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 bmr18421_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 -2.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.10 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 5.35 _LACS_plot.Y_axis_chem_shift_offset 0.57 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 LEU 0.41 -3.93 0 34 ASN -4.68 -0.29 0 10 ARG -1.68 -1.07 1 11 ASN -4.08 -1.11 1 12 PHE -0.89 -0.15 1 13 ARG -3.11 -2.55 1 15 LEU 1.18 -0.01 1 16 THR -0.72 -2.18 1 22 THR 6.60 4.69 1 24 VAL 6.51 4.48 1 25 ASN 4.13 2.79 1 26 THR 7.28 5.17 1 27 ILE 5.07 1.52 1 28 GLN 4.31 2.85 1 29 THR 3.78 3.08 1 30 ASN -0.35 1.34 1 32 LEU 1.96 1.99 1 35 GLU 4.92 3.65 1 36 ALA 4.44 2.38 1 38 GLN 3.30 2.82 1 39 ASN 3.73 2.53 1 40 LEU 3.97 2.13 1 41 PHE 6.24 4.41 1 51 GLU 4.00 2.42 1 52 GLU 2.10 2.15 1 56 PHE 6.10 3.58 1 57 LEU 4.21 1.68 1 58 ASP 2.15 1.79 1 59 VAL 1.44 -0.37 1 60 VAL 1.46 0.48 1 63 GLN 2.40 -0.47 1 64 ALA 3.49 2.06 1 66 GLN 5.17 3.67 1 67 LYS 4.93 3.21 1 68 GLN 4.40 2.43 1 69 ILE 4.88 3.34 1 70 LEU 4.43 2.75 1 71 LEU 5.81 2.86 1 72 ASP 4.44 2.68 1 73 ALA 4.15 2.23 1 74 ILE 6.31 4.61 1 75 ASP 4.92 2.96 1 76 LYS 4.51 2.83 1 77 ILE 4.74 3.69 1 78 ALA 1.91 1.41 1 79 ASP 4.16 2.73 1 80 ASP 3.16 2.90 1 81 TRP 5.99 4.09 1 82 ASP 4.93 3.02 1 83 ASN 3.23 2.44 1 84 ARG 1.59 0.33 1 85 HIS 1.52 -0.71 1 87 LEU -1.55 -1.02 1 89 ASN 1.42 -0.25 1 90 ALA 1.06 0.13 1 92 LEU 0.28 -0.13 1 93 VAL -3.74 -2.84 1 94 ALA 1.12 -0.69 1 97 GLN -3.97 -2.04 1 100 ILE 7.80 5.08 1 102 MET 2.26 -0.72 1 103 THR -3.40 -3.15 1 104 ALA 4.16 3.29 1 105 ARG 5.43 3.60 1 106 PHE 1.77 -1.48 1 107 ILE 7.44 5.61 1 108 ARG 0.44 -0.27 1 110 LEU 3.33 -0.07 1 112 VAL -0.74 -1.86 1 114 ARG 5.76 3.83 1 115 GLU 5.63 3.26 1 116 ARG 5.59 2.19 1 117 GLN 4.12 1.02 1 118 MET -0.42 -0.51 1 119 GLU -0.67 -1.88 1 121 ALA 2.50 1.32 1 122 PHE -1.02 -0.90 1 123 ASP 6.57 3.97 1 127 GLN 4.79 2.79 1 135 GLU 3.87 2.25 1 136 ALA 1.96 2.14 1 137 MET 5.47 4.52 1 138 SER 4.51 3.95 1 139 GLU 3.59 1.77 1 141 ILE 5.89 4.75 1 142 LYS 5.03 3.17 1 143 VAL 4.69 2.79 1 144 MET 3.15 0.73 1 145 ILE 3.16 1.60 1 147 LYS 1.05 -0.31 1 149 LYS -2.93 -1.71 1 150 ALA 4.50 3.35 1 151 