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 bmr26532_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.97 _LACS_plot.Line_1_terminator_val_y_1 -3.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.79 _LACS_plot.Line_2_terminator_val_x_2 7.66 _LACS_plot.Line_2_terminator_val_y_2 4.89 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 164 LYS -1.17 -3.70 0 70 LYS 6.36 0.62 0 139 ARG 5.70 0.04 0 215 MET -6.97 -1.58 0 10 ALA 3.40 2.37 1 11 LEU 4.35 1.86 1 12 LEU 4.18 1.69 1 13 LEU 5.98 3.14 1 14 GLN 4.61 2.57 1 16 LEU 3.49 2.41 1 17 ILE 5.62 4.12 1 18 LEU 4.16 2.31 1 19 ALA 3.33 2.16 1 20 MET 1.54 1.53 1 21 GLN 4.99 2.47 1 22 SER 4.35 2.96 1 23 GLU -1.34 -1.15 1 25 TYR -1.65 -2.50 1 26 VAL 1.46 0.00 1 28 ASP -3.29 -1.66 1 30 VAL -5.74 -3.61 1 31 SER -2.31 -0.56 1 32 THR -5.07 -3.51 1 33 ALA 3.69 1.77 1 34 HIS 4.03 4.51 1 35 GLU 2.10 1.95 1 36 ALA 3.93 2.62 1 37 ALA 4.35 2.63 1 38 LEU 4.26 2.19 1 39 SER 7.66 5.52 1 40 LEU 3.26 1.96 1 41 ALA 1.58 0.48 1 42 SER -0.54 0.26 1 43 ASN -4.63 -1.34 1 44 HIS -1.21 0.02 1 45 TYR -1.05 -0.12 1 46 SER 1.64 1.28 1 47 LEU -0.85 -0.01 1 48 ILE -3.78 -2.07 1 49 VAL -0.10 -1.33 1 50 LEU -6.06 -1.71 1 51 ASP -3.78 -2.28 1 52 LEU 1.43 0.57 1 54 LEU -1.25 -1.51 1 56 ASP 0.77 -0.81 1 57 GLU -4.02 -1.78 1 58 ASP -1.43 0.41 1 60 LEU 4.98 2.10 1 61 HIS 3.70 3.56 1 62 PHE 4.75 3.03 1 63 LEU 3.96 1.99 1 64 SER 3.99 2.64 1 65 ARG 5.72 3.14 1 66 MET 4.02 2.51 1 67 ARG 3.57 0.92 1 68 ARG 4.90 2.66 1 69 GLU 1.09 -1.04 1 71 MET 3.21 0.47 1 72 THR 1.06 -0.25 1 73 GLN 5.35 2.41 1 75 VAL -5.19 -2.55 1 76 LEU -3.10 -2.22 1 77 ILE 1.38 -0.57 1 78 LEU -3.77 -2.49 1 79 THR -2.41 -2.97 1 80 ALA 0.66 -0.10 1 81 ARG 6.03 1.74 1 82 ASP -1.53 -0.85 1 83 THR -1.54 -0.25 1 84 LEU 4.93 2.91 1 85 GLU 5.49 3.15 1 86 ASP 3.99 3.44 1 87 ARG 3.84 2.01 1 88 ILE 5.66 3.65 1 89 SER 4.27 2.81 1 91 LEU 5.02 2.61 1 92 ASP 4.92 2.86 1 93 THR 4.70 3.05 1 95 ALA -0.09 -0.44 1 96 ASP -1.80 1.06 1 97 ASP -3.74 -1.90 1 98 TYR -3.68 -0.91 1 99 LEU -4.84 -2.12 1 100 VAL -2.27 -2.86 1 101 LYS -1.93 -0.88 1 103 PHE -5.91 -4.01 1 104 ALA -2.61 -2.82 1 105 LEU 4.70 2.71 1 106 GLU 4.29 2.64 1 107 GLU 4.42 2.43 1 108 LEU 6.81 3.59 1 109 ASN 5.02 2.57 1 110 ALA 2.77 2.28 1 111 ARG 6.74 3.75 1 112 ILE 7.18 4.77 1 113 ARG 4.96 4.29 1 114 ALA 4.15 2.55 1 115 LEU 1.45 -0.54 1 116 LEU 