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 bmr18353_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.93 _LACS_plot.Line_1_terminator_val_y_1 -3.72 _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 -1.35 _LACS_plot.Line_2_terminator_val_x_2 7.48 _LACS_plot.Line_2_terminator_val_y_2 3.37 _LACS_plot.Y_axis_chem_shift_offset 0.56 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 263 ASP 7.49 5.56 0 239 VAL -6.45 -6.98 0 288 MET 4.16 5.15 0 12 TYR -3.10 -0.90 1 13 PHE 2.72 1.07 1 15 GLN -3.20 -2.26 1 16 SER 3.98 2.00 1 17 LEU -3.55 -1.91 1 18 SER -0.85 -1.81 1 19 TYR -1.32 -1.41 1 20 LEU -0.00 -0.13 1 21 GLU -8.93 -3.41 1 22 ALA -6.23 -3.12 1 23 TYR -4.12 -4.20 1 24 ASN -2.95 -3.45 1 26 SER 3.46 1.74 1 27 ASN -1.25 -1.94 1 29 SER -1.36 -0.29 1 30 TRP -2.77 -1.27 1 31 LEU -4.07 -1.66 1 32 ARG 1.31 -0.27 1 33 LEU -1.79 -2.42 1 34 ALA 1.64 0.95 1 35 ASP -0.16 -0.51 1 36 LEU 0.76 0.12 1 37 GLN 3.66 2.06 1 38 VAL -3.59 -1.79 1 40 ARG -6.85 -1.80 1 41 SER -4.15 -2.06 1 43 LEU -2.29 -1.15 1 44 ALA -6.74 -2.36 1 47 VAL -3.40 -2.41 1 48 VAL -1.38 -0.38 1 51 LEU -1.78 -2.17 1 52 LEU -3.06 -2.17 1 53 TYR -1.83 -1.41 1 54 ALA -3.95 -2.61 1 55 VAL -2.65 -1.91 1 58 ARG -3.77 -1.54 1 59 ASN -1.76 -1.69 1 60 ASN -0.75 -0.68 1 61 SER -1.47 -0.16 1 63 ASP -0.40 -0.75 1 65 ASN -1.25 -0.93 1 66 THR -2.15 -1.50 1 67 ASP -0.16 1.02 1 68 SER -1.86 -1.81 1 69 SER -1.36 -2.32 1 70 ALA -0.13 0.44 1 71 LEU -2.80 -1.15 1 72 ASP -6.75 -1.52 1 74 TYR -0.58 -2.44 1 75 ASN -3.74 -3.70 1 77 MET 3.40 1.34 1 78 THR -1.39 -2.02 1 79 ASN 2.04 -0.17 1 80 GLN -4.71 -2.00 1 81 TRP -2.25 -1.26 1 82 SER -2.24 -1.18 1 85 ALA 1.88 1.19 1 86 SER 0.17 -0.54 1 87 MET -0.92 -0.18 1 88 SER 3.71 2.50 1 89 VAL -4.61 -3.06 1 91 ARG 0.79 0.74 1 93 ARG -0.98 -0.78 1 94 ILE -2.50 -1.82 1 96 VAL -6.96 -3.68 1 98 VAL -2.39 -1.65 1 99 ILE -1.23 -0.30 1 100 ASP 3.41 0.77 1 102 HIS -5.68 -2.57 1 103 ILE -0.72 -0.04 1 104 TYR -0.80 -0.64 1 105 ALA -5.22 -2.11 1 106 VAL -1.88 -1.65 1 109 SER -5.16 -2.57 1 110 HIS -6.20 -3.34 1 113 ILE 2.33 -0.29 1 114 HIS -0.61 -1.05 1 115 HIS -0.12 1.47 1 116 SER -1.61 -1.81 1 117 SER -1.86 -1.56 1 118 VAL -4.16 -1.90 1 119 GLU -7.66 -3.16 1 120 ARG -5.29 -2.81 1 121 TYR -2.08 -2.93 1 122 GLU -3.42 -3.30 1 124 GLU 3.77 1.67 1 125 ARG -1.75 -1.29 1 126 ASP 1.63 -0.25 1 127 GLU -7.15 -2.65 1 128 TRP -3.79 -2.03 1 129 HIS -3.90 -0.29 1 130 LEU 1.51 