GLN 5.55 3.15 1 152 ASN -0.68 -0.70 1 153 ILE 4.05 -1.06 1 154 ARG -3.58 -2.29 1 155 GLN 1.79 -0.97 1 157 ALA 4.01 2.95 1 158 LYS -1.01 -2.91 1 159 GLU -3.55 -1.42 1 161 TYR 2.44 2.61 1 163 GLU 3.20 1.94 1 164 PHE 2.98 1.11 1 165 VAL 6.82 4.04 1 166 ASP 3.98 3.15 1 167 ARG 4.99 3.25 1 168 LEU 4.40 2.76 1 169 LEU 6.38 3.11 1 170 SER 4.56 3.22 1 171 GLN 4.64 1.82 1 172 ILE 6.19 5.20 1 173 LYS 4.92 3.07 1 174 SER 3.30 2.08 1 175 GLU 0.55 0.27 1 177 HIS -1.49 -0.40 1 179 GLN 5.29 3.57 1 180 GLU 5.09 2.81 1 181 ILE 3.36 1.15 1 183 LYS 5.01 3.21 1 184 PHE 4.28 3.19 1 185 LEU 2.82 2.05 1 186 THR 7.41 5.52 1 187 ASP 4.87 2.98 1 188 THR 3.03 2.32 1 189 LEU 5.20 3.18 1 190 THR 3.77 2.22 1 191 ILE 1.74 1.38 1 192 GLN 3.15 2.70 1 193 ASN 1.88 -1.19 1 194 ALA -0.85 -1.28 1 195 ASN 0.79 -1.77 1 196 GLU 4.38 3.52 1 197 GLU 3.77 2.69 1 199 ARG 6.99 4.79 1 200 ASN 4.11 2.88 1 201 ALA 2.94 1.25 1 202 MET -0.36 0.06 1 203 ARG 4.79 2.75 1 204 HIS 0.52 0.78 1 205 LEU -1.89 -2.02 1 206 ARG -0.84 -1.56 1 208 GLU 2.84 0.57 1 209 ASP 2.06 1.61 1 210 THR -0.88 -0.13 1 211 LEU 3.79 2.01 1 212 GLU 5.71 3.76 1 213 GLU 3.50 2.52 1 214 LYS 5.11 3.71 1 215 MET 4.04 3.08 1 216 TYR 4.29 2.92 1 217 ALA 4.07 1.92 1 219 ARG 4.52 2.12 1 220 ASP 0.24 -0.42 1 221 ILE 1.97 -0.13 1 223 THR -0.45 -0.57 1 224 THR 0.80 0.28 1 225 LYS 1.10 -0.11 1 226 GLN 0.71 -0.11 1 227 LYS 0.92 -0.14 1 228 MET 0.45 -0.41 1 229 MET 0.42 -0.56 1 230 LEU 1.28 1.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18421_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 2.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.10 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 -2.45 _LACS_plot.Y_axis_chem_shift_offset 0.57 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 LEU 0.41 -4.34 0 34 ASN -4.68 4.39 0 10 ARG -1.68 0.61 1 11 ASN -4.08 2.97 1 12 PHE -0.89 0.74 1 13 ARG -3.11 0.56 1 15 LEU 1.18 -1.19 1 16 THR -0.72 -1.46 1 22 THR 6.60 -1.91 1 24 VAL 6.51 -2.03 1 25 ASN 4.13 -1.34 1 26 THR 7.28 -2.11 1 27 ILE 5.07 -3.55 1 28 GLN 4.31 -1.46 1 29 THR 3.78 -0.70 1 30 ASN -0.35 1.69 1 32 LEU 1.96 0.03 1 35 GLU 4.92 -1.27 1 36 ALA 4.44 -2.06 1 38 GLN 3.30 -0.48 1 39 ASN 