1.12 -0.96 1 125 ASN 0.42 -0.19 1 126 GLU -4.19 -1.95 1 127 ILE -2.94 -1.32 1 128 SER -2.79 -1.58 1 129 VAL -1.18 -1.26 1 131 ASN 1.38 -0.60 1 132 LEU -2.42 -1.44 1 133 ARG -3.93 -1.39 1 134 LEU -3.93 -1.64 1 135 ASN -1.63 -1.21 1 136 VAL 3.37 1.87 1 137 THR 5.20 3.76 1 138 ARG -0.10 -0.84 1 140 LEU -5.98 -2.43 1 141 VAL -3.32 -2.62 1 142 TRP -3.69 -0.88 1 143 LEU -2.29 -1.98 1 145 GLU 0.45 -0.66 1 146 THR -0.17 -0.04 1 147 ALA 1.34 -0.58 1 148 LEU -1.57 -1.71 1 149 ASP -0.25 -1.36 1 150 LEU -2.84 -2.43 1 151 THR 1.20 -1.68 1 153 LYS 4.57 3.06 1 154 GLU 2.51 2.50 1 155 TYR 5.66 3.92 1 156 ALA 4.23 2.45 1 157 LEU 2.21 1.72 1 158 LEU 4.05 1.79 1 159 SER 4.84 3.11 1 160 ARG 5.15 1.88 1 161 LEU 4.02 2.34 1 162 MET 4.36 3.74 1 163 MET 4.09 2.58 1 165 ALA 2.36 1.74 1 167 SER -2.11 -0.95 1 169 VAL -0.31 -1.09 1 170 HIS 1.18 3.09 1 171 ARG 5.52 3.62 1 172 GLU 4.25 2.67 1 173 ILE 3.95 1.71 1 174 LEU 3.84 1.59 1 175 TYR 4.09 2.69 1 176 ASN 3.69 2.53 1 177 ASP 3.14 2.31 1 178 ILE 0.60 -0.26 1 179 TYR 1.16 0.24 1 183 ASN 1.92 0.90 1 184 GLU 3.67 4.33 1 186 ALA 5.33 4.16 1 188 ASN 1.37 1.40 1 193 HIS 3.79 4.20 1 194 ILE 5.67 0.42 1 195 HIS 4.88 5.22 1 196 ASN 4.44 2.19 1 197 LEU 3.04 2.51 1 198 ARG 4.22 3.27 1 199 GLU 3.15 1.70 1 200 LYS 2.05 2.39 1 201 ILE -0.04 -0.30 1 203 LYS 5.03 3.39 1 204 SER -0.88 0.26 1 205 ARG 1.96 0.61 1 206 ILE -1.27 -1.96 1 207 ARG -2.57 -2.63 1 208 THR 2.45 1.14 1 209 VAL 1.64 -1.53 1 212 PHE -1.09 1.97 1 214 TYR -5.42 -0.87 1 216 LEU -2.39 -1.88 1 217 ALA -1.49 -1.16 1 218 ASN -0.90 -1.17 1 219 ASN -0.37 -0.56 1 220 ASP 0.74 -0.09 1 221 ASP -0.29 0.04 1 222 THR 0.69 0.24 1 223 GLU -0.36 0.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26532_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.97 _LACS_plot.Line_1_terminator_val_y_1 3.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 7.66 _LACS_plot.Line_2_terminator_val_y_2 -2.77 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 164 LYS -1.17 -2.53 0 70 LYS 6.36 -5.74 0 139 ARG 5.70 -5.66 0 215 MET -6.97 5.39 0 10 ALA 3.40 -1.03 1 11 LEU 4.35 -2.49 1 12 LEU 4.18 -2.49 1 13 LEU 5.98 -2.84 1 14 GLN 4.61 -2.04 1 16 LEU 3.49 -1.08 1 17 ILE 5.62 -1.50 1 18 LEU 4.16 -1.85 1 19 ALA 3.33 -1.17 1 20 MET 1.54 -0.01 1 21 GLN 4.99 -2.52 1 22 SER 4.35 -1.39 1 23 GLU -1.34 0.19 1 25 TYR -1.65 -0.85 1 26 VAL 