1.13 1 131 VAL -2.13 -3.17 1 132 ALA 0.88 -1.34 1 135 LEU 3.06 0.64 1 136 THR -2.16 -1.76 1 137 ARG 1.81 -0.02 1 138 ARG -4.79 -1.04 1 139 ILE -3.00 -3.08 1 141 VAL -4.42 -4.19 1 143 VAL -4.67 -2.92 1 144 ALA -6.99 -2.61 1 145 VAL -1.88 -1.40 1 146 LEU -2.80 -1.15 1 147 ASN 3.32 0.85 1 148 ARG 6.38 2.01 1 149 LEU -2.04 -2.17 1 150 LEU -2.03 -1.91 1 152 ALA -4.19 -2.11 1 153 VAL -1.62 -0.63 1 156 PHE -4.39 -2.73 1 157 ASP -1.67 -1.26 1 159 THR 1.70 2.30 1 160 ASN -2.77 -0.93 1 161 ARG 2.57 0.74 1 162 LEU -0.77 -0.39 1 163 ASN -0.24 -2.20 1 164 SER -3.14 -2.07 1 165 ALA -5.21 -2.10 1 166 GLU -6.91 -2.15 1 168 TYR -2.06 -3.18 1 169 TYR -2.02 -2.87 1 171 GLU 3.51 1.66 1 172 ARG -1.74 -1.29 1 173 ASN 2.30 -0.17 1 174 GLU -6.90 -2.65 1 175 TRP -3.27 -1.52 1 176 ARG -4.78 -1.80 1 178 ILE -2.50 -1.82 1 179 THR 0.35 1.00 1 181 MET -0.94 -0.44 1 182 ASN 2.04 2.62 1 183 THR -1.65 -1.00 1 184 ILE 2.32 0.97 1 185 ARG -5.04 -1.28 1 186 SER -2.12 -1.81 1 188 ALA -1.91 -1.85 1 190 VAL -4.17 -2.92 1 192 VAL -3.15 -2.41 1 193 LEU -1.52 -0.64 1 194 HIS 0.91 -0.29 1 197 ILE -0.70 -1.82 1 199 ALA 0.62 -0.84 1 203 TYR -5.38 -2.93 1 204 ASP -1.42 -1.52 1 206 GLN -0.40 1.04 1 207 ASP -3.96 -1.27 1 208 GLN 3.15 -0.23 1 209 LEU -1.80 -0.91 1 210 ASN -0.75 -2.71 1 211 SER -2.62 -1.81 1 212 VAL -2.90 -1.65 1 214 ARG -2.50 -2.56 1 216 ASP -3.71 -2.79 1 217 VAL 3.19 1.40 1 218 GLU 2.50 1.41 1 219 THR -0.12 -0.99 1 220 GLU 4.03 -0.11 1 221 THR -4.19 -2.01 1 222 TRP -2.26 -2.03 1 223 THR -3.69 -2.02 1 224 PHE 2.21 1.83 1 225 VAL 0.65 2.02 1 228 MET -1.43 -0.18 1 230 HIS -2.14 -0.80 1 231 HIS 0.89 0.20 1 232 ARG -5.03 -1.28 1 233 SER -3.13 -1.81 1 234 ALA 3.66 0.43 1 235 LEU -1.02 -0.89 1 237 ILE -5.79 -2.07 1 238 THR -1.39 -2.01 1 240 HIS -1.12 -1.56 1 243 LYS -4.56 -2.25 1 250 TYR -5.39 -2.94 1 251 ASP -2.69 -1.77 1 253 HIS -0.62 1.99 1 254 THR -2.66 -2.01 1 255 PHE 1.44 -0.20 1 256 LEU -0.25 -0.13 1 257 ASP -1.67 -2.79 1 258 SER 2.20 0.73 1 259 VAL -1.37 -2.16 1 262 TYR -5.90 -5.73 1 265 ASP 3.66 2.29 1 266 SER -1.11 -1.31 1 267 ASP 2.13 0.00 1 268 THR -5.21 -2.52 1 269 TRP -2.76 -1.77 1 270 SER -3.13 -1.81 1 271 GLU 0.47 -0.11 1 272 VAL -0.62 -0.63 1 273 THR 1.39 -1.51 1 274 ARG -3.77 -2.30 1 275 MET -1.93 -0.43 1 276 THR 3.94 1.80 1 277 SER 0.41 -0.80 1 279 ARG -0.98 -0.78 1 280 SER -4.66 -2.32 1 282 VAL -1.88 -2.92 1 284 VAL -4.68 -2.92 1 285 ALA -4.18 -1.34 1 286 VAL -4.16 -2.66 1 289 GLU -3.34 -0.11 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18353_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.93 _LACS_plot.Line_1_terminator_val_y_1 5.