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 bmr34121_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 -1.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.44 _LACS_plot.Line_2_terminator_val_y_2 5.67 _LACS_plot.Y_axis_chem_shift_offset -1.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 ILE 1.53 -1.26 0 10 LEU 2.23 2.47 1 11 ASN 3.29 4.07 1 12 ASN 0.61 2.14 1 13 TYR -1.70 1.39 1 14 LYS -0.16 1.91 1 15 LYS 0.17 1.77 1 17 TYR 2.17 3.15 1 19 TYR -0.52 2.43 1 22 TYR 0.41 1.32 1 24 LEU 0.50 1.57 1 26 ILE -0.54 0.96 1 27 ASN 1.98 2.67 1 30 MET -2.76 -0.52 1 31 HIS -0.13 1.21 1 32 TYR 3.57 3.94 1 34 VAL -5.70 -1.97 1 35 ASP -4.20 -0.94 1 36 PHE -4.08 0.41 1 37 PHE 2.93 3.93 1 38 MET -1.10 1.40 1 39 ASN 0.29 1.15 1 40 ILE 3.87 4.18 1 42 THR 3.42 4.65 1 44 VAL -1.17 0.60 1 45 LYS -2.38 -1.14 1 46 ALA 1.95 1.51 1 47 ILE 1.93 3.02 1 48 SER -3.53 0.07 1 49 SER -1.28 0.30 1 51 LYS -4.67 -0.23 1 53 VAL -1.51 -0.09 1 54 GLU -4.34 0.43 1 55 ALA 1.34 0.87 1 57 TRP 0.36 1.87 1 58 SER -3.01 -1.72 1 59 ASN 0.98 2.17 1 60 TYR 0.85 1.49 1 64 ASN 2.56 2.97 1 65 GLN -6.65 -0.93 1 66 ILE -6.57 -0.72 1 68 LEU -7.29 0.18 1 69 ILE -0.52 1.73 1 70 GLU -0.17 2.15 1 71 ASN 3.31 3.71 1 72 ASP 1.64 1.60 1 74 VAL -0.95 3.16 1 75 HIS 5.07 5.87 1 76 ARG -5.60 -1.04 1 77 GLN -5.91 -0.71 1 78 TRP -8.34 -1.54 1 79 TYR -2.75 0.20 1 80 MET -3.32 1.53 1 81 HIS 5.93 3.74 1 82 LEU 1.56 2.00 1 83 SER -0.28 2.25 1 84 LYS -4.79 1.23 1 85 TYR -3.26 1.17 1 86 ASN -4.37 -0.11 1 87 VAL -8.26 -2.39 1 88 LYS -5.08 -0.97 1 89 VAL 5.71 5.32 1 91 ASP 1.06 2.63 1 92 TYR -1.00 1.32 1 93 VAL -6.11 -2.61 1 94 LYS -4.80 -1.66 1 95 ALA 2.57 2.52 1 97 GLN -0.31 1.90 1 98 ILE 3.12 2.83 1 99 ILE 0.51 1.54 1 101 TRP -3.18 1.99 1 102 SER 1.21 3.32 1 104 SER -3.92 -1.31 1 105 THR -2.09 1.11 1 107 TYR 1.01 -0.04 1 109 THR 1.16 2.03 1 110 ALA -2.00 1.38 1 112 HIS 0.03 2.34 1 113 LEU -3.80 0.42 1 114 HIS -5.48 1.70 1 115 PHE -4.11 -0.13 1 116 GLN -6.40 -0.70 1 117 ARG -3.90 0.61 1 118 MET -6.35 -0.12 1 119 VAL -2.45 -0.11 1 120 ASN 6.45 6.87 1 121 SER -2.57 -0.09 1 122 PHE 2.44 1.33 1 123 SER -2.28 -0.29 1 124 ASN 5.85 3.97 1 125 SER 3.52 4.16 1 126 THR 0.42 0.03 1 127 ALA -1.27 1.31 1 128 GLN -6.45 -1.97 1 129 ASP -0.10 0.87 1 131 MET 2.94 3.73 1 133 PHE 4.99 4.40 1 134 LEU 4.30 4.74 1 135 LYS 3.92 4.31 1 