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 bmr4402_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.70 _LACS_plot.Line_1_terminator_val_y_1 -3.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.84 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 6.65 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 TYR 0.20 -3.40 0 11 TRP 0.30 -0.20 1 12 ASN 0.30 -0.30 1 13 THR -0.40 -0.20 1 16 SER -0.10 -0.10 1 17 ARG 0.10 -0.20 1 18 TYR -0.50 -0.70 1 21 GLN 0.30 0.30 1 23 SER 0.00 -0.30 1 27 ASN 0.00 -0.10 1 28 ARG 0.20 -0.20 1 29 TYR -0.40 -0.70 1 32 GLN 0.20 -0.20 1 37 TRP 0.20 -0.10 1 39 GLN -0.30 -0.50 1 41 HIS 0.00 -0.10 1 45 TRP 0.20 0.00 1 47 GLN -0.30 -0.50 1 49 HIS 0.30 0.10 1 53 TRP 0.30 0.00 1 55 GLN -0.30 -0.50 1 57 HIS 0.30 0.10 1 61 TRP 0.20 0.00 1 63 GLN -0.30 -0.50 1 65 HIS 0.10 0.00 1 69 TRP 0.20 0.00 1 71 GLN -0.10 -0.10 1 75 THR -0.30 -0.10 1 76 HIS 0.20 0.10 1 77 SER 0.50 0.10 1 78 GLN 0.60 0.20 1 79 TRP -0.20 -0.50 1 80 ASN -0.20 -0.40 1 81 LYS 0.00 -0.30 1 83 SER -0.30 -0.50 1 84 LYS -0.10 -0.20 1 86 LYS 0.40 0.10 1 87 THR -0.60 -0.50 1 88 ASN 0.20 -0.20 1 89 MET 0.30 0.00 1 90 LYS 0.50 0.00 1 91 HIS 0.20 0.10 1 92 MET -0.40 -0.50 1 93 ALA 0.20 0.10 1 95 ALA 0.00 -0.10 1 96 ALA 0.20 -0.10 1 97 ALA 0.10 -0.20 1 98 ALA 0.10 -0.20 1 100 ALA -0.40 -0.30 1 101 VAL 0.20 -0.30 1 102 VAL 0.50 0.00 1 105 LEU -0.40 -0.50 1 108 TYR -1.50 -0.30 1 109 MET -3.60 -2.00 1 110 LEU -3.00 -2.00 1 112 SER 0.00 0.00 1 113 ALA 1.00 0.20 1 114 MET -5.50 -1.70 1 115 SER 1.10 0.10 1 116 ARG 1.50 0.60 1 118 ILE 2.30 -0.40 1 119 ILE -2.90 -2.50 1 120 HIS -1.50 -1.20 1 121 PHE -0.10 1.40 1 123 SER -3.80 -1.90 1 124 ASP 4.00 3.30 1 125 TYR 4.10 3.30 1 126 GLU 3.10 2.90 1 127 ASP 5.00 4.00 1 128 ARG 4.60 3.40 1 129 TYR 4.80 4.10 1 130 TYR 5.40 4.60 1 131 ARG 5.00 3.70 1 132 GLU 1.80 1.20 1 133 ASN -0.10 1.80 1 134 MET 6.10 3.70 1 135 HIS 4.30 2.40 1 136 ARG 0.60 0.00 1 139 ASN -0.70 -1.50 1 140 GLN -5.70 -1.80 1 141 VAL -4.60 -3.70 1 142 TYR -4.30 -1.20 1 143 TYR -4.00 -2.60 1 144 ARG -1.10 -1.30 1 146 MET 3.00 2.20 1 147 ASP 1.50 -0.10 1 148 GLU -0.60 -1.70 1 150 SER 0.40 0.50 1 151 ASN -1.80 -1.00 1 152 GLN 4.00 3.50 1 153 ASN 4.30 3.20 1 154 ASN 3.70 2.60 1 156 VAL 6.40 5.40 1 157 HIS 5.00 4.10 1 158 ASP 3.00 3.00 1 160 VAL 5.00 4.00 1 161 ASN 3.60 3.30 1 162 ILE 3.20 0.90 1 163 THR 8.60 6.70 1 164 ILE 6.50 4.40 1 165 LYS 4.40 3.40 1 166 GLN 2.40 1.80 1 167 HIS 2.80 3.50 