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 bmr27529_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.08 _LACS_plot.Line_1_terminator_val_y_1 -4.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.30 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 5.42 _LACS_plot.Y_axis_chem_shift_offset 0.75 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 ILE 7.75 -1.32 0 10 ARG -3.55 -2.59 1 11 SER -0.48 -1.30 1 12 PHE -2.17 -0.59 1 13 LYS 0.87 -0.31 1 17 LEU -4.11 -3.12 1 18 ASN -2.07 -2.24 1 19 SER 3.83 2.29 1 20 GLN 1.01 -0.68 1 21 PHE 5.83 1.89 1 22 ARG -1.80 -2.02 1 23 GLU -3.10 -1.10 1 24 GLU -4.46 -1.91 1 25 GLU 0.21 -0.03 1 27 THR 0.81 0.11 1 28 LEU -4.72 -3.13 1 29 TYR -2.55 -3.22 1 31 ASP -0.32 0.54 1 32 LYS 3.71 2.03 1 33 HIS 1.42 0.32 1 36 VAL 7.61 5.15 1 37 ARG 5.04 3.74 1 38 ASP 3.98 3.20 1 41 GLU 3.75 2.16 1 42 GLU 3.16 1.49 1 44 LYS 4.46 3.09 1 45 LYS 2.15 0.98 1 46 ALA -1.37 0.08 1 47 VAL -4.18 -3.40 1 48 GLU -1.22 -1.71 1 49 LEU 0.81 -0.65 1 51 GLU 1.12 0.45 1 52 LYS 1.93 -0.59 1 54 SER 1.96 2.09 1 56 LYS -2.76 -1.97 1 63 VAL -3.18 -1.15 1 64 SER 2.73 0.00 1 65 TYR 5.92 1.30 1 66 LYS -2.85 -2.24 1 67 ILE 1.85 0.54 1 68 ILE -0.32 -1.21 1 70 VAL -0.56 -1.34 1 71 HIS 0.22 1.26 1 72 GLN -0.52 -0.82 1 73 GLU 3.67 2.98 1 74 ASP 0.52 -0.78 1 75 GLU 0.13 -0.21 1 76 LEU 1.28 -0.16 1 77 LEU 4.45 1.60 1 78 GLU 1.88 0.99 1 80 LEU 1.13 -1.26 1 95 LEU 4.07 2.92 1 96 ASP 2.25 0.74 1 97 GLN 0.38 -1.24 1 98 VAL 3.73 2.41 1 99 ASP -0.65 -1.14 1 100 ILE 0.28 -0.98 1 101 ASP -0.61 -1.31 1 102 LYS 3.68 1.77 1 103 GLU 0.89 0.76 1 104 ASN -2.58 -0.23 1 105 GLU -6.80 -2.69 1 106 MET -5.17 -1.23 1 107 LEU -0.64 -2.43 1 109 THR -0.65 -1.27 1 112 HIS -1.23 -0.94 1 113 PHE -2.74 -2.04 1 115 LYS 8.19 5.86 1 116 GLU -4.09 -3.14 1 117 VAL 3.36 1.31 1 120 THR -2.65 -1.92 1 121 PHE -2.08 -2.22 1 123 ILE -9.08 -2.94 1 130 HIS -4.80 -1.72 1 131 GLN 3.46 1.61 1 133 GLU -1.27 -1.72 1 134 HIS 2.49 3.51 1 135 PHE 6.26 5.02 1 137 GLU 2.90 1.30 1 143 GLN 6.50 3.50 1 144 SER 3.38 1.91 1 145 LEU 2.75 1.78 1 146 LEU 0.26 -0.64 1 147 ASP 2.20 -0.05 1 148 ILE -2.11 -2.00 1 149 GLN 1.23 0.14 1 150 GLU 5.38 3.73 1 151 LYS 4.30 1.89 1 152 GLU 1.82 1.12 1 153 PHE 2.96 1.40 1 154 GLU 2.14 0.99 1 155 LYS 0.37 -0.94 1 156 PHE 1.38 -0.08 1 157 LYS -3.68 -1.91 1 158 PHE -4.23 -1.36 1 163 MET 4.08 0.88 1 165 ARG -1.95 -1.50 1 166 HIS -5.40 -0.96 1 167 GLN -3.80 -2.37 1 168 TYR 3.24 2.13 1 169 ILE -1.84 -1.13 1 170 ASN 1.43 -0.93 1 171 GLU 4.00 2.62 1 172 ASP 0.73 1.18 1 173 GLU -3.60 -0.74 1 174 TYR 2.42 1.70 1 175 GLU -4.20 -3.68 1 176 VAL 4.92 2.66 1 177 ASN -2.55 -2.74 1 178 LEU 6.58 3.03 1 179 LYS 4.13 1.92 1 180 ASP 3.43 1.75 1 182 GLU -2.57 -2.75 1 187 ASN -0.01 -0.47 1 194 TRP -5.45 -4.10 1 195 LEU -2.47 -1.72 1 198 ASP -3.47 -3.37 1 199 HIS -0.51 -1.03 1 200 PHE 0.21 -0.24 1 201 ASN 1.24 -1.68 1 202 LYS 0.40 -0.70 1 203 ALA -0.57 -2.32 1 206 ARG -3.23 -2.32 1 207 SER -0.77 -1.12 1 210 THR 0.41 -0.18 1 211 TYR 0.92 -0.16 1 212 LEU 0.50 -0.44 1 214 LYS 0.59 -0.37 1 215 ALA 0.30 -0.49 1 216 ILE 0.49 -0.54 1 217 LYS 0.28 -0.71 1 218 ILE 0.44 -0.58 1 219 HIS -0.69 0.23 1 220 ASN 0.65 1.38 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27529_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.08 _LACS_plot.Line_1_terminator_val_y_1 4.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.30 _LACS_plot.Line_2_terminator_val_x_2 8.19 _LACS_plot.Line_2_terminator_val_y_2 -2.77 _LACS_plot.Y_axis_chem_shift_offset 0.75 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 ILE 7.75 -9.07 0 10 ARG -3.55 0.96 1 11 SER -0.48 -0.82 1 12 PHE -2.17 1.58 1 13 LYS 0.87 -1.18 1 17 LEU -4.11 0.99 1 18 ASN -2.07 -0.17 1 19 SER 3.83 -1.54 1 20 GLN 1.01 -1.69 1 21 PHE 5.83 -3.94 1 22 ARG -1.80 -0.22 1 23 GLU -3.10 2.00 1 24 GLU -4.46 2.55 1 25 GLU 0.21 -0.24 1 27 THR 0.81 -0.70 1 28 LEU -4.72 1.59 1 29 TYR -2.55 -0.67 1 31 ASP -0.32 0.86 1 32 LYS 3.71 -1.68 1 33 HIS 1.42 -1.10 1 36 VAL 7.61 -2.46 1 37 ARG 5.04 -1.30 1 38 ASP 3.98 -0.78 1 41 GLU 3.75 -1.59 1 42 GLU 3.16 -1.67 1 44 LYS 4.46 -1.37 1 45 LYS 2.15 -1.17 1 46 ALA -1.37 1.45 1 47 VAL -4.18 0.78 1 48 GLU -1.22 -0.49 1 49 LEU 0.81 -1.46 1 51 GLU 1.12 -0.67 1 52 LYS 1.93 -2.52 1 54 SER 1.96 0.13 1 56 LYS -2.76 0.79 1 63 VAL -3.18 2.03 1 64 SER 2.73 -2.73 1 65 TYR 5.92 -4.62 1 66 LYS -2.85 0.61 1 67 ILE 1.85 -1.31 1 68 ILE -0.32 -0.89 1 70 VAL -0.56 -0.78 1 71 HIS 0.22 1.04 1 72 GLN -0.52 -0.30 1 73 GLU 3.67 -0.69 1 74 ASP 0.52 -1.30 1 75 GLU 0.13 -0.34 1 76 LEU 1.28 -1.44 1 77 LEU 4.45 -2.85 1 78 GLU 1.88 -0.89 1 80 LEU 1.13 -2.39 1 95 LEU 4.07 -1.15 1 96 ASP 2.25 -1.51 1 97 