1.46 -1.46 1 28 ASP -3.29 1.63 1 30 VAL -5.74 2.13 1 31 SER -2.31 1.75 1 32 THR -5.07 1.56 1 33 ALA 3.69 -1.92 1 34 HIS 4.03 0.48 1 35 GLU 2.10 -0.15 1 36 ALA 3.93 -1.31 1 37 ALA 4.35 -1.72 1 38 LEU 4.26 -2.07 1 39 SER 7.66 -2.14 1 40 LEU 3.26 -1.30 1 41 ALA 1.58 -1.10 1 42 SER -0.54 0.80 1 43 ASN -4.63 3.29 1 44 HIS -1.21 1.23 1 45 TYR -1.05 0.93 1 46 SER 1.64 -0.36 1 47 LEU -0.85 0.84 1 48 ILE -3.78 1.71 1 49 VAL -0.10 -1.23 1 50 LEU -6.06 4.35 1 51 ASP -3.78 1.50 1 52 LEU 1.43 -0.86 1 54 LEU -1.25 -0.26 1 56 ASP 0.77 -1.58 1 57 GLU -4.02 2.24 1 58 ASP -1.43 1.84 1 60 LEU 4.98 -2.88 1 61 HIS 3.70 -0.14 1 62 PHE 4.75 -1.72 1 63 LEU 3.96 -1.97 1 64 SER 3.99 -1.35 1 65 ARG 5.72 -2.58 1 66 MET 4.02 -1.51 1 67 ARG 3.57 -2.65 1 68 ARG 4.90 -2.24 1 69 GLU 1.09 -2.13 1 71 MET 3.21 -2.74 1 72 THR 1.06 -1.31 1 73 GLN 5.35 -2.94 1 75 VAL -5.19 2.64 1 76 LEU -3.10 0.88 1 77 ILE 1.38 -1.95 1 78 LEU -3.77 1.28 1 79 THR -2.41 -0.56 1 80 ALA 0.66 -0.76 1 81 ARG 6.03 -4.29 1 82 ASP -1.53 0.68 1 83 THR -1.54 1.29 1 84 LEU 4.93 -2.02 1 85 GLU 5.49 -2.34 1 86 ASP 3.99 -0.55 1 87 ARG 3.84 -1.83 1 88 ILE 5.66 -2.01 1 89 SER 4.27 -1.46 1 91 LEU 5.02 -2.41 1 92 ASP 4.92 -2.06 1 93 THR 4.70 -1.65 1 95 ALA -0.09 -0.35 1 96 ASP -1.80 2.86 1 97 ASP -3.74 1.84 1 98 TYR -3.68 2.77 1 99 LEU -4.84 2.72 1 100 VAL -2.27 -0.59 1 101 LYS -1.93 1.05 1 103 PHE -5.91 1.90 1 104 ALA -2.61 -0.21 1 105 LEU 4.70 -1.99 1 106 GLU 4.29 -1.65 1 107 GLU 4.42 -1.99 1 108 LEU 6.81 -3.22 1 109 ASN 5.02 -2.45 1 110 ALA 2.77 -0.49 1 111 ARG 6.74 -2.99 1 112 ILE 7.18 -2.41 1 113 ARG 4.96 -0.67 1 114 ALA 4.15 -1.60 1 115 LEU 1.45 -1.99 1 116 LEU 1.12 -2.08 1 125 ASN 0.42 -0.61 1 126 GLU -4.19 2.24 1 127 ILE -2.94 1.62 1 128 SER -2.79 1.21 1 129 VAL -1.18 -0.08 1 131 ASN 1.38 -1.98 1 132 LEU -2.42 0.98 1 133 ARG -3.93 2.54 1 134 LEU -3.93 2.29 1 135 ASN -1.63 0.42 1 136 VAL 3.37 -1.50 1 137 THR 5.20 -1.44 1 138 ARG -0.10 -0.74 1 140 LEU -5.98 3.55 1 141 VAL -3.32 0.70 1 142 TRP -3.69 2.81 1 143 LEU -2.29 0.31 1 145 GLU 0.45 -1.11 1 146 THR -0.17 0.13 1 147 ALA 1.34 -1.92 1 148 LEU -1.57 -0.14 1 149 ASP -0.25 -1.11 1 150 LEU -2.84 0.41 1 151 THR 1.20 -2.88 1 153 LYS 4.57 -1.51 1 154 GLU 2.51 -0.01 1 155 TYR 5.66 -1.74 1 156 ALA 4.23 -1.78 1 157 LEU 2.21 -0.49 1 158 LEU 4.05 -2.26 1 159 SER 4.84 -1.73 1 160 ARG 5.15 -3.27 1 161 