1 168 THR 4.10 3.30 1 169 VAL 3.60 2.60 1 170 THR 2.90 2.10 1 171 THR 2.80 1.90 1 172 THR 2.90 2.10 1 173 THR 2.60 1.80 1 174 LYS 1.00 0.10 1 176 GLU -1.60 -1.00 1 177 ASN -1.50 -0.40 1 178 PHE -1.50 -1.20 1 179 THR -3.60 -1.50 1 180 GLU 4.20 2.80 1 181 THR 6.20 4.80 1 182 ASP 3.20 3.50 1 183 VAL 6.90 5.40 1 184 LYS 4.10 2.90 1 185 MET 5.20 4.60 1 186 MET 3.80 4.10 1 187 GLU 5.70 3.70 1 188 ARG 3.30 2.20 1 189 VAL 4.20 3.40 1 190 VAL 5.70 3.80 1 191 GLU 5.30 4.20 1 192 GLN 4.70 3.00 1 193 MET 3.10 4.30 1 195 ILE 6.30 5.30 1 196 THR 6.70 4.90 1 197 GLN 4.10 2.60 1 198 TYR 6.00 4.10 1 199 GLU 4.50 2.50 1 200 ARG 3.90 3.00 1 201 GLU 2.00 1.00 1 202 SER 4.20 2.70 1 203 GLN 3.50 2.20 1 204 ALA 2.00 1.30 1 205 TYR 2.00 2.10 1 206 TYR 1.80 1.00 1 207 GLN 0.90 0.10 1 208 ARG 0.40 0.20 1 210 SER 0.20 0.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4402_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.70 _LACS_plot.Line_1_terminator_val_y_1 2.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -1.94 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 TYR 0.20 -3.60 0 11 TRP 0.30 -0.50 1 12 ASN 0.30 -0.60 1 13 THR -0.40 0.20 1 16 SER -0.10 0.00 1 17 ARG 0.10 -0.30 1 18 TYR -0.50 -0.20 1 21 GLN 0.30 0.00 1 23 SER 0.00 -0.30 1 27 ASN 0.00 -0.10 1 28 ARG 0.20 -0.40 1 29 TYR -0.40 -0.30 1 32 GLN 0.20 -0.40 1 37 TRP 0.20 -0.30 1 39 GLN -0.30 -0.20 1 41 HIS 0.00 -0.10 1 45 TRP 0.20 -0.20 1 47 GLN -0.30 -0.20 1 49 HIS 0.30 -0.20 1 53 TRP 0.30 -0.30 1 55 GLN -0.30 -0.20 1 57 HIS 0.30 -0.20 1 61 TRP 0.20 -0.20 1 63 GLN -0.30 -0.20 1 65 HIS 0.10 -0.10 1 69 TRP 0.20 -0.20 1 71 GLN -0.10 0.00 1 75 THR -0.30 0.20 1 76 HIS 0.20 -0.10 1 77 SER 0.50 -0.40 1 78 GLN 0.60 -0.40 1 79 TRP -0.20 -0.30 1 80 ASN -0.20 -0.20 1 81 LYS 0.00 -0.30 1 83 SER -0.30 -0.20 1 84 LYS -0.10 -0.10 1 86 LYS 0.40 -0.30 1 87 THR -0.60 0.10 1 88 ASN 0.20 -0.40 1 89 MET 0.30 -0.30 1 90 LYS 0.50 -0.50 1 91 HIS 0.20 -0.10 1 92 MET -0.40 -0.10 1 93 ALA 0.20 -0.10 1 95 ALA 0.00 -0.10 1 96 ALA 0.20 -0.30 1 97 ALA 0.10 -0.30 1 98 ALA 0.10 -0.30 1 100 ALA -0.40 0.10 1 101 VAL 0.20 -0.50 1 102 VAL 0.50 -0.50 1 105 LEU -0.40 -0.10 1 108 TYR -1.50 1.20 1 109 MET -3.60 1.60 1 110 LEU -3.00 1.00 1 112 SER 0.00 0.00 1 113 ALA 1.00 -0.80 1 114 MET -5.50 3.80 1 115 SER 1.10 -1.00 1 116 ARG 1.50 -0.90 1 118 ILE 2.30 -2.70 1 119 ILE -2.90 0.40 1 120 HIS -1.50 0.30 1 121 PHE -0.10 1.50 1 123 SER -3.80 1.90 1 124 ASP 4.00 -0.70 1 125 TYR 