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 bmr17362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.50 _LACS_plot.Line_1_terminator_val_y_1 -2.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.08 _LACS_plot.Line_2_terminator_val_x_2 7.20 _LACS_plot.Line_2_terminator_val_y_2 4.67 _LACS_plot.Y_axis_chem_shift_offset 0.55 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 193 LYS 0.80 -3.90 0 88 HIS -3.80 2.00 0 10 ASN 1.00 0.00 1 11 ILE 3.90 1.90 1 12 ALA 3.90 3.00 1 13 VAL 5.30 3.10 1 14 GLN 4.60 2.60 1 15 ARG -0.10 1.50 1 16 ILE -2.90 -1.10 1 17 LYS 6.25 4.05 1 18 ARG 4.60 2.70 1 19 GLU 2.90 2.40 1 20 PHE 3.90 3.20 1 21 LYS 4.70 2.60 1 22 GLU 3.00 1.70 1 23 VAL 6.70 4.00 1 24 LEU 3.70 2.10 1 25 LYS 1.00 -1.00 1 26 SER 0.40 0.70 1 27 GLU 0.40 -0.30 1 28 GLU 0.00 -0.40 1 29 THR -0.60 -1.00 1 30 SER 0.10 -0.40 1 31 LYS 3.50 -0.30 1 32 ASN 2.50 0.50 1 33 GLN 0.10 0.90 1 34 ILE -0.50 0.30 1 35 LYS -3.20 -1.00 1 36 VAL -3.90 -2.40 1 37 ASP -5.30 -1.80 1 38 LEU 0.70 -0.60 1 39 VAL 0.60 -0.60 1 40 ASP 0.60 0.20 1 41 GLU -3.10 -1.00 1 42 ASN 3.70 3.70 1 43 PHE -0.90 -0.20 1 44 THR 0.40 -0.30 1 45 GLU -2.20 -2.40 1 46 LEU -4.50 -2.30 1 47 ARG -2.90 -3.00 1 49 GLU -4.50 -1.70 1 50 ILE -5.30 -3.10 1 51 ALA -2.20 -2.20 1 55 ASP 3.70 1.00 1 56 THR -3.50 -2.80 1 58 TYR -1.20 -2.40 1 59 GLU 1.60 0.80 1 62 ARG -1.80 -1.40 1 63 TYR -1.40 -0.80 1 64 GLN -1.80 -1.60 1 65 LEU -4.50 -2.30 1 66 GLU -4.60 -2.10 1 67 ILE -1.64 -1.52 1 68 LYS -2.55 -2.27 1 69 ILE 4.80 1.60 1 71 GLU 3.30 1.70 1 72 THR -0.00 -1.90 1 73 TYR 0.50 1.70 1 75 PHE 4.60 2.10 1 76 ASN -3.00 -1.60 1 79 LYS 0.20 -1.80 1 80 VAL -3.00 -2.70 1 81 ARG -4.40 -1.90 1 82 PHE 3.60 1.60 1 83 ILE 0.90 0.40 1 84 THR 0.80 0.90 1 85 LYS 1.40 -0.20 1 86 ILE 0.66 -0.68 1 87 TRP -3.80 -3.70 1 90 ASN 0.60 1.90 1 91 ILE -5.50 -3.20 1 92 SER 1.20 -0.10 1 93 SER 3.80 2.90 1 94 VAL 1.60 1.70 1 95 THR -2.10 -0.90 1 97 ALA 0.60 -0.30 1 98 ILE -3.80 -1.30 1 100 LEU -3.00 -1.20 1 101 ASP 2.50 3.90 1 102 ILE 4.20 2.60 1 103 LEU 0.20 -2.10 1 104 LYS 1.20 -0.40 1 105 ASP 2.20 1.00 1 106 GLN 0.60 -1.80 1 107 TRP 0.80 0.80 1 108 ALA -5.30 -3.20 1 109 ALA 2.30 0.60 1 110 ALA 0.30 -0.80 1 111 MET 3.20 1.30 1 112 THR -2.00 0.70 1 113 LEU 3.30 2.40 1 114 ARG 6.10 3.90 1 115 THR 6.30 4.00 