LEU 4.02 -1.68 1 162 MET 4.36 -0.62 1 163 MET 4.09 -1.51 1 165 ALA 2.36 -0.62 1 167 SER -2.11 1.16 1 169 VAL -0.31 -0.78 1 170 HIS 1.18 1.91 1 171 ARG 5.52 -1.90 1 172 GLU 4.25 -1.58 1 173 ILE 3.95 -2.24 1 174 LEU 3.84 -2.25 1 175 TYR 4.09 -1.40 1 176 ASN 3.69 -1.16 1 177 ASP 3.14 -0.83 1 178 ILE 0.60 -0.86 1 179 TYR 1.16 -0.92 1 183 ASN 1.92 -1.02 1 184 GLU 3.67 0.66 1 186 ALA 5.33 -1.17 1 188 ASN 1.37 0.03 1 193 HIS 3.79 0.41 1 194 ILE 5.67 -5.25 1 195 HIS 4.88 0.34 1 196 ASN 4.44 -2.25 1 197 LEU 3.04 -0.53 1 198 ARG 4.22 -0.95 1 199 GLU 3.15 -1.45 1 200 LYS 2.05 0.34 1 201 ILE -0.04 -0.26 1 203 LYS 5.03 -1.64 1 204 SER -0.88 1.14 1 205 ARG 1.96 -1.35 1 206 ILE -1.27 -0.69 1 207 ARG -2.57 -0.06 1 208 THR 2.45 -1.31 1 209 VAL 1.64 -3.17 1 212 PHE -1.09 3.06 1 214 TYR -5.42 4.55 1 216 LEU -2.39 0.51 1 217 ALA -1.49 0.33 1 218 ASN -0.90 -0.27 1 219 ASN -0.37 -0.19 1 220 ASP 0.74 -0.83 1 221 ASP -0.29 0.33 1 222 THR 0.69 -0.45 1 223 GLU -0.36 1.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26532_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.97 _LACS_plot.Line_1_terminator_val_y_1 -3.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 7.66 _LACS_plot.Line_2_terminator_val_y_2 3.14 _LACS_plot.Y_axis_chem_shift_offset 0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 203 LYS 5.03 -2.04 0 70 LYS 6.36 -1.25 0 139 ARG 5.70 -2.01 0 10 ALA 3.40 2.48 1 11 LEU 4.35 2.65 1 12 LEU 4.18 1.14 1 13 LEU 5.98 0.12 1 14 GLN 4.61 2.84 1 16 LEU 3.49 1.08 1 17 ILE 5.62 2.24 1 18 LEU 4.16 2.86 1 19 ALA 3.33 3.12 1 20 MET 1.54 3.44 1 21 GLN 4.99 5.65 1 22 SER 4.35 1.01 1 23 GLU -1.34 -0.84 1 25 TYR -1.65 0.30 1 26 VAL 1.46 -0.84 1 28 ASP -3.29 -2.06 1 30 VAL -5.74 -1.98 1 31 SER -2.31 -2.12 1 32 THR -5.07 -0.82 1 33 ALA 3.69 2.90 1 34 HIS 4.03 4.20 1 35 GLU 2.10 3.28 1 36 ALA 3.93 0.69 1 37 ALA 4.35 3.23 1 38 LEU 4.26 3.08 1 39 SER 7.66 2.52 1 40 LEU 3.26 -0.15 1 41 ALA 1.58 1.08 1 42 SER -0.54 -1.47 1 44 HIS -1.21 0.36 1 45 TYR -1.05 -0.49 1 46 SER 1.64 -2.10 1 47 LEU -0.85 -4.65 1 48 ILE -3.78 -2.62 1 49 VAL -0.10 -2.98 1 50 LEU -6.06 -3.91 1 51 ASP -3.78 -1.46 1 52 LEU 1.43 0.78 1 56 ASP 0.77 -0.86 1 57 GLU -4.02 -3.76 1 58 ASP -1.43 2.87 1 60 LEU 4.98 2.20 1 61 HIS 3.70 4.45 1 62 PHE 4.75 0.71 1 63 LEU 3.96 -0.02 1 64 SER 3.99 2.84 1 65 ARG 5.72 2.41 1 66 MET 4.02 2.95 1 67 