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 bmr25441_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 -3.04 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.97 _LACS_plot.Line_2_terminator_val_x_2 8.50 _LACS_plot.Line_2_terminator_val_y_2 4.47 _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 183 MET 6.70 6.60 0 21 VAL 0.80 0.80 1 22 LEU -1.80 -0.50 1 23 ASP -1.80 -0.60 1 26 TYR -2.00 -1.30 1 27 GLN 1.40 0.30 1 29 VAL -3.70 -1.30 1 30 THR 0.50 0.60 1 31 PHE -2.00 -0.70 1 35 ASN 2.40 0.80 1 36 ASP 7.00 3.40 1 37 TYR -2.00 0.30 1 38 TRP 0.00 1.60 1 39 ILE 0.60 -2.40 1 40 LEU -3.70 -1.30 1 41 ILE -1.20 0.40 1 42 ASN -1.40 -2.20 1 43 SER 0.60 1.30 1 46 ASN 2.10 0.70 1 48 VAL 3.70 2.40 1 49 VAL 0.80 2.10 1 50 LEU -3.80 -1.50 1 51 GLU -5.90 -1.50 1 53 THR -2.30 -2.10 1 54 ASN -1.00 -1.20 1 55 ASN 2.80 2.70 1 56 THR 1.00 0.90 1 57 ASP -2.00 -1.40 1 58 VAL -3.90 0.30 1 59 TRP -2.10 2.10 1 60 VAL -7.20 -4.20 1 61 ALA -5.70 -1.70 1 62 ILE -3.10 -1.60 1 63 ILE -3.30 -1.20 1 64 SER -2.40 -2.10 1 65 ILE -0.70 0.50 1 68 ASN 3.80 2.00 1 69 VAL -3.20 -0.50 1 70 ASN -0.10 -0.10 1 71 SER 1.80 0.80 1 72 GLU -3.80 -1.50 1 73 SER 0.10 -0.60 1 74 ARG -4.40 -0.50 1 75 GLN -3.20 -1.60 1 76 TYR -5.00 -1.40 1 77 SER -0.20 -1.70 1 78 LEU -2.80 -2.40 1 79 PHE 5.10 1.00 1 81 VAL -2.50 -1.10 1 82 ASN 0.90 0.70 1 83 LYS -4.90 -2.70 1 84 GLN -0.90 -0.90 1 85 ILE -4.20 -0.70 1 86 THR 2.80 1.50 1 87 VAL -5.70 -3.40 1 88 VAL -3.00 -1.60 1 89 ASN -0.30 -0.30 1 90 THR 1.00 -0.80 1 91 SER -2.30 -0.80 1 92 ASN 0.30 0.20 1 93 LYS -2.80 -0.70 1 95 LYS -5.00 -1.10 1 96 PHE -1.30 -1.90 1 97 MET -3.30 0.20 1 98 GLU -0.60 -0.40 1 99 MET -1.10 -3.50 1 100 PHE -7.60 -0.20 1 101 ARG 0.10 0.00 1 102 ASN -3.10 -2.00 1 103 ASN -3.20 -0.10 1 104 SER 2.60 1.60 1 105 ASN -0.90 -0.50 1 106 ALA -4.00 -1.50 1 107 GLU -2.40 -2.10 1 108 PHE 1.90 2.70 1 109 GLN -4.30 -1.80 1 111 LYS -0.50 2.40 1 112 ARG -8.70 -0.80 1 113 THR -1.30 0.70 1 114 LEU -4.50 -1.40 1 115 THR 1.50 0.60 1 116 SER -5.00 -2.60 1 117 SER 0.20 0.50 1 118 THR 0.20 0.10 1 119 LYS 8.50 3.30 1 120 LEU -3.00 -1.40 1 121 VAL -4.90 -2.30 1 123 ILE -3.50 -0.10 1 124 LEU -2.00 -1.30 1 125 LYS -0.30 -1.10 1 126 HIS -0.90 2.60 1 129 ARG -7.00 -1.80 1 130 LEU -6.30 -2.70 1 131 TRP -2.60 -1.30 1 132 THR -5.50 -2.60 1 133 TYR -2.60 0.20 1 134 HIS -5.30 0.40 1 136 GLU -4.90 -3.20 1 137 THR 3.50 1.60 1 139 ASN -1.60 -0.20 1 140 ALA 0.50 1.10 1 