4.10 -0.80 1 126 GLU 3.10 -0.20 1 127 ASP 5.00 -1.00 1 128 ARG 4.60 -1.20 1 129 TYR 4.80 -0.70 1 130 TYR 5.40 -0.80 1 131 ARG 5.00 -1.30 1 132 GLU 1.80 -0.60 1 133 ASN -0.10 1.90 1 134 MET 6.10 -2.40 1 135 HIS 4.30 -1.90 1 136 ARG 0.60 -0.60 1 139 ASN -0.70 -0.80 1 140 GLN -5.70 3.90 1 141 VAL -4.60 0.90 1 142 TYR -4.30 3.10 1 143 TYR -4.00 1.40 1 144 ARG -1.10 -0.20 1 146 MET 3.00 -0.80 1 147 ASP 1.50 -1.60 1 148 GLU -0.60 -1.10 1 150 SER 0.40 0.10 1 151 ASN -1.80 0.80 1 152 GLN 4.00 -0.50 1 153 ASN 4.30 -1.10 1 154 ASN 3.70 -1.10 1 156 VAL 6.40 -1.00 1 157 HIS 5.00 -0.90 1 158 ASP 3.00 0.00 1 160 VAL 5.00 -1.00 1 161 ASN 3.60 -0.30 1 162 ILE 3.20 -2.30 1 163 THR 8.60 -1.90 1 164 ILE 6.50 -2.10 1 165 LYS 4.40 -1.00 1 166 GLN 2.40 -0.60 1 167 HIS 2.80 0.70 1 168 THR 4.10 -0.80 1 169 VAL 3.60 -1.00 1 170 THR 2.90 -0.80 1 171 THR 2.80 -0.90 1 172 THR 2.90 -0.80 1 173 THR 2.60 -0.80 1 174 LYS 1.00 -0.90 1 176 GLU -1.60 0.60 1 177 ASN -1.50 1.10 1 178 PHE -1.50 0.30 1 179 THR -3.60 2.10 1 180 GLU 4.20 -1.40 1 181 THR 6.20 -1.40 1 182 ASP 3.20 0.30 1 183 VAL 6.90 -1.50 1 184 LYS 4.10 -1.20 1 185 MET 5.20 -0.60 1 186 MET 3.80 0.30 1 187 GLU 5.70 -2.00 1 188 ARG 3.30 -1.10 1 189 VAL 4.20 -0.80 1 190 VAL 5.70 -1.90 1 191 GLU 5.30 -1.10 1 192 GLN 4.70 -1.70 1 193 MET 3.10 1.20 1 195 ILE 6.30 -1.00 1 196 THR 6.70 -1.80 1 197 GLN 4.10 -1.50 1 198 TYR 6.00 -1.90 1 199 GLU 4.50 -2.00 1 200 ARG 3.90 -0.90 1 201 GLU 2.00 -1.00 1 202 SER 4.20 -1.50 1 203 GLN 3.50 -1.30 1 204 ALA 2.00 -0.70 1 205 TYR 2.00 0.10 1 206 TYR 1.80 -0.80 1 207 GLN 0.90 -0.80 1 208 ARG 0.40 -0.20 1 210 SER 0.20 -0.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4402_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.70 _LACS_plot.Line_1_terminator_val_y_1 0.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.04 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 152 GLN 4.00 -1.41 0 198 TYR 6.00 -1.60 0 11 TRP 0.30 -0.07 1 12 ASN 0.30 -0.12 1 13 THR -0.40 -0.11 1 16 SER -0.10 -0.10 1 17 ARG 0.10 -0.10 1 18 TYR -0.50 -0.03 1 21 GLN 0.30 -0.08 1 23 SER 0.00 -0.07 1 27 ASN 0.00 -0.17 1 28 ARG 0.20 -0.16 1 29 TYR -0.40 -0.03 1 32 GLN 0.20 -0.10 1 37 TRP 0.20 -0.10 1 39 GLN -0.30 -0.18 1 41 HIS 0.00 -0.15 1 45 TRP 0.20 -0.12 1 47 GLN -0.30 -0.18 1 49 HIS 0.30 -0.16 1 53 TRP 0.30 -0.13 1 55 GLN -0.30 -0.18 1 57 HIS 0.30 -0.15 1 61 TRP 0.20 -0.12 1 63 GLN -0.30 -0.18 1 65 HIS 0.10 -0.16 1 69 TRP 0.20 -0.11 1 71 GLN -0.10 -0.09 1 75 THR -0.30 -0.13 1 76 HIS 0.20 -0.07 1 77 SER 0.50 -0.13 1 78 GLN 0.60 -0.10 1 79 TRP -0.20 -0.04 1 80 ASN -0.20 -0.17 1 81 LYS 0.00 -0.22 1 83 SER -0.30 -0.06 1 84 LYS -0.10 -0.03 1 86 LYS 0.40 -0.03 1 87 THR -0.60 -0.06 1 88 ASN 0.20 -0.08 1 89 MET 0.30 -0.07 1 90 LYS 0.50 -0.12 1 91 HIS 0.20 -0.16 1 92 MET -0.40 -0.04 1 93 ALA 0.20 -0.04 1 95 ALA 0.00 -0.07 1 96 ALA 0.20 -0.08 1 97 ALA 0.10 -0.08 1 98 ALA 0.10 -0.06 1 100 ALA -0.40 0.02 1 101 VAL 0.20 0.00 1 102 VAL 0.50 -0.05 1 105 LEU -0.40 0.01 1 108 TYR -1.50 -0.05 1 109 MET -3.60 0.05 1 110 LEU -3.00 0.12 1 112 SER 0.00 -0.08 1 113 ALA 1.00 0.11 1 114 MET -5.50 0.25 1 115 SER 1.10 -0.13 1 116 ARG 1.50 -0.26 1 118 ILE 2.30 -0.04 1 119 ILE -2.90 -0.27 1 120 HIS -1.50 0.17 1 121 PHE -0.10 -0.28 1 123 SER -3.80 0.31 1 124 ASP 4.00 -0.15 1 125 TYR 4.10 -0.37 1 126 GLU 3.10 -0.77 1 127 ASP 5.00 0.01 1 128 ARG 4.60 -0.35 1 129 TYR 4.80 -0.74 1 130 TYR 5.40 -0.44 1 131 ARG 5.00 -0.43 1 132 GLU 1.80 -0.29 1 133 ASN -0.10 -0.47 1 134 MET 6.10 -1.06 1 135 HIS 4.30 -0.52 1 136 ARG 0.60 -0.22 1 137 TYR 0.20 0.16 1 139 ASN -0.70 -0.03 1 140 GLN -5.70 0.18 1 141 VAL -4.60 0.78 1 142 TYR -4.30 0.97 1 143 TYR -4.00 0.21 1 144 ARG -1.10 -0.04 1 146 MET 3.00 -0.05 1 147 ASP 1.50 -0.13 1 148 GLU -0.60 0.17 1 150 SER 0.40 0.08 1 151 ASN -1.80 0.01 1 153 ASN 4.30 -0.51 1 154 ASN 3.70 -0.19 1 156 VAL 6.40 -0.62 1 157 HIS 5.00 -0.43 1 158 ASP 3.00 -0.11 1 160 VAL 5.00 -0.50 1 161 ASN 3.60 -0.44 1 162 ILE 3.20 -0.43 1 163 THR 8.60 -0.31 1 164 ILE 6.50 -0.48 1 165 LYS 4.40 -0.28 1 166 GLN 2.40 -0.33 1 167 HIS 2.80 -0.15 1 168 THR 4.10 -0.17 1 169 VAL 3.60 -0.13 1 170 THR 2.90 -0.13 1 171 THR 2.80 -0.15 1 172 THR 2.90 0.03 1 173 THR 2.60 -0.12 1 174 LYS 1.00 0.01 1 176 GLU -1.60 -0.11 1 177 ASN -1.50 -0.09 1 178 PHE -1.50 0.64 1 179 THR -3.60 0.26 1 180 GLU 4.20 -0.28 1 181 THR 6.20 -0.58 1 182 ASP 3.20 -0.07 1 183 VAL 6.90 -0.83 1 184 LYS 4.10 -0.27 1 185 MET 5.20 -0.35 1 186 MET 3.80 -0.92 1 187 GLU 5.70 -0.69 1 188 ARG 3.30 -0.15 1 189 VAL 4.20 -0.33 1 190 VAL 5.70 -0.49 1 191 GLU 5.30 -0.76 1 192 GLN 4.70 -0.37 1 193 MET 3.10 -0.33 1 195 ILE 6.30 -0.60 1 196 THR 6.70 -0.42 1 197 GLN 4.10 -0.71 1 199 GLU 4.50 -0.61 1 200 ARG 3.90 -0.29 1 201 GLU 2.00 -0.32 1 202 SER 4.20 -0.57 1 203 GLN 3.50 -0.24 1 204 ALA 2.00 -0.16 1 205 TYR 2.00 -0.38 1 206 TYR 1.80 -0.19 1 207 GLN 0.90 -0.12 1 208 ARG 0.40 -0.08 1 210 SER 0.20 0.02 1 stop_ save_