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 bmr18324_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 -2.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.05 _LACS_plot.Line_2_terminator_val_x_2 6.85 _LACS_plot.Line_2_terminator_val_y_2 4.53 _LACS_plot.Y_axis_chem_shift_offset 0.51 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 HIS 3.66 4.91 0 12 LYS -0.55 -0.82 1 13 THR -0.47 -0.91 1 15 ILE 4.29 2.84 1 16 SER 4.36 2.88 1 17 LEU 3.39 2.37 1 18 LEU 4.53 2.01 1 19 GLN 5.52 3.21 1 20 GLU 1.16 -0.30 1 21 TYR 4.90 3.48 1 23 THR 5.93 4.46 1 24 ARG 4.88 2.89 1 25 ILE 0.76 -0.21 1 27 LYS -4.14 -2.76 1 28 THR 0.04 0.10 1 30 VAL -2.24 -1.28 1 31 TYR -2.02 -1.01 1 32 ASP -4.58 -1.32 1 33 LEU 2.26 -0.26 1 34 LEU 0.84 -0.17 1 35 LYS -1.14 -0.36 1 36 ALA -1.93 -1.17 1 37 GLU -2.61 -1.69 1 39 GLN 0.61 -0.26 1 41 HIS 1.42 1.31 1 42 GLN -0.45 -0.82 1 44 ASN -2.12 -0.19 1 45 PHE -2.57 -0.82 1 46 THR -0.46 -0.36 1 47 PHE -5.09 -1.30 1 48 ARG -4.24 -2.18 1 49 VAL -5.74 -4.30 1 50 THR -0.85 -0.27 1 51 VAL -1.38 -2.30 1 53 ASP 0.86 0.12 1 54 THR 1.03 1.07 1 55 SER -2.92 -1.92 1 57 THR -4.87 -2.74 1 59 GLN -5.32 -2.32 1 62 SER -5.05 -2.93 1 63 LYS 6.85 4.68 1 64 LYS 4.83 3.15 1 65 ALA 3.08 1.84 1 66 ALA 2.35 2.41 1 67 LYS 5.81 4.11 1 69 LYS 3.91 0.73 1 70 ALA 6.27 3.56 1 71 ALA 4.65 2.37 1 72 GLU 3.26 2.79 1 73 VAL 6.08 4.10 1 74 ALA 4.17 2.48 1 75 LEU 4.12 2.63 1 76 LYS 4.39 2.66 1 77 HIS 3.06 3.40 1 78 LEU 2.33 1.28 1 79 LYS 2.39 0.70 1 82 SER 0.55 0.02 1 83 MET 0.98 -0.02 1 84 LEU 0.78 -0.23 1 85 GLU 1.65 1.64 1 87 ALA 0.03 -0.59 1 88 LEU 0.95 -0.22 1 89 GLU -0.11 -1.62 1 90 ASP 0.27 -0.31 1 91 SER 0.90 0.10 1 92 SER 0.91 0.31 1 93 SER 0.18 -0.24 1 94 PHE 0.35 -0.32 1 97 LEU 0.75 -0.22 1 98 ASP 0.38 -0.31 1 99 SER 0.13 -0.35 1 100 SER 0.37 -0.13 1 101 LEU 1.08 -0.23 1 103 GLU 0.01 -0.31 1 104 ASP 0.10 -0.31 1 105 ILE 0.56 -0.33 1 107 VAL 0.64 -0.32 1 108 PHE 0.38 -0.33 1 109 THR -0.47 -0.82 1 110 ALA 0.28 -0.43 1 111 ALA -0.02 -0.64 1 112 ALA -0.11 -0.76 1 113 ALA 0.19 -0.54 1 114 ALA 0.02 -0.65 1 115 THR -0.01 -0.41 1 117 VAL 0.97 -0.22 1 119 SER -0.01 -0.40 1 120 VAL 0.71 -0.31 1 121 VAL 0.72 -0.30 1 122 LEU 0.73 -0.29 1 123 