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 bmr16964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -2.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 9.00 _LACS_plot.Line_2_terminator_val_y_2 6.65 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 LYS 4.20 -0.30 0 16 VAL 7.60 5.80 1 17 ALA 4.60 3.20 1 19 LEU 3.00 3.50 1 20 PHE 4.90 4.60 1 21 ASN 4.30 3.50 1 22 ASN 3.60 4.80 1 24 VAL 5.70 4.60 1 25 ASP -0.70 2.30 1 27 PHE 4.10 4.40 1 28 GLU 1.50 0.10 1 29 TYR 0.20 0.90 1 30 VAL 0.20 -0.70 1 31 GLN -4.30 -2.60 1 32 LEU 0.80 -0.60 1 34 ARG 6.40 5.50 1 36 PHE 5.70 5.10 1 38 ARG 2.80 1.40 1 39 ASP 0.50 0.90 1 40 TYR 5.20 3.10 1 41 GLU 3.20 3.80 1 42 ARG 4.50 3.30 1 44 GLN 3.20 1.90 1 45 LEU 4.10 2.40 1 46 ARG 6.10 4.70 1 47 LEU 3.90 3.40 1 48 ASP 1.60 2.40 1 49 ILE 4.30 3.80 1 50 ALA 5.40 3.30 1 51 LYS 4.60 3.10 1 52 ALA 5.10 2.70 1 53 ARG 6.60 5.10 1 55 SER 4.00 3.10 1 56 ARG 3.80 3.60 1 57 TRP 9.00 5.50 1 59 GLU 2.70 1.60 1 60 ALA 1.30 2.50 1 61 VAL -0.20 -1.80 1 63 ILE 2.30 1.70 1 64 ASN 1.70 1.90 1 65 ASP 5.20 4.40 1 66 ASP -1.40 -0.70 1 68 ARG 2.80 2.60 1 69 PHE 1.40 1.00 1 70 HIS -1.50 0.30 1 71 SER -3.70 -2.20 1 72 SER 0.90 0.70 1 73 ALA -1.60 -0.80 1 75 THR 0.50 0.10 1 76 ASP -1.70 -0.20 1 77 LYS 4.90 4.20 1 78 SER 6.50 4.10 1 79 VAL 6.00 4.40 1 80 GLN 5.10 4.50 1 81 LEU 4.80 3.80 1 82 ALA 3.40 2.70 1 83 LYS 3.90 3.80 1 84 SER 2.90 2.20 1 85 ILE 6.10 4.50 1 86 VAL 6.30 4.20 1 87 GLU 3.50 1.60 1 88 GLU 4.50 4.10 1 89 ILE 5.70 5.10 1 90 LEU 5.40 3.90 1 91 LEU 3.40 2.70 1 92 LEU 3.40 2.90 1 93 PHE 5.40 4.50 1 94 GLU 4.80 3.20 1 95 SER 5.40 4.30 1 96 ALA 2.50 2.30 1 97 GLN 4.80 3.10 1 98 LYS 5.70 2.50 1 99 THR 6.40 5.70 1 100 SER 4.50 4.30 1 101 LYS 3.80 2.00 1 102 ARG 5.00 3.80 1 103 TYR 4.50 3.50 1 104 GLU 2.50 2.40 1 105 LEU 1.30 2.10 1 106 VAL -2.00 -2.10 1 107 ALA -2.00 -0.60 1 108 ASP -1.10 -0.10 1 109 GLN 4.20 3.30 1 110 GLN 3.50 1.90 1 111 ASP 0.80 1.30 1 112 LEU 1.20 -0.70 1 113 VAL -0.10 0.00 1 114 VAL -3.80 -3.00 1 115 PHE 1.30 1.00 1 116 GLU -6.70 -2.40 1 117 ASP 5.10 3.30 1 118 LYS 3.90 1.70 1 119 ASP 1.10 1.40 1 120 MET -1.20 0.80 1 121 LYS 4.10 1.50 1 123 ILE 5.20 3.40 1 125 ARG 4.80 