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 bmr19075_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 -3.10 _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 -2.20 _LACS_plot.Line_2_terminator_val_x_2 7.95 _LACS_plot.Line_2_terminator_val_y_2 5.25 _LACS_plot.Y_axis_chem_shift_offset 0.71 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 ARG 7.58 1.57 0 12 LYS 3.70 1.98 1 14 ARG -1.38 -3.32 1 15 SER -3.95 -1.87 1 16 TYR 4.47 3.50 1 17 GLU 4.57 2.82 1 18 ASP 3.04 3.26 1 19 PHE 5.39 4.54 1 20 GLN 4.01 1.59 1 21 LYS 5.39 3.54 1 22 VAL 7.10 3.24 1 25 ALA 3.14 2.41 1 27 ALA 3.01 2.28 1 31 ARG 2.43 1.28 1 36 TYR -1.04 0.44 1 42 TYR 2.27 1.95 1 56 THR -1.65 -1.62 1 57 TRP 3.31 1.34 1 58 ASP -3.19 -2.13 1 59 LYS 2.06 0.27 1 60 HIS 5.17 3.55 1 61 ASP -2.19 -2.32 1 62 ASN 0.64 -0.06 1 63 THR -3.19 -1.30 1 66 SER 1.32 1.27 1 67 TYR 5.98 4.65 1 70 THR 5.14 2.43 1 72 ARG 2.13 -0.18 1 73 PHE 1.16 -0.47 1 74 LYS 4.09 2.59 1 75 LYS 4.94 3.45 1 76 GLU 0.93 0.95 1 78 ASN 0.31 -0.69 1 79 ASP -0.37 0.38 1 81 SER 4.47 2.99 1 82 ASN -0.57 -1.91 1 83 ALA 3.81 2.30 1 85 LEU 4.59 1.15 1 86 GLN 6.58 3.05 1 90 LYS 4.03 2.09 1 91 PHE 4.63 2.80 1 92 LEU 0.46 -0.09 1 93 GLU 7.95 4.64 1 95 ILE 5.26 1.96 1 97 LYS 3.76 1.78 1 98 GLU 1.97 0.61 1 99 PHE -1.49 -4.07 1 106 ASP 6.48 3.64 1 107 LEU 5.26 2.87 1 108 PHE 1.89 -0.57 1 109 SER 3.79 3.01 1 110 LEU 3.82 1.83 1 113 VAL 6.24 5.10 1 115 ALA 3.29 3.13 1 119 MET 2.89 0.74 1 126 TRP -2.90 -0.95 1 127 ARG -5.42 -3.24 1 132 ASP 3.21 0.36 1 133 THR 1.57 -0.55 1 135 GLU 4.71 3.09 1 136 ASP 3.44 0.96 1 137 THR 0.14 -0.05 1 138 THR 3.02 2.02 1 140 ASP 0.92 -0.03 1 141 ASN 0.28 0.18 1 143 ARG 1.27 0.32 1 148 ASP 0.55 -1.35 1 149 LYS -4.93 -2.50 1 150 ASP -4.17 -2.77 1 151 ALA 2.90 2.74 1 152 ASP 3.75 2.73 1 153 TYR 4.74 3.57 1 154 VAL 7.30 5.76 1 155 ARG 5.99 4.02 1 156 THR 5.77 4.41 1 157 PHE 5.60 3.99 1 158 PHE 5.18 4.58 1 159 GLN 5.97 3.35 1 161 LEU -1.84 -1.53 1 162 ASN 1.78 0.33 1 163 MET -2.89 -2.70 1 164 ASN -2.27 -2.66 1 165 ASP 4.19 3.37 1 166 ARG 5.69 4.09 1 167 GLU 2.69 2.42 1 181 HIS -1.18 -0.46 1 182 LEU 4.81 4.34 1 183 LYS 3.38 1.31 1 187 TYR -0.76 0.43 1 188 GLU -4.22 -1.90 1 193 ALA -0.48 0.25 1 194 ALA 