141 THR -4.00 -2.10 1 142 THR -3.70 -1.40 1 143 ASP -4.10 -0.80 1 144 TYR -4.90 -2.60 1 145 SER -1.70 -0.90 1 146 THR -0.20 0.20 1 147 THR -0.50 -2.30 1 148 SER -0.70 -0.30 1 149 ASN -1.80 -1.60 1 151 ASN 4.90 3.20 1 152 GLU -0.90 -1.20 1 153 ILE 3.80 2.40 1 154 SER -2.00 -1.20 1 155 VAL -5.20 -2.20 1 156 THR -1.00 0.00 1 157 THR -3.60 -3.10 1 158 TYR 1.30 0.10 1 159 ALA -5.70 -1.90 1 160 GLU -0.90 -0.60 1 161 PHE -7.60 -2.80 1 162 TYR -6.40 -2.10 1 163 ILE -2.20 -0.20 1 164 ILE -5.70 -0.50 1 166 ARG 5.60 3.80 1 167 SER 4.40 2.10 1 168 GLN 0.40 -1.60 1 169 GLU 3.20 4.10 1 171 LYS 3.30 0.80 1 173 THR 5.20 3.90 1 174 GLU 3.90 3.00 1 175 TYR 1.80 -1.10 1 176 ILE 4.90 1.40 1 177 ASN 1.00 3.20 1 178 THR -1.40 0.60 1 180 LEU 1.30 0.10 1 184 GLN -1.90 -1.40 1 187 ARG 0.10 0.00 1 188 ASN 0.20 1.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25441_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 5.66 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.03 _LACS_plot.Line_2_terminator_val_x_2 8.50 _LACS_plot.Line_2_terminator_val_y_2 -4.03 _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 183 MET 6.70 -0.10 0 21 VAL 0.80 0.00 1 22 LEU -1.80 1.30 1 23 ASP -1.80 1.20 1 26 TYR -2.00 0.70 1 27 GLN 1.40 -1.10 1 29 VAL -3.70 2.40 1 30 THR 0.50 0.10 1 31 PHE -2.00 1.30 1 35 ASN 2.40 -1.60 1 36 ASP 7.00 -3.60 1 37 TYR -2.00 2.30 1 38 TRP 0.00 1.60 1 39 ILE 0.60 -3.00 1 40 LEU -3.70 2.40 1 41 ILE -1.20 1.60 1 42 ASN -1.40 -0.80 1 43 SER 0.60 0.70 1 46 ASN 2.10 -1.40 1 48 VAL 3.70 -1.30 1 49 VAL 0.80 1.30 1 50 LEU -3.80 2.30 1 51 GLU -5.90 4.40 1 53 THR -2.30 0.20 1 54 ASN -1.00 -0.20 1 55 ASN 2.80 -0.10 1 56 THR 1.00 -0.10 1 57 ASP -2.00 0.60 1 58 VAL -3.90 4.20 1 59 TRP -2.10 4.20 1 60 VAL -7.20 3.00 1 61 ALA -5.70 4.00 1 62 ILE -3.10 1.50 1 63 ILE -3.30 2.10 1 64 SER -2.40 0.30 1 65 ILE -0.70 1.20 1 68 ASN 3.80 -1.80 1 69 VAL -3.20 2.70 1 70 ASN -0.10 0.00 1 71 SER 1.80 -1.00 1 72 GLU -3.80 2.30 1 73 SER 0.10 -0.70 1 74 ARG -4.40 3.90 1 75 GLN -3.20 1.60 1 76 TYR -5.00 3.60 1 77 SER -0.20 -1.50 1 78 LEU -2.80 0.40 1 79 PHE 5.10 -4.10 1 81 VAL -2.50 1.40 1 82 ASN 0.90 -0.20 1 83 LYS -4.90 2.20 1 84 GLN -0.90 0.00 1 85 ILE -4.20 3.50 1 86 THR 2.80 -1.30 1 87 VAL -5.70 2.30 1 88 VAL -3.00 1.40 1 89 ASN -0.30 0.00 1 90 THR 1.00 -1.80 1 91 SER -2.30 1.50 1 92 ASN 0.30 -0.10 1 93 LYS -2.80 2.10 1 95 LYS -5.00 3.90 1 96 PHE -1.30 -0.60 1 97 MET -3.30 3.50 1 98 GLU -0.60 0.20 