THR 0.04 -0.40 1 124 ARG 0.10 -0.59 1 125 SER -0.05 -0.48 1 127 ALA 0.72 -0.14 1 128 MET 0.36 -0.19 1 129 GLU -0.16 -0.68 1 130 LEU 0.74 -0.25 1 131 GLN -0.01 0.08 1 134 VAL 0.19 -0.78 1 135 SER -0.08 -0.52 1 137 GLN 1.16 0.16 1 138 GLN 1.08 0.16 1 139 SER 1.15 0.26 1 140 GLU 0.10 -0.50 1 142 ASN -0.12 -0.94 1 144 VAL 5.67 3.69 1 146 ALA 3.07 1.87 1 147 LEU 4.77 2.31 1 148 GLN 6.21 4.19 1 149 GLU 3.28 2.25 1 150 LEU 3.29 2.32 1 151 VAL 6.43 3.69 1 152 VAL 5.93 3.52 1 153 GLN 4.76 2.70 1 154 LYS 1.88 -0.36 1 156 TRP -5.92 -4.60 1 157 ARG 1.05 -0.06 1 158 LEU 3.16 0.77 1 160 GLU -4.50 -2.52 1 161 TYR -2.07 -1.46 1 162 THR -2.43 -0.99 1 163 VAL 1.72 0.22 1 164 THR 0.98 0.10 1 165 GLN -1.29 0.17 1 166 GLU -2.18 -1.67 1 167 SER -1.57 -0.93 1 170 ALA 2.90 1.38 1 171 HIS 0.60 0.51 1 172 ARG 0.91 -0.55 1 173 LYS -0.10 -0.83 1 174 GLU -2.73 -1.25 1 175 PHE -2.23 -0.45 1 176 THR -0.93 -0.47 1 177 MET -5.59 -2.02 1 178 THR -1.02 -0.94 1 180 ARG -3.58 -2.11 1 181 VAL -3.41 -1.32 1 182 GLU 5.29 1.27 1 183 ARG 1.93 -0.58 1 184 PHE -2.13 -1.40 1 185 ILE -2.77 -1.20 1 186 GLU -6.70 -2.72 1 187 ILE -2.32 -1.25 1 189 SER -4.22 -1.99 1 191 THR 2.02 0.60 1 192 SER -5.05 -2.92 1 193 LYS 6.42 4.16 1 194 LYS 4.80 3.16 1 195 LEU 3.32 1.80 1 196 ALA 4.51 2.84 1 197 LYS 4.93 3.70 1 198 ARG 4.87 3.39 1 199 ASN 3.40 2.81 1 200 ALA 4.07 2.40 1 201 ALA 3.31 2.01 1 202 ALA 4.06 2.43 1 203 LYS 4.02 2.84 1 204 MET 4.50 0.47 1 205 LEU 3.78 2.76 1 206 LEU 3.45 1.79 1 207 ARG 3.34 0.88 1 208 VAL 3.17 1.19 1 209 HIS 1.65 1.88 1 210 THR 0.49 0.08 1 211 VAL 2.44 1.45 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18324_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 3.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.05 _LACS_plot.Line_2_terminator_val_x_2 6.85 _LACS_plot.Line_2_terminator_val_y_2 -2.32 _LACS_plot.Y_axis_chem_shift_offset 0.51 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 HIS 3.66 1.25 0 12 LYS -0.55 -0.27 1 13 THR -0.47 -0.44 1 15 ILE 4.29 -1.45 1 16 SER 4.36 -1.48 1 17 LEU 3.39 -1.02 1 18 LEU 4.53 -2.52 1 19 GLN 5.52 -2.31 1 20 GLU 1.16 -1.46 1 21 TYR 4.90 -1.42 1 23 THR 5.93 -1.47 1 24 ARG 4.88 -1.99 1 25 ILE 0.76 -0.97 1 27 LYS -4.14 1.38 1 28 THR 0.04 0.06 1 30 VAL -2.24 0.96 1 31 TYR -2.02 1.01 1 32 ASP -4.58 3.26 1 33 LEU 2.26 -2.52 1 34 LEU 0.84 -1.01 1 35 LYS -1.14 0.78 1 36 ALA -1.93 0.76 1 37 GLU -2.61 0.92 1 39 GLN 0.61 -0.87 1 41 HIS 1.42 -0.11 1 42 GLN -0.45 -0.37 1 44 ASN -2.12 1.93 1 45 PHE -2.57 1.75 1 46 THR -0.46 0.10 1 47 PHE -5.09 3.79 1 48 ARG -4.24 2.06 1 49 VAL -5.74 1.44 1 50 THR -0.85 0.58 1 51 VAL -1.38 -0.92 1 53 ASP 0.86 -0.74 1 54 THR 1.03 0.04 1 55 SER -2.92 1.00 1 57 THR -4.87 2.13 1 59 GLN -5.32 3.00 1 62 SER -5.05 2.12 1 63 LYS 6.85 -2.17 1 64 LYS 4.83 -1.68 1 65 ALA 3.08 -1.24 1 66 ALA 2.35 0.06 1 67 LYS 5.81 -1.70 1 69 LYS 3.91 -3.18 1 70 ALA 6.27 -2.71 1 71 ALA 4.65 -2.28 1 72 GLU 3.26 -0.47 1 73 VAL 6.08 -1.98 1 74 ALA 4.17 -1.69 1 75 LEU 4.12 -1.49 1 76 LYS 4.39 -1.73 1 77 HIS 3.06 0.34 1 78 LEU 2.33 -1.05 1 79 LYS 2.39 -1.69 1 82 SER 0.55 -0.53 1 83 MET 0.98 -1.00 1 84 LEU 0.78 -1.01 1 85 GLU 1.65 -0.01 1 87 ALA 0.03 -0.62 1 88 LEU 0.95 -1.17 1 89 GLU -0.11 -1.51 1 90 ASP 0.27 -0.58 1 91 SER 0.90 -0.80 1 92 SER 0.91 -0.60 1 93 SER 0.18 -0.42 1 94 PHE 0.35 -0.67 1 97 LEU 0.75 -0.97 1 98 ASP 0.38 -0.69 1 99 SER 0.13 -0.48 1 100 SER 0.37 -0.50 1 101 LEU 1.08 -1.31 1 103 GLU 0.01 -0.32 1 104 ASP 0.10 -0.41 1 105 ILE 0.56 -0.89 1 107 VAL 0.64 -0.96 1 108 PHE 0.38 -0.71 1 109 THR -0.47 -0.35 1 110 ALA 0.28 -0.71 1 111 ALA -0.02 -0.62 1 112 ALA -0.11 -0.65 1 113 ALA 0.19 -0.73 1 114 ALA 0.02 -0.67 1 115 THR -0.01 -0.40 1 117 VAL 0.97 -1.19 1 119 SER -0.01 -0.39 1 120 VAL 0.71 -1.02 1 121 VAL 0.72 -1.02 1 122 LEU 0.73 -1.02 1 123 THR 0.04 -0.44 1 124 ARG 0.10 -0.69 1 125 SER -0.05 -0.43 1 127 ALA 0.72 -0.86 1 128 MET 0.36 -0.55 1 129 GLU -0.16 -0.52 1 130 LEU 0.74 -0.99 1 131 GLN -0.01 0.09 1 134 VAL 0.19 -0.97 1 135 SER -0.08 -0.44 1 137 GLN 1.16 -1.00 1 138 GLN 1.08 -0.92 1 139 SER 1.15 -0.89 1 140 GLU 0.10 -0.60 1 142 ASN -0.12 -0.82 1 144 VAL 5.67 -1.98 1 146 ALA 3.07 -1.20 1 147 LEU 4.77 -2.46 1 148 GLN 6.21 -2.02 1 149 GLU 3.28 -1.03 1 150 LEU 3.29 -0.97 1 151 VAL 6.43 -2.74 1 152 VAL 5.93 -2.41 1 153 GLN 4.76 -2.06 1 154 LYS 1.88 -2.24 1 156 TRP -5.92 1.32 1 157 ARG 1.05 -1.11 1 158 LEU 3.16 -2.39 1 160 GLU -4.50 1.98 1 161 