3.60 1 126 ALA 3.40 2.30 1 127 LEU 2.00 2.60 1 128 HIS 3.20 3.50 1 129 ARG 5.00 3.30 1 130 ARG 4.40 3.30 1 131 LEU 3.90 2.70 1 132 ASN 4.40 3.00 1 133 ASP 3.60 3.10 1 134 LEU 4.10 2.90 1 135 VAL 5.70 4.20 1 136 SER 4.70 3.40 1 137 ARG 5.50 2.50 1 138 ARG 0.40 1.30 1 139 GLN 1.00 0.30 1 142 THR 0.20 -0.10 1 146 LYS 2.10 1.10 1 147 LYS 0.00 -0.60 1 148 THR -2.50 -1.20 1 149 ALA -0.30 -0.10 1 150 TRP -2.80 -2.10 1 151 ALA -5.30 -2.90 1 152 LEU -5.30 -1.70 1 153 TYR -1.00 0.40 1 154 ASP -5.80 -2.10 1 156 LYS 5.00 3.20 1 157 SER 4.60 3.70 1 158 LEU 4.20 3.00 1 159 GLU 2.20 1.70 1 160 LYS 4.20 3.10 1 161 ILE 4.90 4.40 1 162 VAL 6.40 4.90 1 163 ASP 2.30 3.30 1 164 GLN 2.70 3.00 1 165 VAL 8.00 6.20 1 166 ALA 3.90 3.40 1 167 ARG 4.00 3.10 1 168 PHE 3.20 1.40 1 169 VAL 6.80 4.30 1 170 ASP 5.00 3.70 1 171 GLU 3.90 3.60 1 172 LEU 6.60 3.10 1 173 GLU 3.00 2.60 1 174 LYS 1.30 1.20 1 175 ALA 0.50 0.50 1 176 PHE -3.80 -0.70 1 179 GLU 5.20 4.80 1 180 ALA 5.00 2.60 1 181 VAL 4.40 3.50 1 183 HIS 5.10 5.60 1 184 LYS 3.80 2.40 1 185 LEU -2.40 -0.30 1 186 ALA 3.90 2.60 1 187 GLU 3.30 2.80 1 188 ILE 6.50 5.00 1 189 GLU 2.90 2.50 1 190 ILE -0.90 -1.30 1 191 GLU 5.60 2.90 1 192 GLU -0.10 -0.50 1 193 VAL 2.80 0.50 1 194 GLU -2.90 -0.70 1 195 ASP -3.40 -2.30 1 196 GLU 3.60 3.50 1 197 ALA 4.50 3.40 1 198 SER 5.60 4.40 1 199 LEU 2.20 2.60 1 200 THR 6.60 5.40 1 201 ILE 5.00 3.70 1 202 LEU 3.30 2.90 1 203 LYS 4.40 3.80 1 204 ASP 2.50 2.70 1 205 ALA 3.50 2.30 1 206 ALA 0.50 0.00 1 209 ILE -2.20 0.30 1 210 ASP -2.20 -1.50 1 211 ALA 3.00 2.30 1 212 ALA 3.40 2.40 1 213 MET 2.00 3.00 1 215 ASP 3.30 2.60 1 216 ALA 4.20 2.50 1 217 ALA 4.50 2.90 1 218 ALA 4.30 3.10 1 219 GLN 3.40 2.50 1 220 LYS 4.20 3.60 1 221 ILE 5.70 5.10 1 222 ASP 4.00 3.10 1 223 ALA 2.40 1.70 1 224 ILE 3.70 3.20 1 225 VAL 3.70 0.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 3.