136 SER -1.27 -0.09 1 137 ALA 0.99 2.75 1 139 TYR -0.68 1.02 1 141 LYS -0.46 1.30 1 142 ALA -0.16 1.50 1 145 THR -0.21 1.29 1 146 VAL -0.11 1.35 1 147 THR 0.02 1.35 1 149 THR -0.91 1.08 1 154 TRP -2.84 0.42 1 155 LYS -1.76 0.69 1 156 THR -3.10 -0.97 1 157 ASN 3.74 3.67 1 158 LYS 0.06 0.88 1 159 TYR 2.09 2.53 1 161 THR -2.77 0.20 1 162 LEU -6.29 -0.04 1 163 TYR -3.22 0.45 1 164 LYS 1.44 2.04 1 165 SER -3.23 1.92 1 166 GLU -3.38 -0.96 1 167 SER -1.64 0.39 1 168 ALA -3.97 -0.24 1 169 SER -5.10 -0.22 1 170 PHE -2.39 -0.02 1 171 THR -0.89 -0.20 1 173 ASN -2.46 -1.22 1 174 THR 1.23 1.80 1 175 ASP -4.47 1.35 1 176 ILE 2.36 3.16 1 177 ILE -2.62 -0.60 1 178 THR -5.10 -0.79 1 179 ARG -2.77 -0.19 1 180 THR 5.31 6.25 1 181 THR -5.88 -0.47 1 184 PHE 3.27 3.91 1 185 ARG 0.34 1.03 1 186 SER 1.60 1.81 1 187 MET 0.93 1.79 1 189 GLN -0.14 0.95 1 190 SER -3.56 0.46 1 192 VAL -1.86 0.16 1 193 LEU -0.74 0.35 1 194 LYS 2.11 2.27 1 195 ALA 0.52 1.33 1 197 GLN 1.00 3.03 1 198 THR -7.20 -1.76 1 199 ILE -0.81 1.63 1 200 HIS -4.70 -0.56 1 201 TYR -1.85 1.10 1 202 ASP -6.07 0.88 1 203 GLU -4.27 -0.40 1 204 VAL -8.37 0.13 1 205 MET 0.91 1.04 1 206 LYS -2.89 0.73 1 207 GLN 0.33 3.07 1 208 ASP -0.89 3.66 1 210 HIS -0.01 0.85 1 211 VAL -5.03 -1.59 1 212 TRP -5.01 -2.31 1 213 VAL -5.24 -0.61 1 215 TYR 1.06 1.82 1 216 THR 3.14 3.98 1 218 ASN 0.11 1.09 1 219 SER -1.67 0.33 1 221 GLN -0.09 -0.02 1 222 ARG -1.86 -0.13 1 223 ILE -4.04 0.18 1 224 TYR -2.74 0.68 1 225 LEU -1.88 -0.55 1 227 VAL -3.19 -0.76 1 228 ARG -0.61 1.76 1 229 THR -3.10 -0.25 1 230 TRP -2.06 -0.49 1 231 ASN 2.77 3.47 1 232 LYS 4.02 4.36 1 233 SER -0.73 0.52 1 234 THR 1.83 2.24 1 235 ASN -0.85 1.32 1 236 THR -3.44 -0.45 1 237 LEU 1.11 1.95 1 239 VAL -0.95 2.01 1 240 LEU 0.77 -0.86 1 241 TRP -2.93 0.81 1 243 THR -2.60 0.64 1 244 ILE -0.64 3.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34121_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 6.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 2.13 _LACS_plot.Line_2_terminator_val_x_2 6.44 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _LACS_plot.Y_axis_chem_shift_offset -1.