1 116 VAL 6.70 4.50 1 117 LEU 5.30 3.10 1 118 LEU 4.50 2.00 1 119 SER 3.60 3.50 1 120 LEU 0.80 -0.70 1 121 GLN -2.20 -0.10 1 122 ALA 1.40 0.20 1 123 LEU 3.10 -1.40 1 124 LEU 5.50 2.30 1 125 ALA 0.00 -0.70 1 126 ALA -0.60 -1.60 1 127 ALA -0.20 -1.20 1 128 GLU -2.20 -2.70 1 130 ASP 2.10 0.20 1 131 ASP 0.00 -1.10 1 133 GLN -0.80 -1.40 1 134 ASP -3.90 -2.20 1 135 ALA 3.50 2.00 1 136 VAL 5.40 3.10 1 137 VAL 4.71 2.64 1 138 ALA 3.80 2.30 1 139 ASN 4.20 2.60 1 140 GLN 2.30 3.40 1 141 TYR 3.90 3.00 1 142 LYS 2.80 2.10 1 143 GLN 1.90 1.00 1 144 ASN -0.00 -0.50 1 146 GLU 4.30 2.10 1 147 MET 2.80 2.20 1 148 PHE 5.50 3.50 1 149 LYS 5.80 3.70 1 150 GLN 4.40 1.90 1 151 THR 7.10 5.80 1 152 ALA 4.90 2.60 1 153 ARG 3.70 2.20 1 154 LEU 5.20 2.00 1 155 TRP 6.50 4.50 1 156 ALA 4.10 2.50 1 157 HIS 3.40 2.40 1 158 VAL 4.40 2.90 1 159 TYR 0.70 0.50 1 160 ALA -4.30 -2.10 1 162 ALA 1.10 0.10 1 164 VAL -0.60 -0.90 1 165 SER -2.80 -2.40 1 166 SER -1.00 -1.80 1 168 GLU 3.70 1.90 1 169 TYR 3.10 -0.60 1 170 THR 7.10 4.50 1 171 LYS 2.70 0.40 1 172 LYS 4.00 3.50 1 173 ILE 3.30 2.50 1 174 GLU 3.90 2.10 1 175 ASN 3.80 2.30 1 176 LEU 3.00 2.20 1 178 ALA 3.50 1.20 1 179 MET 0.90 0.00 1 181 PHE -2.10 -1.30 1 182 ASP -1.90 -0.30 1 183 ARG 5.40 4.00 1 184 ASN 4.90 2.90 1 185 ALA 4.20 1.90 1 186 VAL 6.00 3.90 1 187 ILE 7.20 5.10 1 188 VAL 6.90 4.80 1 189 ALA 3.90 2.50 1 190 LEU 4.90 1.90 1 191 SER 3.60 3.50 1 192 SER 2.60 1.70 1 194 SER 4.40 1.20 1 195 TRP 6.70 1.20 1 196 ASP -1.80 -1.50 1 197 VAL 6.00 3.90 1 198 GLU 4.90 3.20 1 199 THR 5.00 3.00 1 200 ALA 4.40 2.30 1 201 THR 7.20 5.40 1 202 GLU 3.50 2.00 1 203 LEU 3.60 2.00 1 204 LEU 4.30 1.50 1 205 LEU 0.90 0.10 1 206 SER 0.60 0.10 1 207 ASN 0.20 1.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.50 _LACS_plot.Line_1_terminator_val_y_1 2.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.08 _LACS_plot.Line_2_terminator_val_x_2 7.20 _LACS_plot.Line_2_terminator_val_y_2 -2.53 _LACS_plot.Y_axis_chem_shift_offset 0.55 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 193 LYS 0.80 -4.70 0 88 HIS -3.80 5.80 0 10 ASN 1.00 -1.00 1 11 ILE 3.90 -2.00 1 12 ALA 3.90 -0.90 1 13 VAL 5.30 -2.20 1 14 GLN 4.60 -2.00 1 15 ARG -0.10 1.60 1 16 ILE -2.90 1.80 1 17 LYS 6.25 -2.20 1 18 ARG 4.60 -1.90 1 19 GLU 2.90 -0.50 