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.09 _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 7.48 _LACS_plot.Line_2_terminator_val_y_2 -4.11 _LACS_plot.Y_axis_chem_shift_offset 0.56 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 263 ASP 7.49 -1.93 0 239 VAL -6.45 -0.53 0 288 MET 4.16 0.99 0 12 TYR -3.10 2.20 1 13 PHE 2.72 -1.65 1 15 GLN -3.20 0.94 1 16 SER 3.98 -1.98 1 17 LEU -3.55 1.64 1 18 SER -0.85 -0.96 1 19 TYR -1.32 -0.09 1 20 LEU -0.00 -0.13 1 21 GLU -8.93 5.52 1 22 ALA -6.23 3.11 1 23 TYR -4.12 -0.08 1 24 ASN -2.95 -0.50 1 26 SER 3.46 -1.72 1 27 ASN -1.25 -0.69 1 29 SER -1.36 1.07 1 30 TRP -2.77 1.50 1 31 LEU -4.07 2.41 1 32 ARG 1.31 -1.58 1 33 LEU -1.79 -0.63 1 34 ALA 1.64 -0.69 1 35 ASP -0.16 -0.35 1 36 LEU 0.76 -0.64 1 37 GLN 3.66 -1.60 1 38 VAL -3.59 1.80 1 40 ARG -6.85 5.05 1 41 SER -4.15 2.09 1 43 LEU -2.29 1.14 1 44 ALA -6.74 4.38 1 47 VAL -3.40 0.99 1 48 VAL -1.38 1.00 1 51 LEU -1.78 -0.39 1 52 LEU -3.06 0.89 1 53 TYR -1.83 0.42 1 54 ALA -3.95 1.34 1 55 VAL -2.65 0.74 1 58 ARG -3.77 2.23 1 59 ASN -1.76 0.07 1 60 ASN -0.75 0.07 1 61 SER -1.47 1.31 1 63 ASP -0.40 -0.35 1 65 ASN -1.25 0.32 1 66 THR -2.15 0.65 1 67 ASP -0.16 1.18 1 68 SER -1.86 0.05 1 69 SER -1.36 -0.96 1 70 ALA -0.13 0.57 1 71 LEU -2.80 1.65 1 72 ASP -6.75 5.23 1 74 TYR -0.58 -1.86 1 75 ASN -3.74 0.04 1 77 MET 3.40 -2.06 1 78 THR -1.39 -0.63 1 79 ASN 2.04 -2.21 1 80 GLN -4.71 2.71 1 81 TRP -2.25 0.99 1 82 SER -2.24 1.06 1 85 ALA 1.88 -0.69 1 86 SER 0.17 -0.71 1 87 MET -0.92 0.74 1 88 SER 3.71 -1.21 1 89 VAL -4.61 1.55 1 91 ARG 0.79 -0.05 1 93 ARG -0.98 0.20 1 94 ILE -2.50 0.68 1 96 VAL -6.96 3.28 1 98 VAL -2.39 0.74 1 99 ILE -1.23 0.93 1 100 ASP 3.41 -2.64 1 102 HIS -5.68 3.11 1 103 ILE -0.72 0.68 1 104 TYR -0.80 0.16 1 105 ALA -5.22 3.11 1 106 VAL -1.88 0.23 1 109 SER -5.16 2.59 1 110 HIS -6.20 2.86 1 113 ILE 2.33 -2.62 1 114 HIS -0.61 -0.44 1 115 HIS -0.12 1.59 1 116 SER -1.61 -0.20 1 117 SER -1.86 0.30 1 118 VAL -4.16 2.26 1 119 GLU -7.66 4.50 1 120 ARG -5.29 2.48 1 121 TYR -2.08 -0.85 1 122 GLU -3.42 0.12 1 124 GLU 3.77 -2.10 1 125 ARG -1.75 0.46 1 126 ASP 1.63 -1.88 1 127 GLU -7.15 4.50 1 128 TRP -3.79 1.76 1 129 HIS -3.90 3.61 1 130 LEU 1.51 -0.38 1 131 VAL -2.13 -1.04 1 132 ALA 0.88 -2.22 1 135 LEU 3.06 -2.42 1 136 THR -2.16 0.40 1 137 ARG 1.81 -1.83 1 138 ARG -4.79 3.75 1 139 ILE -3.00 -0.08 1 141 VAL -4.42 0.23 1 143 VAL -4.67 1.75 1 144 ALA -6.99 4.38 1 145 VAL -1.88 0.48 1 146 LEU -2.80 1.65 1 147 ASN 3.32 -2.47 1 148 ARG 6.38 -4.37 1 149 LEU -2.04 -0.13 1 150 LEU -2.03 0.12 1 152 ALA -4.19 2.08 1 153 VAL -1.62 0.99 1 156 PHE -4.39 1.66 1 157 ASP -1.67 0.41 1 159 THR 1.70 0.60 1 160 ASN -2.77 1.84 1 161 ARG 2.57 -1.83 1 162 LEU -0.77 0.38 1 163 ASN -0.24 -1.96 1 164 SER -3.14 1.07 1 165 ALA -5.21 3.11 1 166 GLU -6.91 4.76 1 168 TYR -2.06 -1.12 1 169 TYR -2.02 -0.85 1 171 GLU 3.51 -1.85 1 172 ARG -1.74 0.45 1 173 ASN 2.30 -2.47 1 174 GLU -6.90 4.25 1 175 TRP -3.27 1.75 1 176 ARG -4.78 2.98 1 178 ILE -2.50 0.68 1 179 THR 0.35 0.65 1 181 MET -0.94 0.50 1 182 ASN 2.04 0.58 1 183 THR -1.65 0.65 1 184 ILE 2.32 -1.35 1 185 ARG -5.04 3.76 1 186 SER -2.12 0.31 1 188 ALA -1.91 0.06 1 190 VAL -4.17 1.25 1 192 VAL -3.15 0.74 1 193 LEU -1.52 0.88 1 194 HIS 0.91 -1.20 1 197 ILE -0.70 -1.12 1 199 ALA 0.62 -1.46 1 203 TYR -5.38 2.45 1 204 ASP -1.42 -0.10 1 206 GLN -0.40 1.44 1 207 ASP -3.96 2.69 1 208 GLN 3.15 -3.38 1 209 LEU -1.80 0.89 1 210 ASN -0.75 -1.96 1 211 SER -2.62 0.81 1 212 VAL -2.90 1.25 1 214 ARG -2.50 -0.06 1 216 ASP -3.71 0.92 1 217 VAL 3.19 -1.79 1 218 GLU 2.50 -1.09 1 219 THR -0.12 -0.87 1 220 GLU 4.03 -4.14 1 221 THR -4.19 2.18 1 222 TRP -2.26 0.23 1 223 THR -3.69 1.67 1 224 PHE 2.21 -0.38 1 225 VAL 0.65 1.37 1 228 MET -1.43 1.25 1 230 HIS -2.14 1.34 1 231 HIS 0.89 -0.69 1 232 ARG -5.03 3.75 1 233 SER -3.13 1.32 1 234 ALA 3.66 -3.23 1 235 LEU -1.02 0.13 1 237 ILE -5.79 3.72 1 238 THR -1.39 -0.62 1 240 HIS -1.12 -0.44 1 243 LYS -4.56 2.31 1 250 TYR -5.39 2.45 1 251 ASP -2.69 0.92 1 253 HIS -0.62 2.61 1 254 THR -2.66 0.65 1 255 PHE 1.44 -1.64 1 256 LEU -0.25 0.12 1 257 ASP -1.67 -1.12 1 258 SER 2.20 -1.47 1 259 VAL -1.37 -0.79 1 262 TYR -5.90 0.17 1 265 ASP 3.66 -1.37 1 266 SER -1.11 -0.20 1 267 ASP 2.13 -2.13 1 268 THR -5.21 2.69 1 269 TRP -2.76 0.99 1 270 SER -3.13 1.32 1 271 GLU 0.47 -0.58 1 272 VAL -0.62 -0.01 1 273 THR 1.39 -2.90 1 274 ARG -3.77 1.47 1 275 MET -1.93 1.50 1 276 THR 3.94 -2.14 1 277 SER 0.41 -1.21 1 279 ARG -0.98 0.20 1 280 SER -4.66 2.34 1 282 VAL -1.88 -1.04 1 284 VAL -4.68 1.76 1 285 ALA -4.18 2.84 1 286 VAL -4.16 1.50 1 289 GLU -3.34 3.23 1 stop_ save_