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 ILE 1.53 -2.79 0 10 LEU 2.23 0.24 1 11 ASN 3.29 0.78 1 12 ASN 0.61 1.53 1 13 TYR -1.70 3.09 1 14 LYS -0.16 2.07 1 15 LYS 0.17 1.60 1 17 TYR 2.17 0.98 1 19 TYR -0.52 2.95 1 22 TYR 0.41 0.91 1 24 LEU 0.50 1.07 1 26 ILE -0.54 1.50 1 27 ASN 1.98 0.69 1 30 MET -2.76 2.24 1 31 HIS -0.13 1.34 1 32 TYR 3.57 0.37 1 34 VAL -5.70 3.73 1 35 ASP -4.20 3.26 1 36 PHE -4.08 4.49 1 37 PHE 2.93 1.00 1 38 MET -1.10 2.50 1 39 ASN 0.29 0.86 1 40 ILE 3.87 0.31 1 42 THR 3.42 1.23 1 44 VAL -1.17 1.77 1 45 LYS -2.38 1.24 1 46 ALA 1.95 -0.44 1 47 ILE 1.93 1.09 1 48 SER -3.53 3.60 1 49 SER -1.28 1.58 1 51 LYS -4.67 4.44 1 53 VAL -1.51 1.42 1 54 GLU -4.34 4.77 1 55 ALA 1.34 -0.47 1 57 TRP 0.36 1.51 1 58 SER -3.01 1.29 1 59 ASN 0.98 1.19 1 60 TYR 0.85 0.64 1 64 ASN 2.56 0.41 1 65 GLN -6.65 5.72 1 66 ILE -6.57 5.85 1 68 LEU -7.29 7.47 1 69 ILE -0.52 2.25 1 70 GLU -0.17 2.32 1 71 ASN 3.31 0.40 1 72 ASP 1.64 -0.04 1 74 VAL -0.95 4.11 1 75 HIS 5.07 0.80 1 76 ARG -5.60 4.56 1 77 GLN -5.91 5.20 1 78 TRP -8.34 6.80 1 79 TYR -2.75 2.95 1 80 MET -3.32 4.85 1 81 HIS 5.93 -2.19 1 82 LEU 1.56 0.44 1 83 SER -0.28 2.53 1 84 LYS -4.79 6.02 1 85 TYR -3.26 4.43 1 86 ASN -4.37 4.26 1 87 VAL -8.26 5.87 1 88 LYS -5.08 4.11 1 89 VAL 5.71 -0.39 1 91 ASP 1.06 1.57 1 92 TYR -1.00 2.32 1 93 VAL -6.11 3.50 1 94 LYS -4.80 3.14 1 95 ALA 2.57 -0.05 1 97 GLN -0.31 2.21 1 98 ILE 3.12 -0.29 1 99 ILE 0.51 1.03 1 101 TRP -3.18 5.17 1 102 SER 1.21 2.11 1 104 SER -3.92 2.61 1 105 THR -2.09 3.20 1 107 TYR 1.01 -1.05 1 109 THR 1.16 0.87 1 110 ALA -2.00 3.38 1 112 HIS 0.03 2.31 1 113 LEU -3.80 4.22 1 114 HIS -5.48 7.18 1 115 PHE -4.11 3.98 1 116 GLN -6.40 5.70 1 117 ARG -3.90 4.51 1 118 MET -6.35 6.23 1 119 VAL -2.45 2.34 1 120 ASN 6.45 0.42 1 121 SER -2.57 2.48 1 122 PHE 2.44 -1.11 1 123 SER -2.28 1.99 1 124 ASN 5.85 -1.88 1 125 SER 3.52 0.64 1 126 THR 0.42 -0.39 1 127 ALA -1.27 2.58 1 128 GLN -6.45 4.48 1 129 ASP -0.10 0.97 1 131 MET 2.94 0.79 1 133 PHE 4.99 -0.59 1 134 LEU 4.30 0.44 1 135 LYS 3.92 0.39 1 136 SER -1.27 1.18 1 137 ALA 0.99 1.76 1 139 TYR -0.68 1.70 1 141 LYS -0.46 1.76 1 142 ALA -0.16 1.66 1 145 THR -0.21 1.50 1 146 VAL -0.11 1.46 1 147 THR 0.02 1.33 1 149 THR -0.91 1.99 1 154 TRP -2.84 3.26 1 155 LYS -1.76 2.45 1 156 THR -3.10 2.13 1 157 ASN 3.74 -0.07 1 158 LYS 0.06 0.82 1 159 TYR 2.09 0.44 1 161 THR -2.77 2.97 1 162 LEU -6.29 6.25 1 163 TYR -3.22 3.67 1 164 LYS 1.44 0.60 1 165 SER -3.23 5.15 1 166 GLU -3.38 2.42 1 167 SER -1.64 2.03 1 168 