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 bmr26569_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.07 _LACS_plot.Line_1_terminator_val_y_1 -3.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.61 _LACS_plot.Line_2_terminator_val_x_2 5.68 _LACS_plot.Line_2_terminator_val_y_2 2.88 _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 207 HIS -5.07 -0.02 0 24 LEU -2.84 1.28 0 178 LYS 3.94 3.66 0 155 VAL -8.07 -5.19 0 135 ILE 4.95 3.99 0 190 LEU -5.64 -0.09 0 10 ILE -3.89 -3.28 1 11 ALA -6.34 -3.28 1 12 LYS -1.28 -1.82 1 13 SER 1.74 0.81 1 15 THR -1.28 -0.21 1 16 SER -2.06 -1.78 1 17 VAL -3.29 -1.52 1 18 LYS -1.53 -1.02 1 19 ILE -1.87 -0.70 1 20 GLU -3.66 -1.24 1 22 ARG -4.91 -2.64 1 23 SER -2.48 -3.19 1 27 GLN -0.44 -1.23 1 28 ALA -1.95 -1.65 1 29 THR 1.16 0.34 1 30 THR -2.11 0.01 1 31 MET -3.58 -1.06 1 32 PHE -4.27 -2.39 1 33 TRP -2.94 -1.15 1 34 TYR -5.40 -1.72 1 35 ARG -2.88 -2.05 1 36 GLN -3.92 -1.50 1 37 PHE 3.68 1.32 1 39 LYS 5.68 1.50 1 40 GLN -3.64 -1.73 1 41 SER -1.08 -1.70 1 42 LEU 2.46 1.76 1 43 MET -1.76 -1.61 1 44 LEU 3.15 0.63 1 45 MET -0.91 0.71 1 46 ALA -4.07 -1.32 1 47 THR -0.82 0.03 1 48 SER -1.83 -1.56 1 49 ASN -4.11 -1.74 1 50 GLU 2.83 0.74 1 52 SER -2.83 -1.86 1 53 LYS 0.95 -0.20 1 54 ALA 0.60 -0.12 1 55 ALA -2.32 -2.33 1 56 TYR -0.46 0.60 1 57 GLU -2.47 -2.28 1 58 GLN 3.35 1.72 1 60 VAL 1.49 -0.26 1 61 GLU 0.95 -0.18 1 62 LYS 4.22 2.20 1 63 ASP 2.16 0.63 1 64 LYS -0.31 -0.62 1 65 PHE -1.47 -2.54 1 66 LEU 0.20 -0.45 1 67 ILE -2.14 -1.97 1 68 ASN -3.63 -1.15 1 70 ALA 1.09 1.03 1 71 SER -2.91 -1.89 1 72 LEU 1.88 1.04 1 73 THR -2.68 -2.18 1 74 LEU -2.83 -0.39 1 75 SER -3.96 -1.73 1 76 THR -4.04 -2.55 1 77 LEU -1.15 -2.34 1 78 THR -1.54 -1.51 1 79 VAL 0.55 -1.29 1 80 THR 0.08 -0.27 1 81 SER 0.52 -1.81 1 82 ALA 2.25 0.76 1 83 HIS -4.09 -0.75 1 85 GLU 4.20 1.73 1 86 ASP 1.12 0.95 1 87 SER 3.25 2.12 1 88 SER 1.09 0.37 1 89 PHE -4.08 -3.84 1 90 TYR -1.68 -0.20 1 91 ILE -4.30 -0.99 1 93 SER -4.74 -3.01 1 94 ALA -5.37 -1.92 1 95 ARG -2.88 -1.26 1 98 SER -1.30 -1.37 1 100 ASN 0.76 -1.32 1 101 SER -0.51 -0.02 1 104 HIS -2.99 -0.37 1 105 PHE -1.25 0.22 1 107 ASN 1.25 -0.02 1 109 THR -2.53 -0.36 1 110 ARG 1.51 -1.25 1 111 LEU -3.24 -1.56 1 112 THR -1.13 -1.14 1 113 VAL -1.77 -3.02 1 114 THR -4.00 -3.62 1 115 GLU 2.23 1.59 1 116 ASP -3.89 -0.91 1 117 LEU 4.71 1.71 1 118 LYS 4.57 1.30 1 119 ASN 1.17 0.28 1 120 VAL 2.89 0.83 1 121 PHE -4.95 -0.04 1 124 GLU -1.34 -1.20 1 125 VAL -2.45 -1.08 1 126 ALA -5.16 -2.03 1 127 VAL -3.68 -2.25 1 128 PHE -1.52 -1.23 1 129 GLU 0.32 -0.28 1 131 SER -2.72 -1.93 1 132 GLU 4.26 2.36 1 134 GLU 5.24 2.48 1 136 SER 3.03 2.16 1 137 HIS -1.87 0.45 1 138 THR 2.47 0.17 1 139 GLN -0.39 1.94 1 140 LYS -3.65 -1.16 1 141 ALA 0.35 2.18 1 146 LEU -4.95 -1.90 1 147 ALA -4.63 -3.95 1 148 THR -3.66 -1.91 1 150 PHE -4.73 -3.84 1 151 TYR -2.89 0.13 1 156 GLU -4.75 -1.53 1 157 LEU -2.47 -0.30 1 158 SER -3.87 -1.33 1 159 TRP -3.79 -1.21 1 160 TRP -2.26 -2.32 1 161 VAL -1.82 -2.07 1 162 ASN 3.52 1.05 1 164 LYS -3.38 -2.06 1 165 GLU 1.66 -0.38 1 166 VAL -2.79 -1.82 1 170 VAL -5.15 -3.08 1 175 GLN -2.50 -1.10 1 177 LEU -2.97 -1.63 1 179 GLU 2.59 1.84 1 180 GLN -1.23 -0.88 1 182 ALA 1.02 0.05 1 183 LEU -1.26 -1.51 1 184 ASN 3.33 2.13 1 185 ASP 1.22 -1.65 1 186 SER -0.31 -0.71 1 187 ARG 0.86 0.33 1 188 TYR -4.34 -0.07 1 189 ALA -6.99 -2.36 1 192 SER -3.76 -2.25 1 194 LEU -0.44 -2.48 1 195 ARG -6.64 -2.14 1 196 VAL -7.17 -4.60 1 197 SER 1.06 0.44 1 198 ALA 3.53 3.06 1 199 THR 4.03 2.58 1 200 PHE 3.05 3.34 1 201 TRP 2.51 1.19 1 202 GLN 1.04 -1.59 1 203 ASN -2.19 -2.31 1 205 ARG 1.39 -0.58 1 206 ASN 0.15 -0.75 1 208 PHE -3.44 -1.83 1 209 ARG -5.18 -1.79 1 211 GLN -3.93 -1.54 1 212 VAL -0.20 -1.56 1 213 GLN -0.19 -0.74 1 214 PHE -5.01 -3.10 1 215 TYR 2.05 -0.31 1 217 LEU 0.40 -0.62 1 218 SER -2.61 -1.36 1 220 ASN 0.76 -0.03 1 221 ASP 0.27 0.91 1 222 GLU -0.01 -0.24 1 223 TRP -3.33 -0.79 1 224 THR -3.07 -0.21 1 226 ASP 2.46 0.90 1 227 ARG -0.66 -1.01 1 228 ALA 0.84 -0.24 1 229 LYS -0.84 -0.83 1 231 VAL -1.99 -2.04 1 232 THR 2.28 1.71 1 233 GLN -3.95 -1.23 1 234 ILE -1.29 -1.24 1 235 VAL -1.39 -1.13 1 236 SER -4.77 -1.72 1 237 ALA -4.07 -0.99 1 238 GLU -6.29 -2.50 1 239 ALA -3.62 -0.72 1 240 TRP -2.84 -0.84 1 242 ARG -2.61 -1.28 1 243 ALA -0.81 -0.94 1 244 ASP 0.14 0.96 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26569_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.07 _LACS_plot.Line_1_terminator_val_y_1 5.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.39 _LACS_plot.Line_2_terminator_val_x_2 5.68 _LACS_plot.Line_2_terminator_val_y_2 -2.80 _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 207 HIS -5.07 5.05 0 24 LEU -2.84 4.12 0 178 LYS 3.94 -0.28 0 155 VAL -8.07 2.88 0 135 ILE 4.95 -0.96 0 190 LEU -5.64 5.55 0 10 ILE -3.89 0.61 1 11 ALA -6.34 3.06 1 12 LYS -1.28 -0.54 1 13 SER 1.74 -0.93 1 15 THR -1.28 1.07 1 16 SER -2.06 0.28 1 17 VAL -3.29 1.77 1 18 LYS -1.53 0.51 1 19 ILE -1.87 1.17 1 20 GLU -3.66 2.42 1 22 ARG -4.91 2.27 1 23 SER -2.48 -0.71 1 27 GLN -0.44 -0.79 1 28 ALA -1.95 0.30 1 29 THR 1.16 -0.82 1 30 THR -2.11 2.12 1 31 MET -3.58 2.52 1 32 PHE -4.27 1.88 1 33 TRP -2.94 1.79 1 34 TYR -5.40 3.68 1 35 ARG -2.88 0.83 1 36 GLN -3.92 2.42 1 37 PHE 3.68 -2.36 1 39 LYS 5.68 -4.18 1 40 GLN -3.64 1.91 1 41 SER -1.08 -0.62 1 42 LEU 2.46 -0.70 1 43 MET -1.76 0.15 1 44 LEU 3.15 -2.52 1 45 MET -0.91 1.62 1 46 ALA -4.07 2.75 1 47 THR -0.82 0.85 1 48 SER -1.83 0.27 1 49 ASN -4.11 2.37 1 50 GLU 2.83 -2.09 1 52 SER -2.83 0.97 1 53 LYS 0.95 -1.15 1 54 ALA 0.60 -0.72 1 55 ALA -2.32 -0.01 1 56 TYR -0.46 1.06 1 57 GLU -2.47 0.19 1 58 GLN 3.35 -1.63 1 60 VAL 1.49 -1.75 1 61 GLU 0.95 -1.13 1 62 LYS 4.22 -2.02 1 63 ASP 2.16 -1.53 1 64 LYS -0.31 -0.31 1 65 PHE -1.47 -1.07 1 66 LEU 0.20 -0.65 1 67 ILE -2.14 0.17 1 68 ASN -3.63 2.48 1 70 ALA 1.09 -0.06 1 71 SER -2.91 1.02 1 72 LEU 1.88 -0.84 1 73 THR -2.68 0.50 1 74 LEU -2.83 2.44 1 75 SER -3.96 2.23 1 76 THR -4.04 1.49 1 77 LEU -1.15 -1.19 1 78 THR -1.54 0.03 1 79 VAL 0.55 -1.84 1 80 THR 0.08 -0.35 1 81 SER 0.52 -2.33 1 82 ALA 2.25 -1.49 1 83 HIS -4.09 3.34 1 85 GLU 4.20 -2.47 1 86 ASP 1.12 -0.17 1 87 SER 3.25 -1.13 1 88 SER 1.09 -0.72 1 89 PHE -4.08 0.24 1 90 TYR -1.68 1.48 1 91 ILE -4.30 3.31 1 93 SER -4.74 1.73 1 94 ALA -5.37 3.45 1 95 ARG -2.88 1.62 1 98 SER -1.30 -0.07 1 100 ASN 0.76 -2.08 1 101 SER -0.51 0.49 1 104 HIS -2.99 2.62 1 105 PHE -1.25 1.47 1 107 ASN 1.25 -1.27 1 109 THR -2.53 2.17 1 110 ARG 1.51 -2.76 1 111 LEU -3.24 1.68 1 112 THR -1.13 -0.01 1 113 VAL -1.77 -1.25 1 114 THR -4.00 0.38 1 115 GLU 2.23 -0.64 1 116 ASP -3.89 2.98 1 117 LEU 4.71 -3.00 1 118 LYS 4.57 -3.27 1 119 ASN 1.17 -0.89 1 120 VAL 2.89 -2.06 1 121 PHE -4.95 4.91 1 124 GLU -1.34 0.14 1 125 VAL -2.45 1.37 1 126 ALA -5.16 3.13 1 127 VAL -3.68 1.43 1 128 PHE -1.52 0.29 1 129 GLU 0.32 -0.60 1 131 SER -2.72 0.79 1 132 GLU 4.26 -1.90 1 134 GLU 5.24 -2.76 1 136 SER 3.03 -0.87 1 137 HIS -1.87 2.32 1 138 THR 2.47 -2.30 1 139 GLN -0.39 2.33 1 140 LYS -3.65 2.49 1 141 ALA 0.35 1.83 1 146 LEU -4.95 3.05 1 147 ALA -4.63 0.68 1 148 THR -3.66 1.75 1 150 PHE -4.73 0.89 1 151 TYR -2.89 3.02 1 156 GLU -4.75 3.22 1 157 LEU -2.47 2.17 1 158 SER -3.87 2.54 1 159 TRP -3.79 2.58 1 160 TRP -2.26 -0.06 1 161 VAL -1.82 -0.25 1 162 ASN 3.52 -2.47 1 164 LYS -3.38 1.32 1 165 GLU 1.66 -2.04 1 166 VAL -2.79 0.97 1 170 VAL -5.15 2.07 1 175 GLN -2.50 1.40 1 177 LEU -2.97 1.34 1 179 GLU 2.59 -0.75 1 180 GLN -1.23 0.35 1 182 ALA 1.02 -0.97 1 183 LEU -1.26 -0.25 1 184 ASN 3.33 -1.20 1 185 ASP 1.22 -2.87 1 186 SER -0.31 -0.40 1 187 ARG 0.86 -0.53 1 188 TYR -4.34 4.27 1 189 ALA -6.99 4.63 1 192 SER -3.76 1.51 1 194 LEU -0.44 -2.04 1 195 ARG -6.64 4.50 1 196 VAL -7.17 2.57 1 197 SER 1.06 -0.62 1 198 ALA 3.53 -0.47 1 199 THR 4.03 -1.45 1 200 PHE 3.05 0.29 1 201 TRP 2.51 -1.32 1 202 GLN 1.04 -2.63 1 203 ASN -2.19 -0.12 1 205 ARG 1.39 -1.97 1 206 ASN 0.15 -0.90 1 208 PHE -3.44 1.61 1 209 ARG -5.18 3.39 1 211 GLN -3.93 2.39 1 212 VAL -0.20 -1.36 1 213 GLN -0.19 -0.55 1 214 PHE -5.01 1.91 1 215 TYR 2.05 -2.36 1 217 LEU 0.40 -1.02 1 218 SER -2.61 1.25 1 220 ASN 0.76 -0.79 1 221 ASP 0.27 0.64 1 222 GLU -0.01 -0.23 1 223 TRP -3.33 2.54 1 224 THR -3.07 2.86 1 226 ASP 2.46 -1.56 1 227 ARG -0.66 -0.35 1 228 ALA 0.84 -1.08 1 229 LYS -0.84 0.01 1 231 VAL -1.99 -0.05 1 232 THR 2.28 -0.57 1 233 GLN -3.95 2.72 1 234 ILE -1.29 0.05 1 235 VAL -1.39 0.26 1 236 SER -4.77 3.05 1 237 ALA -4.07 3.08 1 238 GLU -6.29 3.79 1 239 ALA -3.62 2.90 1 240 TRP -2.84 2.00 1 242 ARG -2.61 1.33 1 243 ALA -0.81 -0.13 1 244 ASP 0.14 0.82 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26569_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.07 _LACS_plot.Line_1_terminator_val_y_1 -2.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.46 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.29 _LACS_plot.Line_2_terminator_val_x_2 5.68 _LACS_plot.Line_2_terminator_val_y_2 0.36 _LACS_plot.Y_axis_chem_shift_offset 0.86 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 170 VAL -5.15 2.91 0 10 ILE -3.89 -2.56 1 11 ALA -6.34 -2.77 1 12 LYS -1.28 0.89 1 13 SER 1.74 0.63 1 15 THR -1.28 -2.19 1 16 SER -2.06 -0.12 1 17 VAL -3.29 -3.34 1 18 LYS -1.53 -1.53 1 19 ILE -1.87 -1.75 1 20 GLU -3.66 -1.61 1 22 ARG -4.91 -0.78 1 23 SER -2.48 0.32 1 27 GLN -0.44 -1.85 1 28 ALA -1.95 -1.35 1 29 THR 1.16 1.18 1 30 THR -2.11 -1.86 1 31 MET -3.58 -3.52 1 32 PHE -4.27 -1.24 1 33 TRP -2.94 -1.99 1 34 TYR -5.40 -0.82 1 35 ARG -2.88 -2.49 1 36 GLN -3.92 -1.04 1 39 LYS 5.68 -0.87 1 40 GLN -3.64 -0.33 1 41 SER -1.08 -0.22 1 42 LEU 2.46 -0.95 1 43 MET -1.76 -1.18 1 44 LEU 3.15 -1.83 1 45 MET -0.91 -0.20 1 46 ALA -4.07 -3.06 1 47 THR -0.82 -1.27 1 48 SER -1.83 -2.28 1 49 ASN -4.11 -1.41 1 50 GLU 2.83 0.78 1 52 SER -2.83 1.56 1 53 LYS 0.95 0.74 1 54 ALA 0.60 -2.14 1 55 ALA -2.32 -0.31 1 56 TYR -0.46 1.32 1 57 GLU -2.47 -0.26 1 58 GLN 3.35 1.40 1 60 VAL 1.49 -0.76 1 61 GLU 0.95 0.14 1 62 LYS 4.22 -0.64 1 63 ASP 2.16 -0.37 