TYR -2.07 0.61 1 162 THR -2.43 1.44 1 163 VAL 1.72 -1.50 1 164 THR 0.98 -0.88 1 165 GLN -1.29 1.46 1 166 GLU -2.18 0.51 1 167 SER -1.57 0.64 1 170 ALA 2.90 -1.52 1 171 HIS 0.60 -0.09 1 172 ARG 0.91 -1.46 1 173 LYS -0.10 -0.73 1 174 GLU -2.73 1.48 1 175 PHE -2.23 1.78 1 176 THR -0.93 0.46 1 177 MET -5.59 3.57 1 178 THR -1.02 0.08 1 180 ARG -3.58 1.47 1 181 VAL -3.41 2.09 1 182 GLU 5.29 -4.02 1 183 ARG 1.93 -2.51 1 184 PHE -2.13 0.73 1 185 ILE -2.77 1.57 1 186 GLU -6.70 3.98 1 187 ILE -2.32 1.07 1 189 SER -4.22 2.23 1 191 THR 2.02 -1.42 1 192 SER -5.05 2.13 1 193 LYS 6.42 -2.26 1 194 LYS 4.80 -1.64 1 195 LEU 3.32 -1.52 1 196 ALA 4.51 -1.67 1 197 LYS 4.93 -1.23 1 198 ARG 4.87 -1.48 1 199 ASN 3.40 -0.59 1 200 ALA 4.07 -1.67 1 201 ALA 3.31 -1.30 1 202 ALA 4.06 -1.63 1 203 LYS 4.02 -1.18 1 204 MET 4.50 -4.03 1 205 LEU 3.78 -1.02 1 206 LEU 3.45 -1.66 1 207 ARG 3.34 -2.46 1 208 VAL 3.17 -1.98 1 209 HIS 1.65 0.23 1 210 THR 0.49 -0.41 1 211 VAL 2.44 -0.99 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18324_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 -2.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.78 _LACS_plot.Line_2_terminator_val_x_2 6.85 _LACS_plot.Line_2_terminator_val_y_2 2.17 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 VAL -5.74 -3.78 0 182 GLU 5.29 -0.70 0 59 GLN -5.32 0.12 0 152 VAL 5.93 4.46 0 12 LYS -0.55 -0.44 1 15 ILE 4.29 2.93 1 16 SER 4.36 2.78 1 17 LEU 3.39 2.52 1 18 LEU 4.53 0.65 1 19 GLN 5.52 2.71 1 20 GLU 1.16 2.51 1 21 TYR 4.90 1.51 1 23 THR 5.93 2.37 1 24 ARG 4.88 2.04 1 25 ILE 0.76 -0.21 1 27 LYS -4.14 -0.01 1 30 VAL -2.24 -0.96 1 31 TYR -2.02 -0.51 1 32 ASP -4.58 -2.78 1 33 LEU 2.26 -1.68 1 34 LEU 0.84 -0.53 1 35 LYS -1.14 -2.23 1 36 ALA -1.93 -1.60 1 37 GLU -2.61 -0.10 1 39 GLN 0.61 0.18 1 41 HIS 1.42 0.61 1 44 ASN -2.12 -1.97 1 45 PHE -2.57 -1.21 1 46 THR -0.46 -0.98 1 47 PHE -5.09 -1.48 1 48 ARG -4.24 -1.40 1 50 THR -0.85 -0.74 1 51 VAL -1.38 -0.68 1 53 ASP 0.86 -0.53 1 54 THR 1.03 -2.07 1 55 SER -2.92 -0.59 1 57 THR -4.87 -0.81 1 62 SER -5.05 -0.75 1 63 LYS 6.85 1.06 1 64 LYS 4.83 1.51 1 65 ALA 3.08 2.91 1 66 ALA 2.35 0.29 1 67 LYS 5.81 1.35 1 68 HIS 3.66 3.34 1 69 LYS 3.91 -0.35 1 