ARG 3.57 4.70 1 68 ARG 4.90 1.56 1 69 GLU 1.09 -1.53 1 72 THR 1.06 0.47 1 75 VAL -5.19 -2.10 1 76 LEU -3.10 -2.65 1 77 ILE 1.38 -3.56 1 78 LEU -3.77 -3.02 1 79 THR -2.41 -2.98 1 80 ALA 0.66 0.18 1 81 ARG 6.03 -0.30 1 82 ASP -1.53 1.00 1 83 THR -1.54 -0.11 1 84 LEU 4.93 0.16 1 85 GLU 5.49 2.84 1 86 ASP 3.99 1.45 1 87 ARG 3.84 1.39 1 88 ILE 5.66 1.20 1 89 SER 4.27 3.97 1 91 LEU 5.02 2.95 1 92 ASP 4.92 2.33 1 93 THR 4.70 -0.72 1 95 ALA -0.09 -4.14 1 96 ASP -1.80 -1.64 1 97 ASP -3.74 -2.49 1 98 TYR -3.68 -2.66 1 99 LEU -4.84 -4.07 1 100 VAL -2.27 -0.83 1 103 PHE -5.91 -2.47 1 105 LEU 4.70 0.26 1 106 GLU 4.29 3.83 1 107 GLU 4.42 1.00 1 108 LEU 6.81 0.35 1 109 ASN 5.02 3.32 1 110 ALA 2.77 2.12 1 111 ARG 6.74 2.36 1 112 ILE 7.18 1.34 1 113 ARG 4.96 3.38 1 114 ALA 4.15 2.08 1 115 LEU 1.45 -1.66 1 125 ASN 0.42 -1.20 1 126 GLU -4.19 -0.88 1 127 ILE -2.94 -1.84 1 128 SER -2.79 -0.64 1 131 ASN 1.38 -0.44 1 132 LEU -2.42 -1.97 1 133 ARG -3.93 -3.00 1 134 LEU -3.93 -2.90 1 135 ASN -1.63 0.30 1 136 VAL 3.37 1.53 1 137 THR 5.20 1.33 1 138 ARG -0.10 -1.57 1 140 LEU -5.98 -3.08 1 141 VAL -3.32 -2.32 1 142 TRP -3.69 -1.34 1 143 LEU -2.29 -0.11 1 145 GLU 0.45 -0.34 1 146 THR -0.17 -1.52 1 147 ALA 1.34 -0.39 1 148 LEU -1.57 -1.54 1 149 ASP -0.25 -1.72 1 150 LEU -2.84 0.34 1 153 LYS 4.57 1.53 1 154 GLU 2.51 1.90 1 155 TYR 5.66 1.67 1 156 ALA 4.23 2.21 1 157 LEU 2.21 0.15 1 158 LEU 4.05 0.90 1 159 SER 4.84 1.20 1 160 ARG 5.15 2.35 1 161 LEU 4.02 2.40 1 162 MET 4.36 1.73 1 163 MET 4.09 0.42 1 164 LYS -1.17 -1.44 1 165 ALA 2.36 1.12 1 169 VAL -0.31 -1.27 1 170 HIS 1.18 3.02 1 171 ARG 5.52 0.42 1 172 GLU 4.25 2.80 1 173 ILE 3.95 1.67 1 174 LEU 3.84 1.06 1 175 TYR 4.09 2.07 1 176 ASN 3.69 1.92 1 177 ASP 3.14 1.41 1 178 ILE 0.60 -0.96 1 179 TYR 1.16 1.91 1 183 ASN 1.92 -0.45 1 193 HIS 3.79 4.44 1 194 ILE 5.67 1.29 1 195 HIS 4.88 3.62 1 196 ASN 4.44 3.60 1 197 LEU 3.04 1.32 1 198 ARG 4.22 2.50 1 199 GLU 3.15 1.63 1 200 LYS 2.05 1.77 1 201 ILE -0.04 -1.47 1 204 SER -0.88 0.41 1 205 ARG 1.96 -0.10 1 206 ILE -1.27 -0.82 1 207 ARG -2.57 0.16 1 208 THR 2.45 -1.06 1 212 PHE -1.09 -1.24 1 214 TYR -5.42 -3.11 1 215 MET -6.97 -3.00 1 216 LEU -2.39 -2.80 1 217 ALA -1.49 -1.48 1 218 ASN -0.90 -1.07 1 219 ASN -0.37 -0.87 1 220 ASP 0.74 -0.12 1 221 ASP -0.29 -0.28 1 222 THR 0.69 -0.76 1 223 GLU -0.36 0.93 1 stop_ save_