GLN 0.38 -1.62 1 98 VAL 3.73 -1.32 1 99 ASP -0.65 -0.49 1 100 ILE 0.28 -1.26 1 101 ASP -0.61 -0.70 1 102 LYS 3.68 -1.91 1 103 GLU 0.89 -0.13 1 104 ASN -2.58 2.35 1 105 GLU -6.80 4.11 1 106 MET -5.17 3.94 1 107 LEU -0.64 -1.79 1 109 THR -0.65 -0.62 1 112 HIS -1.23 0.29 1 113 PHE -2.74 0.70 1 115 LYS 8.19 -2.33 1 116 GLU -4.09 0.95 1 117 VAL 3.36 -2.05 1 120 THR -2.65 0.73 1 121 PHE -2.08 -0.14 1 123 ILE -9.08 6.14 1 130 HIS -4.80 3.08 1 131 GLN 3.46 -1.85 1 133 GLU -1.27 -0.45 1 134 HIS 2.49 1.02 1 135 PHE 6.26 -1.24 1 137 GLU 2.90 -1.60 1 143 GLN 6.50 -3.00 1 144 SER 3.38 -1.47 1 145 LEU 2.75 -0.97 1 146 LEU 0.26 -0.90 1 147 ASP 2.20 -2.25 1 148 ILE -2.11 0.11 1 149 GLN 1.23 -1.09 1 150 GLU 5.38 -1.65 1 151 LYS 4.30 -2.41 1 152 GLU 1.82 -0.70 1 153 PHE 2.96 -1.56 1 154 GLU 2.14 -1.15 1 155 LYS 0.37 -1.31 1 156 PHE 1.38 -1.46 1 157 LYS -3.68 1.77 1 158 PHE -4.23 2.87 1 163 MET 4.08 -3.20 1 165 ARG -1.95 0.45 1 166 HIS -5.40 4.44 1 167 GLN -3.80 1.43 1 168 TYR 3.24 -1.11 1 169 ILE -1.84 0.71 1 170 ASN 1.43 -2.36 1 171 GLU 4.00 -1.38 1 172 ASP 0.73 0.45 1 173 GLU -3.60 2.86 1 174 TYR 2.42 -0.72 1 175 GLU -4.20 0.52 1 176 VAL 4.92 -2.26 1 177 ASN -2.55 -0.19 1 178 LEU 6.58 -3.55 1 179 LYS 4.13 -2.21 1 180 ASP 3.43 -1.68 1 182 GLU -2.57 -0.18 1 187 ASN -0.01 -0.46 1 194 TRP -5.45 1.35 1 195 LEU -2.47 0.75 1 198 ASP -3.47 0.10 1 199 HIS -0.51 -0.52 1 200 PHE 0.21 -0.45 1 201 ASN 1.24 -2.92 1 202 LYS 0.40 -1.10 1 203 ALA -0.57 -1.75 1 206 ARG -3.23 0.91 1 207 SER -0.77 -0.35 1 210 THR 0.41 -0.59 1 211 TYR 0.92 -1.08 1 212 LEU 0.50 -0.94 1 214 LYS 0.59 -0.96 1 215 ALA 0.30 -0.79 1 216 ILE 0.49 -1.03 1 217 LYS 0.28 -0.99 1 218 ILE 0.44 -1.02 1 219 HIS -0.69 0.92 1 220 ASN 0.65 0.73 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27529_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.08 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 7.74 _LACS_plot.Line_2_terminator_val_y_2 1.83 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 TYR 5.92 -3.53 0 26 ILE 7.75 -2.83 0 10 ARG -3.55 -2.38 1 11 SER -0.48 -0.12 1 12 PHE -2.17 -2.15 1 13 LYS 0.87 -0.77 1 17 LEU -4.11 -4.28 1 18 ASN -2.07 2.24 1 19 SER 3.83 0.53 1 20 GLN 1.01 -1.22 1 21 PHE 5.83 -2.28 1 22 ARG -1.80 -0.37 1 23 GLU -3.10 -0.04 1 24 GLU -4.46 -1.82 1 27 THR 0.81 -2.23 1 28 LEU -4.72 -3.01 1 29 TYR -2.55 -2.28 1 31 ASP -0.32 1.72 1 32 LYS 3.71 0.96 1 33 HIS 1.42 0.84 1 36 VAL 7.61 1.40 1 37 ARG 5.04 1.06 1 38 ASP 3.98 2.74 1 41 GLU 3.75 3.23 1 42 GLU 3.16 2.44 1 44 LYS 4.46 0.45 1 46 ALA -1.37 -0.27 1 47 VAL -4.18 -1.94 1 48 GLU -1.22 -0.44 1 49 LEU 0.81 0.39 1 51 GLU 1.12 0.47 1 52 LYS 1.93 -1.16 1 54 SER 1.96 1.67 1 56 LYS -2.76 -1.95 1 63 VAL -3.18 -0.29 1 64 SER 2.73 -0.07 1 66 LYS -2.85 -1.33 1 67 ILE 1.85 -0.05 1 68 ILE -0.32 0.22 1 70 VAL -0.56 0.47 1 71 HIS 0.22 0.08 1 72 GLN -0.52 1.48 1 73 GLU 3.67 -0.38 1 74 ASP 0.52 0.10 1 76 LEU 1.28 0.87 1 77 LEU 4.45 2.39 1 78 GLU 1.88 0.32 1 80 LEU 1.13 -0.88 1 95 LEU 4.07 1.01 1 96 ASP 2.25 -0.87 1 97 GLN 0.38 -1.09 1 98 VAL 3.73 -0.69 1 99 ASP -0.65 -1.60 1 100 ILE 0.28 -0.89 1 101 ASP -0.61 0.40 1 102 LYS 3.68 0.98 1 103 GLU 0.89 0.77 1 104 ASN -2.58 -2.18 1 105 GLU -6.80 -2.64 1 106 MET -5.17 -2.99 1 107 LEU -0.64 -1.52 1 109 THR -0.65 -1.79 1 113 PHE -2.74 -4.69 1 116 GLU -4.09 1.27 1 117 VAL 3.36 -0.64 1 120 THR -2.65 0.15 1 121 PHE -2.08 -2.23 1 123 ILE -9.08 -2.08 1 130 HIS -4.80 -0.42 1 131 GLN 3.46 1.19 1 133 GLU -1.27 -1.60 1 137 GLU 2.90 2.98 1 143 GLN 6.50 2.31 1 144 SER 3.38 1.46 1 145 LEU 2.75 -0.03 1 146 LEU 0.26 -1.01 1 147 ASP 2.20 -1.70 1 148 ILE -2.11 -0.27 1 149 GLN 1.23 1.66 1 150 GLU 5.38 1.41 1 151 LYS 4.30 2.05 1 152 GLU 1.82 2.57 1 153 PHE 2.96 2.13 1 154 GLU 2.14 -0.15 1 155 LYS 0.37 0.61 1 156 PHE 1.38 -0.67 1 157 LYS -3.68 -2.28 1 158 PHE -4.23 -1.50 1 163 MET 4.08 -0.16 1 165 ARG -1.95 -2.87 1 166 HIS -5.40 -0.91 1 167 GLN -3.80 -0.68 1 168 TYR 3.24 0.47 1 169 ILE -1.84 -0.88 1 170 ASN 1.43 -0.17 1 171 GLU 4.00 -1.03 1 172 ASP 0.73 1.07 1 174 TYR 2.42 -2.59 1 175 GLU -4.20 -2.03 1 176 VAL 4.92 -0.08 1 177 ASN -2.55 1.58 1 178 LEU 6.58 1.68 1 179 LYS 4.13 2.21 1 180 ASP 3.43 -0.91 1 182 GLU -2.57 -2.75 1 187 ASN -0.01 0.58 1 194 TRP -5.45 -3.01 1 195 LEU -2.47 -3.48 1 198 ASP -3.47 1.37 1 199 HIS -0.51 -2.82 1 200 PHE 0.21 -0.73 1 201 ASN 1.24 -1.49 1 202 LYS 0.40 -1.08 1 203 ALA -0.57 -2.97 1 206 ARG -3.23 -2.02 1 207 SER -0.77 -0.20 1 210 THR 0.41 -0.65 1 211 TYR 0.92 -0.44 1 212 LEU 0.50 -0.64 1 214 LYS 0.59 -0.40 1 215 ALA 0.30 -0.30 1 216 ILE 0.49 -0.39 1 217 LYS 0.28 -0.60 1 218 ILE 0.44 -0.67 1 219 HIS -0.69 -0.25 1 220 ASN 0.65 4.34 1 stop_ save_