0.86 -1.66 1 195 ASN 1.94 1.17 1 197 VAL -2.42 -1.37 1 198 PHE 2.15 1.20 1 199 THR -4.66 -1.78 1 200 ASN 1.83 -0.43 1 203 TYR 3.69 1.49 1 204 LEU 4.14 2.27 1 205 ASN 6.11 1.98 1 207 LEU 1.38 1.04 1 208 ASN 0.55 1.21 1 209 GLU -1.08 -1.75 1 210 ASP -0.99 -1.84 1 211 TRP -4.26 -1.49 1 212 LYS -3.48 -1.51 1 213 LEU 2.52 -0.66 1 214 GLU -4.41 -2.59 1 215 LYS -0.62 -1.07 1 216 ASN -2.29 -2.52 1 217 ASP 3.50 2.27 1 218 ALA 0.05 -1.50 1 219 ASN 3.29 1.19 1 220 ASN -2.60 -1.82 1 221 GLU -0.65 -1.19 1 222 GLN -4.36 -1.95 1 223 TRP -0.98 -1.86 1 224 ASP -3.65 -2.29 1 225 SER -4.90 -3.61 1 226 LYS 4.13 1.64 1 227 SER 1.47 -0.91 1 229 TYR -5.62 -5.62 1 230 MET -5.85 -2.36 1 231 MET -4.58 -2.41 1 237 SER 4.74 3.21 1 241 ASP -4.77 -1.81 1 243 LYS 4.37 1.95 1 244 TYR 1.40 -0.64 1 245 LEU 4.77 2.80 1 246 SER 4.16 2.80 1 247 ILE 4.56 2.85 1 249 LYS 4.75 3.34 1 250 GLU 3.27 2.40 1 251 TYR 1.13 -2.56 1 253 ASN -0.27 0.42 1 254 ASP -1.52 -1.52 1 255 GLN 3.47 3.54 1 256 ASP 4.19 3.26 1 257 LYS 3.83 2.03 1 258 PHE 3.32 0.56 1 259 PHE 5.08 2.12 1 262 PHE 6.54 5.06 1 263 SER 4.52 3.01 1 264 LYS 3.24 2.26 1 265 ALA 4.08 2.30 1 266 PHE 3.14 2.16 1 267 GLU 7.16 3.03 1 268 LYS 4.03 3.07 1 269 LEU 2.84 2.39 1 271 GLU -0.96 -1.36 1 272 ASN 1.98 -0.04 1 274 ILE 1.05 -0.09 1 275 THR 0.13 -0.35 1 276 PHE 0.91 -0.16 1 278 LYS 4.24 2.28 1 279 ASP 0.48 -1.67 1 280 ALA 1.18 -0.05 1 282 SER 3.77 1.33 1 284 PHE -3.70 -3.91 1 285 ILE -0.22 -2.39 1 286 PHE 1.89 1.17 1 287 LYS -1.61 -1.45 1 288 THR -2.31 -1.96 1 289 LEU 7.18 3.69 1 290 GLU 4.01 2.56 1 291 GLU 2.34 1.73 1 292 GLN -2.01 0.00 1 294 LEU 0.35 -1.65 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19075_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 2.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.20 _LACS_plot.Line_2_terminator_val_x_2 7.95 _LACS_plot.Line_2_terminator_val_y_2 -2.70 _LACS_plot.Y_axis_chem_shift_offset 0.71 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 ARG 7.58 -6.01 0 12 LYS 3.70 -1.72 1 14 ARG -1.38 -1.94 1 15 SER -3.95 2.08 1 16 TYR 4.47 -0.97 1 17 GLU 4.57 -1.75 1 18 ASP 3.04 0.22 1 19 PHE 5.39 -0.85 1 20 GLN 4.01 -2.42 1 21 LYS 5.39 -1.85 1 22 VAL 7.10 -3.86 1 25 ALA 3.14 -0.73 1 27 