3.73 -1.20 1 40 LEU 3.97 -1.84 1 41 PHE 6.24 -1.83 1 51 GLU 4.00 -1.58 1 52 GLU 2.10 0.05 1 56 PHE 6.10 -2.52 1 57 LEU 4.21 -2.53 1 58 ASP 2.15 -0.36 1 59 VAL 1.44 -1.81 1 60 VAL 1.46 -0.98 1 63 GLN 2.40 -2.87 1 64 ALA 3.49 -1.43 1 66 GLN 5.17 -1.50 1 67 LYS 4.93 -1.72 1 68 GLN 4.40 -1.97 1 69 ILE 4.88 -1.54 1 70 LEU 4.43 -1.68 1 71 LEU 5.81 -2.95 1 72 ASP 4.44 -1.76 1 73 ALA 4.15 -1.92 1 74 ILE 6.31 -1.70 1 75 ASP 4.92 -1.96 1 76 LYS 4.51 -1.68 1 77 ILE 4.74 -1.05 1 78 ALA 1.91 -0.50 1 79 ASP 4.16 -1.43 1 80 ASP 3.16 -0.26 1 81 TRP 5.99 -1.90 1 82 ASP 4.93 -1.91 1 83 ASN 3.23 -0.79 1 84 ARG 1.59 -1.26 1 85 HIS 1.52 -2.23 1 87 LEU -1.55 0.53 1 89 ASN 1.42 -1.67 1 90 ALA 1.06 -0.93 1 92 LEU 0.28 -0.41 1 93 VAL -3.74 0.90 1 94 ALA 1.12 -1.81 1 97 GLN -3.97 1.93 1 100 ILE 7.80 -2.72 1 102 MET 2.26 -2.98 1 103 THR -3.40 0.25 1 104 ALA 4.16 -0.87 1 105 ARG 5.43 -1.83 1 106 PHE 1.77 -3.25 1 107 ILE 7.44 -1.83 1 108 ARG 0.44 -0.71 1 110 LEU 3.33 -3.40 1 112 VAL -0.74 -1.12 1 114 ARG 5.76 -1.93 1 115 GLU 5.63 -2.37 1 116 ARG 5.59 -3.40 1 117 GLN 4.12 -3.10 1 118 MET -0.42 -0.09 1 119 GLU -0.67 -1.21 1 121 ALA 2.50 -1.18 1 122 PHE -1.02 0.12 1 123 ASP 6.57 -2.60 1 127 GLN 4.79 -2.00 1 135 GLU 3.87 -1.62 1 136 ALA 1.96 0.18 1 137 MET 5.47 -0.95 1 138 SER 4.51 -0.56 1 139 GLU 3.59 -1.82 1 141 ILE 5.89 -1.14 1 142 LYS 5.03 -1.86 1 143 VAL 4.69 -1.90 1 144 MET 3.15 -2.42 1 145 ILE 3.16 -1.56 1 147 LYS 1.05 -1.36 1 149 LYS -2.93 1.22 1 150 ALA 4.50 -1.15 1 151 GLN 5.55 -2.40 1 152 ASN -0.68 -0.02 1 153 ILE 4.05 -5.11 1 154 ARG -3.58 1.29 1 155 GLN 1.79 -2.76 1 157 ALA 4.01 -1.06 1 158 LYS -1.01 -1.90 1 159 GLU -3.55 2.13 1 161 TYR 2.44 0.17 1 163 GLU 3.20 -1.26 1 164 PHE 2.98 -1.87 1 165 VAL 6.82 -2.78 1 166 ASP 3.98 -0.83 1 167 ARG 4.99 -1.74 1 168 LEU 4.40 -1.64 1 169 LEU 6.38 -3.27 1 170 SER 4.56 -1.34 1 171 GLN 4.64 -2.82 1 172 ILE 6.19 -0.99 1 173 LYS 4.92 -1.85 1 174 SER 3.30 -1.22 1 175 GLU 0.55 -0.28 1 177 HIS -1.49 1.09 1 179 GLN 5.29 -1.72 1 180 GLU 5.09 -2.28 1 181 ILE 3.36 -2.21 1 183 LYS 5.01 -1.80 1 184 PHE 4.28 -1.09 1 185 LEU 2.82 -0.77 1 186 THR 7.41 -1.89 1 187 ASP 4.87 -1.89 1 188 THR 3.03 -0.71 1 189 LEU 5.20 -2.02 1 190 THR 3.77 -1.55 1 191 ILE 1.74 -0.36 1 192 GLN 3.15 -0.45 1 193 ASN 1.88 -3.07 1 194 ALA -0.85 -0.43 1 195 ASN 0.79 -2.56 1 196 GLU 4.38 -0.86 1 197 GLU 3.77 -1.08 1 199 ARG 6.99 -2.20 1 200 ASN 4.11 -1.23 1 201 ALA 2.94 -1.69 1 202 MET -0.36 0.42 1 203 ARG 4.79 -2.04 1 204 HIS 0.52 0.26 1 205 LEU -1.89 -0.13 1 206 ARG -0.84 -0.72 1 208 GLU 2.84 -2.27 1 209 ASP 2.06 -0.45 1 210 THR -0.88 0.75 1 211 LEU 3.79 -1.78 1 212 GLU 5.71 -1.95 1 213 GLU 3.50 -0.98 1 214 LYS 5.11 -1.40 1 215 MET 4.04 -0.96 1 216 TYR 4.29 -1.37 1 217 ALA 4.07 -2.15 1 219 ARG 4.52 -2.40 1 220 ASP 0.24 -0.66 1 221 ILE 1.97 -2.10 1 223 THR -0.45 -0.12 1 224 THR 0.80 -0.52 1 225 LYS 1.10 -1.21 1 226 GLN 0.71 -0.82 1 227 LYS 0.92 -1.06 1 228 MET 0.45 -0.86 1 229 MET 0.42 -0.98 1 230 LEU 1.28 -0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18421_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 -1.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.69 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 2.85 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 85 HIS 1.52 7.20 0 10 ARG -1.68 -0.60 1 11 ASN -4.08 -2.30 1 12 PHE -0.89 -1.30 1 13 ARG -3.11 -2.50 1 15 LEU 1.18 -0.40 1 16 THR -0.72 -0.70 1 22 THR 6.60 2.40 1 24 VAL 6.51 2.10 1 25 ASN 4.13 3.30 1 26 THR 7.28 1.60 1 27 ILE 5.07 2.90 1 28 GLN 4.31 1.90 1 29 THR 3.78 0.70 1 30 ASN -0.35 0.30 1 32 LEU 1.96 -1.80 1 33 LEU 0.41 -3.00 1 34 ASN -4.68 -0.60 1 35 GLU 4.92 0.60 1 36 ALA 4.44 3.80 1 38 GLN 3.30 2.20 1 39 ASN 3.73 3.00 1 40 LEU 3.97 0.70 1 41 PHE 6.24 3.50 1 51 GLU 4.00 3.10 1 52 GLU 2.10 2.60 1 56 PHE 6.10 3.40 1 57 LEU 4.21 0.90 1 58 ASP 2.15 1.70 1 59 VAL 1.44 -0.70 1 60 VAL 1.46 -0.50 1 63 GLN 2.40 0.30 1 66 GLN 5.17 1.80 1 67 LYS 4.93 1.00 1 68 GLN 4.40 1.60 1 69 ILE 4.88 2.70 1 70 LEU 4.43 0.30 1 71 LEU 5.81 2.10 1 72 ASP 4.44 2.70 1 73 ALA 4.15 3.00 1 74 ILE 6.31 1.00 1 75 ASP 4.92 2.00 1 76 LYS 4.51 2.90 1 77 ILE 4.74 2.00 1 78 ALA 1.91 1.10 1 79 ASP 4.16 2.90 1 80 ASP 3.16 1.60 1 81 TRP 5.99 4.10 1 82 ASP 4.93 2.50 1 83 ASN 3.23 2.00 1 84 ARG 1.59 -0.80 1 87 LEU -1.55 -1.70 1 89 ASN 1.42 -0.50 1 90 ALA 1.06 -0.40 1 92 LEU 0.28 0.50 1 93 VAL -3.74 -1.30 1 