1 99 MET -1.10 -2.40 1 100 PHE -7.60 7.40 1 101 ARG 0.10 -0.10 1 102 ASN -3.10 1.10 1 103 ASN -3.20 3.10 1 104 SER 2.60 -1.00 1 105 ASN -0.90 0.40 1 106 ALA -4.00 2.50 1 107 GLU -2.40 0.30 1 108 PHE 1.90 0.80 1 109 GLN -4.30 2.50 1 111 LYS -0.50 2.90 1 112 ARG -8.70 7.90 1 113 THR -1.30 2.00 1 114 LEU -4.50 3.10 1 115 THR 1.50 -0.90 1 116 SER -5.00 2.40 1 117 SER 0.20 0.30 1 118 THR 0.20 -0.10 1 119 LYS 8.50 -5.20 1 120 LEU -3.00 1.60 1 121 VAL -4.90 2.60 1 123 ILE -3.50 3.40 1 124 LEU -2.00 0.70 1 125 LYS -0.30 -0.80 1 126 HIS -0.90 3.50 1 129 ARG -7.00 5.20 1 130 LEU -6.30 3.60 1 131 TRP -2.60 1.30 1 132 THR -5.50 2.90 1 133 TYR -2.60 2.80 1 134 HIS -5.30 5.70 1 136 GLU -4.90 1.70 1 137 THR 3.50 -1.90 1 139 ASN -1.60 1.40 1 140 ALA 0.50 0.60 1 141 THR -4.00 1.90 1 142 THR -3.70 2.30 1 143 ASP -4.10 3.30 1 144 TYR -4.90 2.30 1 145 SER -1.70 0.80 1 146 THR -0.20 0.40 1 147 THR -0.50 -1.80 1 148 SER -0.70 0.40 1 149 ASN -1.80 0.20 1 151 ASN 4.90 -1.70 1 152 GLU -0.90 -0.30 1 153 ILE 3.80 -1.40 1 154 SER -2.00 0.80 1 155 VAL -5.20 3.00 1 156 THR -1.00 1.00 1 157 THR -3.60 0.50 1 158 TYR 1.30 -1.20 1 159 ALA -5.70 3.80 1 160 GLU -0.90 0.30 1 161 PHE -7.60 4.80 1 162 TYR -6.40 4.30 1 163 ILE -2.20 2.00 1 164 ILE -5.70 5.20 1 166 ARG 5.60 -1.80 1 167 SER 4.40 -2.30 1 168 GLN 0.40 -2.00 1 169 GLU 3.20 0.90 1 171 LYS 3.30 -2.50 1 173 THR 5.20 -1.30 1 174 GLU 3.90 -0.90 1 175 TYR 1.80 -2.90 1 176 ILE 4.90 -3.50 1 177 ASN 1.00 2.20 1 178 THR -1.40 2.00 1 180 LEU 1.30 -1.20 1 184 GLN -1.90 0.50 1 187 ARG 0.10 -0.10 1 188 ASN 0.20 1.50 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25441_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 -2.96 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _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 8.50 _LACS_plot.Line_2_terminator_val_y_2 1.20 _LACS_plot.Y_axis_chem_shift_offset 0.76 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 LYS 8.50 -3.50 0 21 VAL 0.80 -1.50 1 22 LEU -1.80 -2.20 1 23 ASP -1.80 -1.50 1 26 TYR -2.00 -1.20 1 27 GLN 1.40 -1.50 1 29 VAL -3.70 -2.80 1 30 THR 0.50 -0.60 1 31 PHE -2.00 -2.60 1 35 ASN 2.40 1.20 1 36 ASP 7.00 -2.20 1 37 TYR -2.00 -0.80 1 38 TRP 0.00 -0.80 1 39 ILE 0.60 -1.30 1 40 LEU -3.70 -2.50 1 41 ILE -1.20 -1.60 1 42 ASN -1.40 -1.80 1 43 SER 0.60 -2.40 1 46 ASN 2.10 0.10 1 48 VAL 3.70 0.00 1 49 VAL 0.80 -1.00 1 50 LEU -3.80 -3.30 1 51 GLU -5.90 -1.00 1 53 THR -2.30 -2.50 1 