1 20 PHE 3.90 -0.70 1 21 LYS 4.70 -2.10 1 22 GLU 3.00 -1.30 1 23 VAL 6.70 -2.70 1 24 LEU 3.70 -1.60 1 25 LYS 1.00 -2.00 1 26 SER 0.40 0.30 1 27 GLU 0.40 -0.70 1 28 GLU 0.00 -0.40 1 29 THR -0.60 -0.40 1 30 SER 0.10 -0.50 1 31 LYS 3.50 -3.80 1 32 ASN 2.50 -2.00 1 33 GLN 0.10 0.80 1 34 ILE -0.50 0.80 1 35 LYS -3.20 2.20 1 36 VAL -3.90 1.50 1 37 ASP -5.30 3.50 1 38 LEU 0.70 -1.30 1 39 VAL 0.60 -1.20 1 40 ASP 0.60 -0.40 1 41 GLU -3.10 2.10 1 42 ASN 3.70 0.00 1 43 PHE -0.90 0.70 1 44 THR 0.40 -0.70 1 45 GLU -2.20 -0.20 1 46 LEU -4.50 2.20 1 47 ARG -2.90 -0.10 1 49 GLU -4.50 2.80 1 50 ILE -5.30 2.20 1 51 ALA -2.20 0.00 1 55 ASP 3.70 -2.70 1 56 THR -3.50 0.70 1 58 TYR -1.20 -1.20 1 59 GLU 1.60 -0.80 1 62 ARG -1.80 0.40 1 63 TYR -1.40 0.60 1 64 GLN -1.80 0.20 1 65 LEU -4.50 2.20 1 66 GLU -4.60 2.50 1 67 ILE -1.64 0.12 1 68 LYS -2.55 0.28 1 69 ILE 4.80 -3.20 1 71 GLU 3.30 -1.60 1 72 THR -0.00 -1.90 1 73 TYR 0.50 1.20 1 75 PHE 4.60 -2.50 1 76 ASN -3.00 1.40 1 79 LYS 0.20 -2.00 1 80 VAL -3.00 0.30 1 81 ARG -4.40 2.50 1 82 PHE 3.60 -2.00 1 83 ILE 0.90 -0.50 1 84 THR 0.80 0.10 1 85 LYS 1.40 -1.60 1 86 ILE 0.66 -1.34 1 87 TRP -3.80 0.10 1 90 ASN 0.60 1.30 1 91 ILE -5.50 2.30 1 92 SER 1.20 -1.30 1 93 SER 3.80 -0.90 1 94 VAL 1.60 0.10 1 95 THR -2.10 1.20 1 97 ALA 0.60 -0.90 1 98 ILE -3.80 2.50 1 100 LEU -3.00 1.80 1 101 ASP 2.50 1.40 1 102 ILE 4.20 -1.60 1 103 LEU 0.20 -2.30 1 104 LYS 1.20 -1.60 1 105 ASP 2.20 -1.20 1 106 GLN 0.60 -2.40 1 107 TRP 0.80 0.00 1 108 ALA -5.30 2.10 1 109 ALA 2.30 -1.70 1 110 ALA 0.30 -1.10 1 111 MET 3.20 -1.90 1 112 THR -2.00 2.70 1 113 LEU 3.30 -0.90 1 114 ARG 6.10 -2.20 1 115 THR 6.30 -2.30 1 116 VAL 6.70 -2.20 1 117 LEU 5.30 -2.20 1 118 LEU 4.50 -2.50 1 119 SER 3.60 -0.10 1 120 LEU 0.80 -1.50 1 121 GLN -2.20 2.10 1 122 ALA 1.40 -1.20 1 123 LEU 3.10 -4.50 1 124 LEU 5.50 -3.20 1 125 ALA 0.00 -0.70 1 126 ALA -0.60 -1.00 1 127 ALA -0.20 -1.00 1 128 GLU -2.20 -0.50 1 130 ASP 2.10 -1.90 1 131 ASP 0.00 -1.10 1 133 GLN -0.80 -0.60 1 134 ASP -3.90 1.70 1 135 ALA 3.50 -1.50 1 136 VAL 5.40 -2.30 1 137 VAL 4.71 -2.07 1 138 ALA 3.80 -1.50 1 139 ASN 4.20 -1.60 1 140 GLN 2.30 1.10 1 141 TYR 3.90 -0.90 1 142 LYS 2.80 -0.70 1 143 GLN 1.90 -0.90 1 144 ASN -0.00 -0.50 1 146 GLU 4.30 -2.20 1 147 MET 2.80 -0.60 1 148 PHE 5.50 -2.00 1 149 LYS 5.80 -2.10 1 150 GLN 4.40 -2.50 1 151 THR 7.10 -1.30 1 152 ALA 4.90 -2.30 1 153 ARG 3.70 -1.50 1 154 LEU 5.20 -3.20 1 155 TRP 6.50 -2.00 1 156 ALA 4.10 -1.60 1 157 HIS 3.40 -1.00 1 158 VAL 4.40 -1.50 1 159 TYR 0.70 -0.20 1 160 ALA -4.30 2.20 1 162 ALA 1.10 -1.00 1 164 VAL -0.60 -0.30 1 165 SER -2.80 0.40 1 166 SER -1.00 -0.80 1 168 GLU 3.70 -1.80 1 169 TYR 3.10 -3.70 1 170 THR 7.10 -2.60 1 171 LYS 2.70 -2.30 1 172 LYS 4.00 -0.50 1 173 ILE 3.30 -0.80 1 174 GLU 3.90 -1.80 1 175 ASN 3.80 -1.50 1 176 LEU 3.00 -0.80 1 178 ALA 3.50 -2.30 1 179 MET 0.90 -0.90 1 181 PHE -2.10 0.80 1 182 ASP -1.90 1.60 1 183 ARG 5.40 -1.40 1 184 ASN 4.90 -2.00 1 185 ALA 4.20 -2.30 1 186 VAL 6.00 -2.10 1 187 ILE 7.20 -2.10 1 188 VAL 6.90 -2.10 1 189 ALA 3.90 -1.40 1 190 LEU 4.90 -3.00 1 191 SER 3.60 -0.10 1 192 SER 2.60 -0.90 1 194 SER 4.40 -3.20 1 195 TRP 6.70 -5.50 1 196 ASP -1.80 0.30 1 197 VAL 6.00 -2.10 1 198 GLU 4.90 -1.70 1 199 THR 5.00 -2.00 1 200 ALA 4.40 -2.10 1 201 THR 7.20 -1.80 1 202 GLU 3.50 -1.50 1 203 LEU 3.60 -1.60 1 204 LEU 4.30 -2.80 1 205 LEU 0.90 -0.80 1 206 SER 0.60 -0.50 1 207 ASN 0.20 1.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17362_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.50 _LACS_plot.Line_1_terminator_val_y_1 -2.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 7.20 _LACS_plot.Line_2_terminator_val_y_2 2.03 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 195 TRP 6.70 -3.80 0 10 ASN 1.00 0.50 1 11 ILE 3.90 0.50 1 12 ALA 3.90 1.40 1 13 VAL 5.30 1.00 1 14 GLN 4.60 1.80 1 15 ARG -0.10 -0.40 1 17 LYS 6.25 2.90 1 18 ARG 4.60 3.10 1 19 GLU 2.90 3.30 1 20 PHE 3.90 -1.20 1 21 LYS 4.70 1.50 1 22 GLU 3.00 2.80 1 23 VAL 6.70 2.50 1 25 LYS 1.00 -0.10 1 27 GLU 0.40 -0.10 1 28 GLU 0.00 0.60 1 30 SER 0.10 -0.10 1 31 LYS 3.50 -0.70 1 32 ASN 2.50 3.10 1 33 GLN 0.10 2.40 1 35 LYS -3.20 -2.80 1 36 VAL -3.90 -4.50 1 37 ASP -5.30 -1.60 1 38 LEU 0.70 -0.90 1 39 VAL 0.60 -1.00 1 40 ASP 0.60 0.60 1 41 GLU -3.10 -0.90 1 43 PHE -0.90 -0.10 1 45 GLU -2.20 -0.60 1 46 LEU -4.50 -2.20 1 47 ARG -2.90 -0.40 1 49 GLU -4.50 -2.30 1 50 ILE -5.30 -1.70 1 51 ALA -2.20 0.90 1 55 ASP 3.70 -1.60 1 58 TYR -1.20 0.70 1 59 GLU 1.60 -1.20 1 62 ARG -1.80 -2.40 1 63 TYR -1.40 -1.80 1 65 LEU -4.50 -2.90 1 66 GLU -4.60 -2.70 1 67 ILE -1.64 -2.80 1 68 LYS -2.55 -3.10 1 71 GLU 3.30 -0.10 1 72 THR -0.00 -0.10 1 75 PHE 4.60 -0.60 1 79 LYS 0.20 0.10 1 80 VAL -3.00 -0.40 1 81 ARG -4.40 -0.90 1 82 PHE 3.60 -1.10 1 83 ILE 0.90 1.10 1 84 THR 0.80 -1.40 1 85 LYS 1.40 -2.70 1 86 ILE 0.66 -2.90 1 87 TRP -3.80 -2.20 1 91 ILE -5.50 -2.10 1 92 SER 1.20 2.50 1 93 SER 3.80 -0.80 1 94 VAL 1.60 1.50 1 95 THR -2.10 1.50 1 97 ALA 0.60 -1.50 1 98 ILE -3.80 -0.90 1 100 LEU -3.00 -1.60 1 101 ASP 2.50 3.50 1 102 ILE 4.20 -3.20 1 103 LEU 0.20 -1.10 1 104 LYS 1.20 -0.90 1 105 ASP 2.20 0.20 1 106 GLN 0.60 -1.70 1 108 ALA -5.30 -0.50 1 109 ALA 2.30 -1.50 1 110 ALA 0.30 0.60 1 111 MET 3.20 -3.80 1 113 LEU 3.30 0.50 1 114 ARG 6.10 0.60 1 115 THR 6.30 3.40 1 116 VAL 6.70 0.80 1 117 LEU 5.30 0.80 1 118 LEU 4.50 0.30 1 119 SER 3.60 0.00 1 120 LEU 0.80 -0.70 1 121 GLN -2.20 0.50 1 122 ALA 1.40 0.00 1 124 LEU 5.50 -0.50 1 125 ALA 0.00 -1.50 1 126 ALA -0.60 1.80 1 127 ALA -0.20 -1.60 1 130 ASP 2.10 -1.20 1 133 GLN -0.80 -1.90 1 134 ASP -3.90 -0.90 1 135 ALA 3.50 1.70 1 136 VAL 5.40 1.30 1 138 ALA 3.80 0.30 1 139 ASN 4.20 1.50 1 140 GLN 2.30 2.90 1 141 TYR 3.90 0.60 1 142 LYS 2.80 1.80 1 143 GLN 1.90 0.90 1 146 GLU 4.30 2.00 1 147 MET 2.80 3.90 1 148 PHE 5.50 0.40 1 149 LYS 5.80 2.00 1 150 GLN 4.40 3.20 1 151 THR 7.10 0.20 1 152 ALA 4.90 2.70 1 153 ARG 3.70 1.60 1 154 LEU 5.20 2.60 1 155 TRP 6.50 4.90 1 156 ALA 4.10 1.90 1 157 HIS 3.40 2.10 1 158 VAL 4.40 1.40 1 159 TYR 0.70 0.10 1 160 ALA -4.30 -0.30 1 164 VAL -0.60 1.60 1 165 SER -2.80 -1.10 1 168 GLU 3.70 2.20 1 169 TYR 3.10 2.00 1 170 THR 7.10 1.40 1 171 LYS 2.70 1.80 1 172 LYS 4.00 1.60 1 173 ILE 3.30 1.90 1 174 GLU 3.90 2.90 1 175 ASN 3.80 2.30 1 176 LEU 3.00 3.10 1 178 ALA 3.50 0.50 1 179 MET 0.90 -0.60 1 181 PHE -2.10 -1.50 1 182 ASP -1.90 -0.50 1 183 ARG 5.40 0.90 1 184 ASN 4.90 1.10 1 185 ALA 4.20 2.40 1 186 VAL 6.00 0.40 1 187 ILE 7.20 1.20 1 188 VAL 6.90 1.60 1 189 ALA 3.90 0.50 1 190 LEU 4.90 1.10 1 191 SER 3.60 0.00 1 192 SER 2.60 0.00 1 193 LYS 0.80 -0.70 1 194 SER 4.40 -1.80 1 196 ASP -1.80 -1.40 1 197 VAL 6.00 2.10 1 198 GLU 4.90 2.60 1 199 THR 5.00 3.40 1 200 ALA 4.40 0.10 1 201 THR 7.20 0.20 1 202 GLU 3.50 2.50 1 203 LEU 3.60 1.90 1 204 LEU 4.30 1.00 1 205 LEU 0.90 -0.30 1 206 SER 0.60 -1.60 1 stop_ save_