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 9.00 _LACS_plot.Line_2_terminator_val_y_2 -2.35 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 LYS 4.20 -4.50 0 16 VAL 7.60 -1.80 1 17 ALA 4.60 -1.40 1 19 LEU 3.00 0.50 1 20 PHE 4.90 -0.30 1 21 ASN 4.30 -0.80 1 22 ASN 3.60 1.20 1 24 VAL 5.70 -1.10 1 25 ASP -0.70 3.00 1 27 PHE 4.10 0.30 1 28 GLU 1.50 -1.40 1 29 TYR 0.20 0.70 1 30 VAL 0.20 -0.90 1 31 GLN -4.30 1.70 1 32 LEU 0.80 -1.40 1 34 ARG 6.40 -0.90 1 36 PHE 5.70 -0.60 1 38 ARG 2.80 -1.40 1 39 ASP 0.50 0.40 1 40 TYR 5.20 -2.10 1 41 GLU 3.20 0.60 1 42 ARG 4.50 -1.20 1 44 GLN 3.20 -1.30 1 45 LEU 4.10 -1.70 1 46 ARG 6.10 -1.40 1 47 LEU 3.90 -0.50 1 48 ASP 1.60 0.80 1 49 ILE 4.30 -0.50 1 50 ALA 5.40 -2.10 1 51 LYS 4.60 -1.50 1 52 ALA 5.10 -2.40 1 53 ARG 6.60 -1.50 1 55 SER 4.00 -0.90 1 56 ARG 3.80 -0.20 1 57 TRP 9.00 -3.50 1 59 GLU 2.70 -1.10 1 60 ALA 1.30 1.20 1 61 VAL -0.20 -1.60 1 63 ILE 2.30 -0.60 1 64 ASN 1.70 0.20 1 65 ASP 5.20 -0.80 1 66 ASP -1.40 0.70 1 68 ARG 2.80 -0.20 1 69 PHE 1.40 -0.40 1 70 HIS -1.50 1.80 1 71 SER -3.70 1.50 1 72 SER 0.90 -0.20 1 73 ALA -1.60 0.80 1 75 THR 0.50 -0.40 1 76 ASP -1.70 1.50 1 77 LYS 4.90 -0.70 1 78 SER 6.50 -2.40 1 79 VAL 6.00 -1.60 1 80 GLN 5.10 -0.60 1 81 LEU 4.80 -1.00 1 82 ALA 3.40 -0.70 1 83 LYS 3.90 -0.10 1 84 SER 2.90 -0.70 1 85 ILE 6.10 -1.60 1 86 VAL 6.30 -2.10 1 87 GLU 3.50 -1.90 1 88 GLU 4.50 -0.40 1 89 ILE 5.70 -0.60 1 90 LEU 5.40 -1.50 1 91 LEU 3.40 -0.70 1 92 LEU 3.40 -0.50 1 93 PHE 5.40 -0.90 1 94 GLU 4.80 -1.60 1 95 SER 5.40 -1.10 1 96 ALA 2.50 -0.20 1 97 GLN 4.80 -1.70 1 98 LYS 5.70 -3.20 1 99 THR 6.40 -0.70 1 100 SER 4.50 -0.20 1 101 LYS 3.80 -1.80 1 102 ARG 5.00 -1.20 1 103 TYR 4.50 -1.00 1 104 GLU 2.50 -0.10 1 105 LEU 1.30 0.80 1 106 VAL -2.00 -0.10 1 107 ALA -2.00 1.40 1 108 ASP -1.10 1.00 1 109 GLN 4.20 -0.90 1 110 GLN 3.50 -1.60 1 111 ASP 0.80 0.50 1 112 LEU 1.20 -1.90 1 113 VAL -0.10 0.10 1 114 VAL -3.80 0.80 1 115 PHE 1.30 -0.30 1 116 GLU -6.70 4.30 1 117 ASP 5.10 -1.80 1 118 LYS 3.90 -2.20 1 119 ASP 1.10 0.30 1 120 MET -1.20 2.00 1 121 LYS 4.10 -2.60 1 123 ILE 5.20 -1.80 1 125 ARG 4.80 -1.20 1 126 ALA 3.40 -1.10 1 127 LEU 2.00 0.60 1 128 HIS 3.20 0.30 1 129 ARG 5.00 -1.70 1 130 ARG 4.40 -1.10 1 131 LEU 3.90 -1.20 1 132 ASN 4.40 -1.40 1 133 ASP 3.60 -0.50 1 134 LEU 4.10 -1.20 1 135 VAL 5.70 -1.50 1 136 SER 4.70 -1.30 1 137 ARG 5.50 -3.00 1 138 ARG 0.40 0.90 1 139 GLN 1.00 -0.70 1 142 THR 0.20 -0.30 1 146 LYS 2.10 -1.00 1 147 LYS 0.00 -0.60 1 148 THR -2.50 1.30 1 149 ALA -0.30 0.20 1 150 TRP -2.80 0.70 1 151 ALA -5.30 2.40 1 152 LEU -5.30 3.60 1 153 TYR -1.00 1.40 1 154 ASP -5.80 3.70 1 156 LYS 5.00 -1.80 1 157 SER 4.60 -0.90 1 158 LEU 4.20 -1.20 1 159 GLU 2.20 -0.50 1 160 LYS 4.20 -1.10 1 161 ILE 4.90 -0.50 1 162 VAL 6.40 -1.50 1 163 ASP 2.30 1.00 1 164 GLN 2.70 0.30 1 165 VAL 8.00 -1.80 1 166 ALA 3.90 -0.50 1 167 ARG 4.00 -0.90 1 168 PHE 3.20 -1.80 1 169 VAL 6.80 -2.50 1 170 ASP 5.00 -1.30 1 171 GLU 3.90 -0.30 1 172 LEU 6.60 -3.50 1 173 GLU 3.00 -0.40 1 174 LYS 1.30 -0.10 1 175 ALA 0.50 0.00 1 176 PHE -3.80 3.10 1 179 GLU 5.20 -0.40 1 180 ALA 5.00 -2.40 1 181 VAL 4.40 -0.90 1 183 HIS 5.10 0.50 1 184 LYS 3.80 -1.40 1 185 LEU -2.40 2.10 1 186 ALA 3.90 -1.30 1 187 GLU 3.30 -0.50 1 188 ILE 6.50 -1.50 1 189 GLU 2.90 -0.40 1 190 ILE -0.90 -0.40 1 191 GLU 5.60 -2.70 1 192 GLU -0.10 -0.40 1 193 VAL 2.80 -2.30 1 194 GLU -2.90 2.20 1 195 ASP -3.40 1.10 1 196 GLU 3.60 -0.10 1 197 ALA 4.50 -1.10 1 198 SER 5.60 -1.20 1 199 LEU 2.20 0.40 1 200 THR 6.60 -1.20 1 201 ILE 5.00 -1.30 1 202 LEU 3.30 -0.40 1 203 LYS 4.40 -0.60 1 204 ASP 2.50 0.20 1 205 ALA 3.50 -1.20 1 206 ALA 0.50 -0.50 1 209 ILE -2.20 2.50 1 210 ASP -2.20 0.70 1 211 ALA 3.00 -0.70 1 212 ALA 3.40 -1.00 1 213 MET 2.00 1.00 1 215 ASP 3.30 -0.70 1 216 ALA 4.20 -1.70 1 217 ALA 4.50 -1.60 1 218 ALA 4.30 -1.20 1 219 GLN 3.40 -0.90 1 220 LYS 4.20 -0.60 1 221 ILE 5.70 -0.60 1 222 ASP 4.00 -0.90 1 223 ALA 2.40 -0.70 1 224 ILE 3.70 -0.50 1 225 VAL 3.70 -3.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -1.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.55 _LACS_plot.Line_2_terminator_val_x_2 9.00 _LACS_plot.Line_2_terminator_val_y_2 2.55 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 TYR 0.20 -4.00 0 81 LEU 4.80 -3.00 0 116 GLU -6.70 0.10 0 16 VAL 7.60 0.80 1 17 ALA 4.60 -0.60 1 19 LEU 3.00 1.00 1 20 PHE 4.90 0.80 1 22 ASN 3.60 0.60 1 24 VAL 5.70 2.40 1 25 ASP -0.70 2.30 1 27 PHE 4.10 1.70 1 28 GLU 1.50 0.00 1 30 VAL 0.20 -1.10 1 31 GLN -4.30 -2.40 1 32 LEU 0.80 -1.80 1 34 ARG 6.40 0.60 1 36 PHE 5.70 2.10 1 38 ARG 2.80 1.10 1 39 ASP 0.50 -1.50 1 40 TYR 5.20 -1.40 1 41 GLU 3.20 0.00 1 42 ARG 4.50 1.10 1 45 LEU 