94 ALA 1.12 -2.10 1 97 GLN -3.97 -0.70 1 100 ILE 7.80 -1.10 1 102 MET 2.26 -0.10 1 103 THR -3.40 -0.10 1 104 ALA 4.16 1.80 1 105 ARG 5.43 0.80 1 106 PHE 1.77 5.10 1 107 ILE 7.44 -0.60 1 108 ARG 0.44 -1.20 1 110 LEU 3.33 -1.70 1 112 VAL -0.74 -0.90 1 114 ARG 5.76 1.60 1 115 GLU 5.63 3.40 1 116 ARG 5.59 1.70 1 117 GLN 4.12 0.10 1 118 MET -0.42 -0.10 1 119 GLU -0.67 0.30 1 121 ALA 2.50 0.20 1 122 PHE -1.02 2.20 1 123 ASP 6.57 2.00 1 127 GLN 4.79 3.60 1 135 GLU 3.87 2.90 1 136 ALA 1.96 2.40 1 137 MET 5.47 1.40 1 138 SER 4.51 2.70 1 139 GLU 3.59 2.70 1 141 ILE 5.89 1.40 1 142 LYS 5.03 3.30 1 143 VAL 4.69 2.20 1 144 MET 3.15 2.50 1 145 ILE 3.16 1.10 1 147 LYS 1.05 -0.30 1 149 LYS -2.93 1.80 1 150 ALA 4.50 0.00 1 151 GLN 5.55 0.40 1 152 ASN -0.68 -0.20 1 153 ILE 4.05 -2.30 1 154 ARG -3.58 -0.70 1 155 GLN 1.79 1.10 1 157 ALA 4.01 0.60 1 158 LYS -1.01 -1.20 1 159 GLU -3.55 -0.60 1 161 TYR 2.44 -0.70 1 163 GLU 3.20 2.50 1 164 PHE 2.98 -0.10 1 165 VAL 6.82 0.90 1 166 ASP 3.98 3.00 1 167 ARG 4.99 3.20 1 168 LEU 4.40 0.70 1 169 LEU 6.38 3.00 1 170 SER 4.56 2.50 1 171 GLN 4.64 2.90 1 172 ILE 6.19 3.30 1 173 LYS 4.92 2.70 1 174 SER 3.30 0.60 1 175 GLU 0.55 1.40 1 177 HIS -1.49 0.40 1 179 GLN 5.29 1.70 1 180 GLU 5.09 2.80 1 181 ILE 3.36 1.10 1 183 LYS 5.01 0.20 1 184 PHE 4.28 3.50 1 185 LEU 2.82 0.50 1 186 THR 7.41 1.40 1 187 ASP 4.87 0.10 1 188 THR 3.03 4.00 1 189 LEU 5.20 1.40 1 190 THR 3.77 1.20 1 191 ILE 1.74 0.30 1 192 GLN 3.15 0.90 1 193 ASN 1.88 -0.20 1 194 ALA -0.85 -1.90 1 195 ASN 0.79 -0.60 1 196 GLU 4.38 1.90 1 197 GLU 3.77 3.00 1 199 ARG 6.99 4.50 1 200 ASN 4.11 2.60 1 201 ALA 2.94 0.50 1 202 MET -0.36 0.80 1 203 ARG 4.79 -0.20 1 204 HIS 0.52 1.00 1 205 LEU -1.89 -1.80 1 206 ARG -0.84 0.90 1 208 GLU 2.84 1.00 1 209 ASP 2.06 -0.70 1 210 THR -0.88 1.20 1 211 LEU 3.79 1.70 1 212 GLU 5.71 3.00 1 213 GLU 3.50 3.00 1 214 LYS 5.11 0.20 1 215 MET 4.04 3.20 1 216 TYR 4.29 2.90 1 217 ALA 4.07 1.40 1 219 ARG 4.52 -0.40 1 220 ASP 0.24 0.00 1 221 ILE 1.97 0.70 1 223 THR -0.45 0.30 1 224 THR 0.80 0.00 1 225 LYS 1.10 0.00 1 226 GLN 0.71 0.00 1 227 LYS 0.92 -0.20 1 228 MET 0.45 -0.50 1 229 MET 0.42 -1.40 1 230 LEU 1.28 -4.70 1 stop_ save_