ALA 3.01 -0.73 1 31 ARG 2.43 -1.15 1 36 TYR -1.04 1.48 1 42 TYR 2.27 -0.32 1 56 THR -1.65 0.03 1 57 TRP 3.31 -1.97 1 58 ASP -3.19 1.06 1 59 LYS 2.06 -1.79 1 60 HIS 5.17 -1.62 1 61 ASP -2.19 -0.13 1 62 ASN 0.64 -0.70 1 63 THR -3.19 1.89 1 66 SER 1.32 -0.05 1 67 TYR 5.98 -1.33 1 70 THR 5.14 -2.71 1 72 ARG 2.13 -2.31 1 73 PHE 1.16 -1.63 1 74 LYS 4.09 -1.50 1 75 LYS 4.94 -1.49 1 76 GLU 0.93 0.02 1 78 ASN 0.31 -1.00 1 79 ASP -0.37 0.75 1 81 SER 4.47 -1.48 1 82 ASN -0.57 -1.34 1 83 ALA 3.81 -1.51 1 85 LEU 4.59 -3.44 1 86 GLN 6.58 -3.53 1 90 LYS 4.03 -1.94 1 91 PHE 4.63 -1.83 1 92 LEU 0.46 -0.55 1 93 GLU 7.95 -3.31 1 95 ILE 5.26 -3.30 1 97 LYS 3.76 -1.98 1 98 GLU 1.97 -1.36 1 99 PHE -1.49 -2.58 1 106 ASP 6.48 -2.84 1 107 LEU 5.26 -2.39 1 108 PHE 1.89 -2.46 1 109 SER 3.79 -0.78 1 110 LEU 3.82 -1.99 1 113 VAL 6.24 -1.14 1 115 ALA 3.29 -0.16 1 119 MET 2.89 -2.15 1 126 TRP -2.90 1.95 1 127 ARG -5.42 2.18 1 132 ASP 3.21 -2.85 1 133 THR 1.57 -2.12 1 135 GLU 4.71 -1.62 1 136 ASP 3.44 -2.48 1 137 THR 0.14 -0.19 1 138 THR 3.02 -1.00 1 140 ASP 0.92 -0.95 1 141 ASN 0.28 -0.10 1 143 ARG 1.27 -0.95 1 148 ASP 0.55 -1.90 1 149 LYS -4.93 2.43 1 150 ASP -4.17 1.40 1 151 ALA 2.90 -0.16 1 152 ASP 3.75 -1.02 1 153 TYR 4.74 -1.17 1 154 VAL 7.30 -1.54 1 155 ARG 5.99 -1.97 1 156 THR 5.77 -1.36 1 157 PHE 5.60 -1.61 1 158 PHE 5.18 -0.60 1 159 GLN 5.97 -2.62 1 161 LEU -1.84 0.31 1 162 ASN 1.78 -1.45 1 163 MET -2.89 0.19 1 164 ASN -2.27 -0.39 1 165 ASP 4.19 -0.82 1 166 ARG 5.69 -1.60 1 167 GLU 2.69 -0.27 1 181 HIS -1.18 0.72 1 182 LEU 4.81 -0.47 1 183 LYS 3.38 -2.07 1 187 TYR -0.76 1.19 1 188 GLU -4.22 2.32 1 193 ALA -0.48 0.73 1 194 ALA 0.86 -2.52 1 195 ASN 1.94 -0.77 1 197 VAL -2.42 1.05 1 198 PHE 2.15 -0.95 1 199 THR -4.66 2.88 1 200 ASN 1.83 -2.26 1 203 TYR 3.69 -2.20 1 204 LEU 4.14 -1.87 1 205 ASN 6.11 -4.13 1 207 LEU 1.38 -0.34 1 208 ASN 0.55 0.66 1 209 GLU -1.08 -0.67 1 210 ASP -0.99 -0.85 1 211 TRP -4.26 2.77 1 212 LYS -3.48 1.97 1 213 LEU 2.52 -3.18 1 214 GLU -4.41 1.82 1 215 LYS -0.62 -0.45 1 216 ASN -2.29 -0.23 1 217 ASP 3.50 -1.23 1 218 ALA 0.05 -1.55 1 219 ASN 3.29 -2.10 1 220 ASN -2.60 0.78 1 221 GLU -0.65 -0.54 1 222 GLN -4.36 2.41 1 223 TRP -0.98 -0.88 1 224 ASP -3.65 