4.10 1.30 1 46 ARG 6.10 2.00 1 48 ASP 1.60 2.40 1 49 ILE 4.30 0.70 1 50 ALA 5.40 0.40 1 51 LYS 4.60 1.60 1 52 ALA 5.10 1.40 1 53 ARG 6.60 3.30 1 55 SER 4.00 2.20 1 56 ARG 3.80 1.00 1 57 TRP 9.00 0.50 1 60 ALA 1.30 1.00 1 61 VAL -0.20 -2.10 1 62 LYS 4.20 -0.40 1 63 ILE 2.30 -1.80 1 64 ASN 1.70 -0.10 1 65 ASP 5.20 -1.00 1 66 ASP -1.40 0.20 1 68 ARG 2.80 2.10 1 69 PHE 1.40 -0.30 1 71 SER -3.70 0.50 1 75 THR 0.50 0.40 1 76 ASP -1.70 0.80 1 77 LYS 4.90 1.70 1 78 SER 6.50 1.20 1 79 VAL 6.00 1.70 1 82 ALA 3.40 2.30 1 83 LYS 3.90 -0.30 1 84 SER 2.90 2.00 1 85 ILE 6.10 1.10 1 86 VAL 6.30 2.20 1 87 GLU 3.50 2.60 1 88 GLU 4.50 2.20 1 91 LEU 3.40 1.10 1 92 LEU 3.40 2.60 1 93 PHE 5.40 2.00 1 94 GLU 4.80 2.30 1 95 SER 5.40 1.10 1 98 LYS 5.70 2.30 1 99 THR 6.40 2.80 1 102 ARG 5.00 2.30 1 103 TYR 4.50 2.20 1 105 LEU 1.30 0.30 1 106 VAL -2.00 -0.60 1 107 ALA -2.00 -0.10 1 108 ASP -1.10 1.30 1 113 VAL -0.10 -0.10 1 115 PHE 1.30 -0.70 1 118 LYS 3.90 -2.40 1 121 LYS 4.10 0.60 1 123 ILE 5.20 2.00 1 125 ARG 4.80 -1.10 1 132 ASN 4.40 3.30 1 133 ASP 3.60 1.90 1 135 VAL 5.70 1.90 1 136 SER 4.70 2.70 1 148 THR -2.50 -0.90 1 149 ALA -0.30 -1.00 1 150 TRP -2.80 -3.90 1 151 ALA -5.30 -1.90 1 152 LEU -5.30 -0.60 1 153 TYR -1.00 -2.90 1 154 ASP -5.80 -1.10 1 157 SER 4.60 1.70 1 160 LYS 4.20 2.00 1 161 ILE 4.90 0.90 1 162 VAL 6.40 0.90 1 163 ASP 2.30 2.10 1 164 GLN 2.70 2.90 1 165 VAL 8.00 0.80 1 166 ALA 3.90 1.50 1 168 PHE 3.20 3.10 1 169 VAL 6.80 1.60 1 173 GLU 3.00 0.80 1 174 LYS 1.30 1.40 1 175 ALA 0.50 -2.20 1 176 PHE -3.80 1.30 1 179 GLU 5.20 1.80 1 181 VAL 4.40 1.90 1 185 LEU -2.40 -2.50 1 187 GLU 3.30 3.10 1 188 ILE 6.50 1.50 1 189 GLU 2.90 1.70 1 190 ILE -0.90 0.60 1 191 GLU 5.60 0.80 1 192 GLU -0.10 -1.10 1 193 VAL 2.80 -0.80 1 194 GLU -2.90 -1.40 1 195 ASP -3.40 -1.30 1 196 GLU 3.60 1.70 1 197 ALA 4.50 2.90 1 198 SER 5.60 1.10 1 199 LEU 2.20 0.80 1 200 THR 6.60 1.30 1 201 ILE 5.00 2.30 1 205 ALA 3.50 -0.50 1 206 ALA 0.50 1.10 1 209 ILE -2.20 -1.90 1 210 ASP -2.20 -1.80 1 211 ALA 3.00 1.40 1 212 ALA 3.40 -2.90 1 213 MET 2.00 1.50 1 215 ASP 3.30 2.40 1 220 LYS 4.20 2.10 1 221 ILE 5.70 2.50 1 223 ALA 2.40 2.00 1 224 ILE 3.70 2.90 1 stop_ save_