70 ALA 6.27 0.66 1 71 ALA 4.65 1.30 1 72 GLU 3.26 2.79 1 73 VAL 6.08 2.86 1 74 ALA 4.17 1.88 1 75 LEU 4.12 0.00 1 76 LYS 4.39 2.54 1 77 HIS 3.06 3.24 1 78 LEU 2.33 0.64 1 79 LYS 2.39 1.13 1 82 SER 0.55 0.03 1 83 MET 0.98 -0.41 1 84 LEU 0.78 -0.30 1 87 ALA 0.03 0.08 1 88 LEU 0.95 -0.33 1 89 GLU -0.11 0.78 1 90 ASP 0.27 0.19 1 91 SER 0.90 0.45 1 92 SER 0.91 0.09 1 93 SER 0.18 -0.73 1 94 PHE 0.35 -1.26 1 97 LEU 0.75 -0.27 1 99 SER 0.13 -0.13 1 100 SER 0.37 -0.59 1 103 GLU 0.01 -0.47 1 104 ASP 0.10 -0.71 1 107 VAL 0.64 -0.29 1 108 PHE 0.38 -0.13 1 109 THR -0.47 -0.96 1 110 ALA 0.28 -0.17 1 111 ALA -0.02 -0.29 1 112 ALA -0.11 -0.39 1 113 ALA 0.19 -0.47 1 114 ALA 0.02 -0.22 1 119 SER -0.01 -0.01 1 120 VAL 0.71 -0.43 1 121 VAL 0.72 -0.26 1 122 LEU 0.73 -0.24 1 123 THR 0.04 -0.68 1 124 ARG 0.10 -0.40 1 127 ALA 0.72 0.10 1 128 MET 0.36 -0.31 1 129 GLU -0.16 0.42 1 130 LEU 0.74 -0.58 1 134 VAL 0.19 -0.17 1 137 GLN 1.16 0.29 1 138 GLN 1.08 0.18 1 139 SER 1.15 -0.09 1 140 GLU 0.10 -0.23 1 144 VAL 5.67 3.49 1 146 ALA 3.07 3.10 1 147 LEU 4.77 -0.20 1 148 GLN 6.21 0.82 1 149 GLU 3.28 2.21 1 150 LEU 3.29 1.17 1 151 VAL 6.43 1.83 1 153 GLN 4.76 2.34 1 154 LYS 1.88 -0.04 1 156 TRP -5.92 -0.84 1 157 ARG 1.05 -0.42 1 160 GLU -4.50 -0.96 1 161 TYR -2.07 0.32 1 162 THR -2.43 -1.36 1 163 VAL 1.72 -0.31 1 164 THR 0.98 0.02 1 165 GLN -1.29 -2.27 1 166 GLU -2.18 -1.37 1 167 SER -1.57 -0.85 1 170 ALA 2.90 0.22 1 171 HIS 0.60 0.78 1 172 ARG 0.91 -1.93 1 173 LYS -0.10 -0.36 1 174 GLU -2.73 -1.50 1 175 PHE -2.23 -0.32 1 176 THR -0.93 -1.18 1 177 MET -5.59 -1.71 1 178 THR -1.02 -1.10 1 180 ARG -3.58 -0.28 1 181 VAL -3.41 0.08 1 183 ARG 1.93 -0.47 1 184 PHE -2.13 -0.45 1 185 ILE -2.77 -1.24 1 186 GLU -6.70 -2.07 1 187 ILE -2.32 -0.67 1 189 SER -4.22 -0.51 1 191 THR 2.02 -1.46 1 192 SER -5.05 -0.62 1 193 LYS 6.42 1.07 1 194 LYS 4.80 2.64 1 195 LEU 3.32 1.28 1 196 ALA 4.51 0.83 1 197 LYS 4.93 2.47 1 198 ARG 4.87 1.45 1 199 ASN 3.40 2.52 1 200 ALA 4.07 1.15 1 201 ALA 3.31 1.86 1 202 ALA 4.06 3.40 1 203 LYS 4.02 3.53 1 204 MET 4.50 1.42 1 205 LEU 3.78 0.76 1 206 LEU 3.45 1.80 1 207 ARG 3.34 2.58 1 208 VAL 3.17 0.37 1 209 HIS 1.65 1.12 1 210 THR 0.49 -0.94 1 stop_ save_