54 ASN -1.00 -0.30 1 55 ASN 2.80 -1.30 1 56 THR 1.00 -1.20 1 57 ASP -2.00 -0.80 1 58 VAL -3.90 -1.90 1 59 TRP -2.10 -3.30 1 60 VAL -7.20 -3.70 1 61 ALA -5.70 -2.40 1 62 ILE -3.10 -1.40 1 63 ILE -3.30 -2.20 1 64 SER -2.40 0.10 1 65 ILE -0.70 -3.80 1 68 ASN 3.80 -1.60 1 69 VAL -3.20 0.30 1 70 ASN -0.10 -1.30 1 71 SER 1.80 1.00 1 72 GLU -3.80 -2.60 1 73 SER 0.10 -0.10 1 74 ARG -4.40 -3.40 1 75 GLN -3.20 -1.10 1 76 TYR -5.00 -1.90 1 77 SER -0.20 -0.90 1 78 LEU -2.80 -1.50 1 79 PHE 5.10 0.90 1 81 VAL -2.50 -1.50 1 82 ASN 0.90 -0.10 1 83 LYS -4.90 -1.80 1 84 GLN -0.90 -0.20 1 85 ILE -4.20 -1.40 1 86 THR 2.80 -0.70 1 87 VAL -5.70 -4.00 1 88 VAL -3.00 -3.90 1 89 ASN -0.30 -0.30 1 90 THR 1.00 -0.40 1 91 SER -2.30 -2.70 1 92 ASN 0.30 0.30 1 93 LYS -2.80 -1.90 1 95 LYS -5.00 -3.30 1 96 PHE -1.30 1.70 1 97 MET -3.30 -2.70 1 98 GLU -0.60 -1.90 1 99 MET -1.10 0.20 1 100 PHE -7.60 -0.60 1 101 ARG 0.10 -3.40 1 102 ASN -3.10 -0.80 1 103 ASN -3.20 -0.90 1 104 SER 2.60 -0.90 1 105 ASN -0.90 -0.60 1 106 ALA -4.00 -1.00 1 107 GLU -2.40 0.20 1 108 PHE 1.90 0.20 1 109 GLN -4.30 -0.10 1 111 LYS -0.50 -1.00 1 112 ARG -8.70 -0.70 1 113 THR -1.30 -2.40 1 114 LEU -4.50 -3.10 1 115 THR 1.50 0.00 1 116 SER -5.00 1.00 1 117 SER 0.20 0.10 1 118 THR 0.20 0.10 1 120 LEU -3.00 -2.40 1 121 VAL -4.90 -2.20 1 123 ILE -3.50 -4.50 1 124 LEU -2.00 -2.50 1 125 LYS -0.30 -2.20 1 126 HIS -0.90 2.10 1 129 ARG -7.00 -4.90 1 130 LEU -6.30 -1.20 1 131 TRP -2.60 -1.50 1 132 THR -5.50 -1.30 1 133 TYR -2.60 0.30 1 134 HIS -5.30 -1.20 1 136 GLU -4.90 1.20 1 137 THR 3.50 0.60 1 139 ASN -1.60 -0.30 1 140 ALA 0.50 0.60 1 141 THR -4.00 -1.30 1 142 THR -3.70 0.70 1 143 ASP -4.10 -2.30 1 144 TYR -4.90 0.50 1 145 SER -1.70 -1.50 1 146 THR -0.20 -2.50 1 147 THR -0.50 -2.70 1 148 SER -0.70 -0.40 1 149 ASN -1.80 0.00 1 151 ASN 4.90 2.10 1 152 GLU -0.90 -0.60 1 153 ILE 3.80 -1.60 1 154 SER -2.00 -1.70 1 155 VAL -5.20 -2.50 1 156 THR -1.00 -0.10 1 157 THR -3.60 -1.60 1 158 TYR 1.30 -1.50 1 159 ALA -5.70 -3.10 1 160 GLU -0.90 -2.30 1 161 PHE -7.60 -3.60 1 162 TYR -6.40 -1.00 1 163 ILE -2.20 0.20 1 166 ARG 5.60 1.40 1 167 SER 4.40 1.10 1 168 GLN 0.40 0.20 1 169 GLU 3.20 -0.50 1 171 LYS 3.30 -0.60 1 173 THR 5.20 1.00 1 174 GLU 3.90 2.90 1 175 TYR 1.80 3.10 1 176 ILE 4.90 2.30 1 177 ASN 1.00 1.40 1 178 THR -1.40 0.00 1 180 LEU 1.30 -1.10 1 183 MET 6.70 -0.50 1 184 GLN -1.90 -1.70 1 187 ARG 0.10 -1.20 1 188 ASN 0.20 4.30 1 stop_ save_