1.36 1 225 SER -4.90 1.29 1 226 LYS 4.13 -2.49 1 227 SER 1.47 -2.38 1 229 TYR -5.62 0.00 1 230 MET -5.85 3.49 1 231 MET -4.58 2.17 1 237 SER 4.74 -1.53 1 241 ASP -4.77 2.96 1 243 LYS 4.37 -2.42 1 244 TYR 1.40 -2.04 1 245 LEU 4.77 -1.97 1 246 SER 4.16 -1.36 1 247 ILE 4.56 -1.71 1 249 LYS 4.75 -1.41 1 250 GLU 3.27 -0.87 1 251 TYR 1.13 -3.69 1 253 ASN -0.27 0.69 1 254 ASP -1.52 0.00 1 255 GLN 3.47 0.07 1 256 ASP 4.19 -0.93 1 257 LYS 3.83 -1.80 1 258 PHE 3.32 -2.76 1 259 PHE 5.08 -2.96 1 262 PHE 6.54 -1.48 1 263 SER 4.52 -1.51 1 264 LYS 3.24 -0.98 1 265 ALA 4.08 -1.78 1 266 PHE 3.14 -0.98 1 267 GLU 7.16 -4.13 1 268 LYS 4.03 -0.96 1 269 LEU 2.84 -0.45 1 271 GLU -0.96 -0.40 1 272 ASN 1.98 -2.02 1 274 ILE 1.05 -1.14 1 275 THR 0.13 -0.48 1 276 PHE 0.91 -1.07 1 278 LYS 4.24 -1.96 1 279 ASP 0.48 -2.15 1 280 ALA 1.18 -1.23 1 282 SER 3.77 -2.44 1 284 PHE -3.70 -0.21 1 285 ILE -0.22 -2.17 1 286 PHE 1.89 -0.72 1 287 LYS -1.61 0.16 1 288 THR -2.31 0.35 1 289 LEU 7.18 -3.49 1 290 GLU 4.01 -1.45 1 291 GLU 2.34 -0.61 1 292 GLN -2.01 2.01 1 294 LEU 0.35 -2.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19075_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 -2.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.65 _LACS_plot.Line_2_terminator_val_x_2 7.95 _LACS_plot.Line_2_terminator_val_y_2 2.26 _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 187 TYR -0.76 -4.90 0 288 THR -2.31 3.87 0 225 SER -4.90 2.44 0 12 LYS 3.70 2.21 1 14 ARG -1.38 -0.76 1 15 SER -3.95 -0.33 1 16 TYR 4.47 0.22 1 17 GLU 4.57 2.44 1 18 ASP 3.04 1.66 1 19 PHE 5.39 1.57 1 20 GLN 4.01 1.80 1 21 LYS 5.39 2.31 1 25 ALA 3.14 3.37 1 31 ARG 2.43 0.78 1 36 TYR -1.04 -2.04 1 42 TYR 2.27 -0.85 1 56 THR -1.65 -0.84 1 57 TRP 3.31 -2.26 1 58 ASP -3.19 -1.23 1 59 LYS 2.06 0.63 1 60 HIS 5.17 1.39 1 61 ASP -2.19 -0.25 1 62 ASN 0.64 -0.60 1 63 THR -3.19 1.06 1 66 SER 1.32 3.10 1 67 TYR 5.98 -0.40 1 70 THR 5.14 -0.25 1 72 ARG 2.13 -0.06 1 73 PHE 1.16 0.72 1 74 LYS 4.09 0.46 1 75 LYS 4.94 1.00 1 78 ASN 0.31 -0.71 1 79 ASP -0.37 2.80 1 82 ASN -0.57 0.72 1 83 ALA 3.81 0.47 1 85 LEU 4.59 0.68 1 90 LYS 4.03 2.35 1 91 PHE 4.63 -0.04 1 92 LEU 0.46 0.97 1 93 GLU 7.95 -0.77 1 97 LYS 3.76 1.31 1 98 GLU 1.97 -0.86 1 106 ASP 6.48 -0.17 1 107 LEU 5.26 0.56 1 108 PHE 1.89 3.67 1 109 SER 3.79 1.46 1 110 LEU 3.82 3.25 1 119 MET 2.89 -2.74 1 126 TRP -2.90 -2.72 1 127 ARG -5.42 -3.88 1 132 ASP 3.21 1.42 1 133 THR 1.57 0.87 1 135 GLU 4.71 2.27 1 136 ASP 3.44 0.27 1 137 THR 0.14 -0.15 1 138 THR 3.02 -0.36 1 140 ASP 0.92 -0.38 1 141 ASN 0.28 -0.16 1 148 ASP 0.55 0.13 1 149 LYS -4.93 -3.68 1 150 ASP -4.17 0.34 1 151 ALA 2.90 1.57 1 152 ASP 3.75 2.99 1 153 TYR 4.74 1.57 1 154 VAL 7.30 1.20 1 155 ARG 5.99 4.34 1 156 THR 5.77 2.60 1 157 PHE 5.60 2.41 1 158 PHE 5.18 3.67 1 159 GLN 5.97 4.34 1 161 LEU -1.84 -1.80 1 162 ASN 1.78 -1.02 1 163 MET -2.89 0.24 1 164 ASN -2.27 -0.68 1 165 ASP 4.19 0.66 1 166 ARG 5.69 0.92 1 181 HIS -1.18 3.16 1 182 LEU 4.81 3.13 1 183 LYS 3.38 0.45 1 188 GLU -4.22 0.08 1 193 ALA -0.48 1.29 1 194 ALA 0.86 -0.31 1 197 VAL -2.42 -2.67 1 198 PHE 2.15 -2.41 1 199 THR -4.66 -1.37 1 200 ASN 1.83 0.48 1 203 TYR 3.69 1.71 1 204 LEU 4.14 1.27 1 207 LEU 1.38 1.63 1 208 ASN 0.55 1.84 1 209 GLU -1.08 -2.84 1 210 ASP -0.99 -1.06 1 211 TRP -4.26 0.49 1 212 LYS -3.48 -2.50 1 213 LEU 2.52 -1.29 1 214 GLU -4.41 -2.32 1 215 LYS -0.62 0.38 1 216 ASN -2.29 2.94 1 217 ASP 3.50 0.36 1 218 ALA 0.05 -2.00 1 219 ASN 3.29 -1.39 1 220 ASN -2.60 -0.80 1 221 GLU -0.65 -1.22 1 223 TRP -0.98 -1.37 1 224 ASP -3.65 0.21 1 226 LYS 4.13 0.98 1 227 SER 1.47 -1.44 1 229 TYR -5.62 -1.08 1 230 MET -5.85 -3.75 1 243 LYS 4.37 3.69 1 244 TYR 1.40 3.02 1 245 LEU 4.77 0.59 1 246 SER 4.16 1.90 1 247 ILE 4.56 0.14 1 249 LYS 4.75 2.32 1 250 GLU 3.27 3.38 1 253 ASN -0.27 -0.27 1 254 ASP -1.52 -2.12 1 255 GLN 3.47 0.76 1 256 ASP 4.19 2.13 1 257 LYS 3.83 1.41 1 258 PHE 3.32 0.20 1 259 PHE 5.08 2.43 1 262 PHE 6.54 0.49 1 263 SER 4.52 1.81 1 264 LYS 3.24 2.84 1 265 ALA 4.08 0.98 1 266 PHE 3.14 1.65 1 267 GLU 7.16 0.57 1 268 LYS 4.03 2.33 1 271 GLU -0.96 -0.43 1 272 ASN 1.98 1.22 1 274 ILE 1.05 -1.12 1 275 THR 0.13 -2.09 1 276 PHE 0.91 -0.64 1 278 LYS 4.24 0.21 1 279 ASP 0.48 -0.50 1 280 ALA 1.18 -0.61 1 282 SER 3.77 -2.15 1 284 PHE -3.70 -0.87 1 285 ILE -0.22 0.36 1 286 PHE 1.89 1.27 1 287 LYS -1.61 0.25 1 289 LEU 7.18 3.07 1 291 GLU 2.34 1.97 1 292 GLN -2.01 -0.37 1 294 LEU 0.35 -1.63 1 stop_ save_