1 64 LYS -0.31 -1.90 1 65 PHE -1.47 -1.96 1 66 LEU 0.20 -0.78 1 67 ILE -2.14 -1.73 1 70 ALA 1.09 -0.57 1 71 SER -2.91 -1.24 1 73 THR -2.68 -0.78 1 74 LEU -2.83 -3.05 1 75 SER -3.96 -1.22 1 76 THR -4.04 -2.63 1 77 LEU -1.15 -3.06 1 78 THR -1.54 -0.92 1 79 VAL 0.55 -0.47 1 80 THR 0.08 -0.99 1 81 SER 0.52 -0.45 1 82 ALA 2.25 -1.28 1 85 GLU 4.20 0.44 1 86 ASP 1.12 1.33 1 87 SER 3.25 -0.91 1 88 SER 1.09 -3.44 1 90 TYR -1.68 0.51 1 91 ILE -4.30 -3.44 1 93 SER -4.74 0.17 1 94 ALA -5.37 -2.91 1 95 ARG -2.88 -0.37 1 98 SER -1.30 -1.87 1 100 ASN 0.76 -0.43 1 104 HIS -2.99 0.56 1 105 PHE -1.25 1.87 1 107 ASN 1.25 0.83 1 109 THR -2.53 -0.77 1 110 ARG 1.51 -3.89 1 111 LEU -3.24 -1.25 1 113 VAL -1.77 0.47 1 114 THR -4.00 -2.18 1 115 GLU 2.23 -0.61 1 116 ASP -3.89 -0.15 1 117 LEU 4.71 -0.41 1 118 LYS 4.57 -0.83 1 119 ASN 1.17 -0.98 1 120 VAL 2.89 -0.50 1 124 GLU -1.34 -0.71 1 125 VAL -2.45 -3.02 1 126 ALA -5.16 -3.40 1 127 VAL -3.68 -1.96 1 128 PHE -1.52 -1.07 1 131 SER -2.72 2.22 1 134 GLU 5.24 -0.87 1 135 ILE 4.95 3.29 1 136 SER 3.03 -0.75 1 138 THR 2.47 -0.37 1 140 LYS -3.65 -1.48 1 141 ALA 0.35 -3.32 1 146 LEU -4.95 -3.32 1 147 ALA -4.63 -1.62 1 148 THR -3.66 0.64 1 150 PHE -4.73 -0.62 1 155 VAL -8.07 -1.35 1 156 GLU -4.75 -1.76 1 157 LEU -2.47 -1.80 1 158 SER -3.87 -2.89 1 159 TRP -3.79 -0.63 1 160 TRP -2.26 0.60 1 161 VAL -1.82 0.27 1 162 ASN 3.52 0.81 1 164 LYS -3.38 -2.42 1 165 GLU 1.66 0.14 1 177 LEU -2.97 -3.11 1 178 LYS 3.94 -2.46 1 179 GLU 2.59 1.55 1 182 ALA 1.02 -0.09 1 184 ASN 3.33 0.43 1 185 ASP 1.22 -2.67 1 186 SER -0.31 -0.19 1 187 ARG 0.86 -0.31 1 188 TYR -4.34 -3.47 1 189 ALA -6.99 -1.66 1 190 LEU -5.64 -5.02 1 194 LEU -0.44 -4.87 1 195 ARG -6.64 -1.90 1 196 VAL -7.17 -0.83 1 197 SER 1.06 -2.52 1 198 ALA 3.53 0.91 1 199 THR 4.03 0.93 1 201 TRP 2.51 -1.65 1 202 GLN 1.04 -0.79 1 205 ARG 1.39 0.56 1 206 ASN 0.15 -3.19 1 207 HIS -5.07 -0.99 1 208 PHE -3.44 -2.25 1 209 ARG -5.18 -2.70 1 211 GLN -3.93 -2.48 1 212 VAL -0.20 -1.86 1 213 GLN -0.19 -3.38 1 214 PHE -5.01 -2.39 1 215 TYR 2.05 0.81 1 217 LEU 0.40 -1.46 1 220 ASN 0.76 0.46 1 221 ASP 0.27 -0.27 1 222 GLU -0.01 -1.09 1 224 THR -3.07 0.85 1 226 ASP 2.46 0.41 1 227 ARG -0.66 -1.39 1 228 ALA 0.84 -0.49 1 231 VAL -1.99 -0.80 1 232 THR 2.28 -0.25 1 233 GLN -3.95 -3.94 1 234 ILE -1.29 -0.52 1 235 VAL -1.39 -1.86 1 236 SER -4.77 -1.87 1 237 ALA -4.07 -2.79 1 238 GLU -6.29 -2.56 1 239 ALA -3.62 -5.65 1 240 TRP -2.84 -0.31 1 242 ARG -2.61 -1.64 1 243 ALA -0.81 -1.36 1 stop_ save_