.88 3.02 1 181 THR -0.40 -0.19 1 182 MET -7.67 4.93 1 183 THR -1.21 -0.17 1 185 ARG -4.96 2.61 1 186 VAL -5.03 3.26 1 187 GLU 3.92 -2.94 1 188 ARG 0.25 -1.34 1 189 PHE -3.75 1.68 1 190 ILE -4.41 2.81 1 191 GLU -8.45 5.24 1 192 ILE -4.41 2.45 1 194 SER -4.66 2.16 1 196 THR 2.49 -2.47 1 197 SER -5.89 2.35 1 198 LYS 5.50 -1.30 1 199 LYS 3.73 -0.91 1 200 LEU 1.94 -0.23 1 201 ALA 3.07 -0.58 1 202 LYS 2.95 0.45 1 203 ARG 3.01 0.03 1 204 ASN 2.12 -0.01 1 205 ALA 2.89 -0.67 1 206 ALA 2.04 -0.14 1 207 ALA 2.79 -0.75 1 208 LYS 2.65 -0.19 1 209 MET 0.20 0.07 1 210 LEU 2.21 0.03 1 211 LEU 1.51 -0.49 1 212 ARG 0.77 -0.78 1 213 VAL 0.11 -0.52 1 214 HIS -0.77 1.08 1 215 THR 1.17 -0.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34103_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.45 _LACS_plot.Line_1_terminator_val_y_1 0.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 6.38 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 GLN -6.10 2.09 0 10 MET 3.45 -0.21 1 11 LEU 2.33 -0.12 1 12 ALA 1.52 -0.07 1 13 ALA -0.22 0.08 1 14 ASN -1.53 0.15 1 17 LYS -1.33 0.37 1 18 THR 1.07 0.04 1 20 ILE 4.27 -0.50 1 21 SER 5.81 -0.20 1 22 LEU 2.56 -0.25 1 23 LEU 3.66 -0.01 1 24 GLN 5.31 -0.35 1 25 GLU 3.70 -0.21 1 26 TYR 4.28 -0.38 1 28 THR 5.81 -0.31 1 29 ARG 3.91 -0.16 1 30 ILE 0.30 0.36 1 32 LYS -4.42 0.42 1 33 THR 0.98 -0.20 1 35 VAL -2.72 0.35 1 36 TYR -2.51 1.12 1 37 ASP -4.72 0.50 1 38 LEU 1.71 -0.95 1 39 LEU -0.12 0.13 1 40 LYS -3.17 0.22 1 41 ALA -3.23 0.49 1 42 GLU -5.06 0.39 1 44 GLN -1.01 0.05 1 45 ALA 2.71 -0.18 1 47 GLN -0.54 0.15 1 49 ASN -2.76 0.20 1 50 PHE -2.09 0.55 1 51 THR -0.38 1.12 1 52 PHE -5.46 0.68 1 53 ARG -5.59 1.06 1 54 VAL -6.45 1.09 1 55 THR -1.54 0.81 1 56 VAL -2.35 0.12 1 58 ASP 0.24 0.06 1 59 THR 0.83 0.12 1 60 SER -3.27 1.38 1 62 THR -4.79 1.58 1 67 SER -5.81 0.55 1 68 LYS 6.39 -0.77 1 69 LYS 4.74 -0.69 1 70 ALA 3.15 0.00 1 71 ALA 1.72 -0.37 1 72 LYS 5.23 -0.89 1 73 HIS 2.84 -0.23 1 74 LYS 3.89 0.09 1 75 ALA 5.00 -0.41 1 76 ALA 4.00 -0.20 1 77 GLU 2.99 -0.33 1 78 VAL 5.60 -0.37 1 79 ALA 4.27 0.01 1 80 LEU 3.44 -0.45 1 81 LYS 4.20 -0.28 1 82 HIS 3.32 -0.30 1 83 LEU 1.63 -0.11 1 84 LYS 1.83 -0.07 1 147 ASN -1.12 0.25 1 149 VAL 3.91 -0.54 1 151 ALA 2.07 -0.23 1 152 LEU 3.18 -0.15 1 153 GLN 4.98 -0.44 1 154 GLU 2.98 -0.43 1 155 LEU 1.84 -0.20 1 156 VAL 5.10 -0.54 1 157 VAL 4.05 -0.11 1 158 GLN 3.27 -0.26 1 159 LYS 0.45 -0.42 1 161 TRP -7.18 0.51 1 162 ARG -0.14 -0.03 1 163 LEU 1.77 -0.28 1 165 GLU -5.87 0.45 1 166 TYR -3.57 1.21 1 167 THR -2.55 0.37 1 168 VAL 1.45 0.62 1 169 THR 1.24 0.19 1 170 GLN -3.17 0.30 1 171 GLU -5.34 0.57 1 172 SER -3.02 0.37 1 175 ALA 2.77 -0.31 1 177 ARG -1.13 0.23 1 178 LYS -2.51 0.09 1 179 GLU -5.08 0.23 1 180 PHE -3.88 0.47 1 181 THR -0.40 0.89 1 182 MET -7.67 1.13 1 183 THR -1.21 0.76 1 185 ARG -4.96 1.03 1 186 VAL -5.03 0.16 1 187 GLU 3.92 -0.91 1 188 ARG 0.25 -0.03 1 189 PHE -3.75 0.21 1 190 ILE -4.41 0.97 1 191 GLU -8.45 0.58 1 192 ILE -4.41 1.05 1 194 SER -4.66 1.69 1 196 THR 2.49 0.49 1 197 SER -5.89 0.48 1 198 LYS 5.50 -0.90 1 199 LYS 3.73 -0.45 1 200 LEU 1.94 -0.18 1 201 ALA 3.07 -0.49 1 202 LYS 2.95 -0.61 1 203 ARG 3.01 -0.46 1 204 ASN 2.12 -0.03 1 205 ALA 2.89 -0.35 1 206 ALA 2.04 -0.08 1 207 ALA 2.79 -0.21 1 208 LYS 2.65 -0.20 1 209 MET 0.20 0.08 1 210 LEU 2.21 -0.37 1 211 LEU 1.51 -0.13 1 212 ARG 0.77 -0.20 1 213 VAL 0.11 0.00 1 214 HIS -0.77 0.06 1 215 THR 1.17 -0.17 1 stop_ save_