ALA -3.97 3.73 1 169 SER -5.10 4.88 1 170 PHE -2.39 2.37 1 171 THR -0.89 0.69 1 173 ASN -2.46 1.24 1 174 THR 1.23 0.57 1 175 ASP -4.47 5.82 1 176 ILE 2.36 0.80 1 177 ILE -2.62 2.02 1 178 THR -5.10 4.31 1 179 ARG -2.77 2.58 1 180 THR 5.31 0.94 1 181 THR -5.88 5.41 1 184 PHE 3.27 0.64 1 185 ARG 0.34 0.69 1 186 SER 1.60 0.21 1 187 MET 0.93 0.86 1 189 GLN -0.14 1.09 1 190 SER -3.56 4.02 1 192 VAL -1.86 2.02 1 193 LEU -0.74 1.09 1 194 LYS 2.11 0.16 1 195 ALA 0.52 0.81 1 197 GLN 1.00 2.03 1 198 THR -7.20 5.44 1 199 ILE -0.81 2.44 1 200 HIS -4.70 4.14 1 201 TYR -1.85 2.95 1 202 ASP -6.07 6.95 1 203 GLU -4.27 3.87 1 204 VAL -8.37 8.50 1 205 MET 0.91 0.13 1 206 LYS -2.89 3.62 1 207 GLN 0.33 2.74 1 208 ASP -0.89 4.55 1 210 HIS -0.01 0.86 1 211 VAL -5.03 3.44 1 212 TRP -5.01 2.70 1 213 VAL -5.24 4.63 1 215 TYR 1.06 0.76 1 216 THR 3.14 0.84 1 218 ASN 0.11 0.98 1 219 SER -1.67 2.00 1 221 GLN -0.09 0.07 1 222 ARG -1.86 1.73 1 223 ILE -4.04 4.22 1 224 TYR -2.74 3.42 1 225 LEU -1.88 1.33 1 227 VAL -3.19 2.43 1 228 ARG -0.61 2.37 1 229 THR -3.10 2.85 1 230 TRP -2.06 1.57 1 231 ASN 2.77 0.70 1 232 LYS 4.02 0.34 1 233 SER -0.73 1.25 1 234 THR 1.83 0.41 1 235 ASN -0.85 2.17 1 236 THR -3.44 2.99 1 237 LEU 1.11 0.84 1 239 VAL -0.95 2.96 1 240 LEU 0.77 -1.63 1 241 TRP -2.93 3.74 1 243 THR -2.60 3.24 1 244 ILE -0.64 4.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34121_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.37 _LACS_plot.Line_1_terminator_val_y_1 1.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.44 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 227 VAL -3.19 -1.36 0 10 LEU 2.23 -0.84 1 11 ASN 3.29 -0.28 1 12 ASN 0.61 -0.22 1 13 TYR -1.70 0.35 1 14 LYS -0.16 0.07 1 15 LYS 0.17 -0.11 1 17 TYR 2.17 -0.26 1 19 TYR -0.52 -0.24 1 22 TYR 0.41 -0.22 1 24 LEU 0.50 -0.24 1 26 ILE -0.54 -0.06 1 27 ASN 1.98 -0.22 1 30 MET -2.76 -0.22 1 31 HIS -0.13 -0.40 1 32 TYR 3.57 -0.38 1 34 VAL -5.70 0.97 1 35 ASP -4.20 1.47 1 36 PHE -4.08 0.32 1 37 PHE 2.93 -0.03 1 38 MET -1.10 0.37 1 39 ASN 0.29 -0.20 1 40 ILE 3.87 -0.42 1 42 THR 3.42 -0.08 1 44 VAL -1.17 -0.46 1 45 LYS -2.38 -0.09 1 46 ALA 1.95 -0.38 1 47 ILE 1.93 0.07 1 48 SER -3.53 1.10 1 49 SER -1.28 0.22 1 51 LYS -4.67 0.51 1 52 ILE 1.53 0.37 1 53 VAL -1.51 0.56 1 54 GLU -4.34 -0.06 1 55 ALA 1.34 0.61 1 57 TRP 0.36 -0.29 1 58 SER -3.01 0.00 1 59 ASN 0.98 -0.05 1 60 TYR 0.85 0.04 1 64 ASN 2.56 -0.23 1 65 GLN -6.65 1.30 1 66 ILE -6.57 0.83 1 68 LEU -7.29 1.27 1 69 ILE -0.52 0.38 1 70 GLU -0.17 0.00 1 71 ASN 3.31 -0.14 1 72 ASP 1.64 -0.16 1 74 VAL -0.95 -0.27 1 75 HIS 5.07 0.02 1 76 ARG -5.60 0.51 1 77 GLN -5.91 0.98 1 78 TRP -8.34 1.70 1 79 TYR -2.75 0.71 1 80 MET -3.32 0.42 1 81 HIS 5.93 -0.34 1 82 LEU 1.56 -0.18 1 83 SER -0.28 0.22 1 84 LYS -4.79 0.12 1 85 TYR -3.26 0.29 1 86 ASN -4.37 0.67 1 87 VAL -8.26 0.57 1 88 LYS -5.08 0.19 1 89 VAL 5.71 -0.99 1 91 ASP 1.06 -0.08 1 92 TYR -1.00 0.53 1 93 VAL -6.11 0.68 1 94 LYS -4.80 0.48 1 95 ALA 2.57 -0.75 1 97 GLN -0.31 -0.31 1 98 ILE 3.12 -0.45 1 99 ILE 0.51 0.24 1 101 TRP -3.18 0.64 1 102 SER 1.21 -0.13 1 105 THR -2.09 0.18 1 107 TYR 1.01 0.20 1 109 THR 1.16 -0.06 1 110 ALA -2.00 0.17 1 112 HIS 0.03 0.50 1 113 LEU -3.80 0.57 1 114 HIS -5.48 1.17 1 115 PHE -4.11 0.74 1 116 GLN -6.40 0.33 1 117 ARG -3.90 0.86 1 118 MET -6.35 0.48 1 119 VAL -2.45 -0.07 1 120 ASN 6.45 -0.63 1 121 SER -2.57 -0.36 1 122 PHE 2.44 -0.92 1 123 SER -2.28 -0.02 1 124 ASN 5.85 -0.76 1 125 SER 3.52 -0.31 1 126 THR 0.42 0.14 1 127 ALA -1.27 0.47 1 128 GLN -6.45 0.08 1 129 ASP -0.10 -1.21 1 131 MET 2.94 -0.45 1 133 PHE 4.99 -1.06 1 134 LEU 4.30 0.32 1 135 LYS 3.92 -0.33 1 136 SER -1.27 0.11 1 137 ALA 0.99 -0.37 1 139 TYR -0.68 -0.08 1 141 LYS -0.46 -0.03 1 142 ALA -0.16 0.02 1 145 THR -0.21 0.07 1 146 VAL -0.11 -0.04 1 147 THR 0.02 -0.04 1 149 THR -0.91 -0.31 1 154 TRP -2.84 0.18 1 155 LYS -1.76 1.23 1 156 THR -3.10 0.47 1 157 ASN 3.74 -0.24 1 158 LYS 0.06 0.09 1 159 TYR 2.09 -0.36 1 161 THR -2.77 1.33 1 162 LEU -6.29 1.59 1 163 TYR -3.22 0.03 1 164 LYS 1.44 0.24 1 165 SER -3.23 -0.23 1 166 GLU -3.38 0.80 1 167 SER -1.64 -0.05 1 168 ALA -3.97 1.00 1 169 SER -5.10 0.99 1 170 PHE -2.39 0.28 1 171 THR -0.89 0.07 1 173 ASN -2.46 0.05 1 174 THR 1.23 0.54 1 175 ASP -4.47 0.10 1 176 ILE 2.36 0.12 1 177 ILE -2.62 0.71 1 178 THR -5.10 1.22 1 179 ARG -2.77 0.64 1 180 THR 5.31 0.53 1 181 THR -5.88 0.13 1 184 PHE 3.27 -0.13 1 185 ARG 0.34 -0.15 1 186 SER 1.60 -0.08 1 187 MET 0.93 0.34 1 189 GLN -0.14 0.04 1 190 SER -3.56 0.60 1 192 VAL -1.86 0.30 1 193 LEU -0.74 -0.07 1 194 LYS 2.11 -0.80 1 195 ALA 0.52 0.02 1 197 GLN 1.00 0.45 1 198 THR -7.20 0.33 1 199 ILE -0.81 0.28 1 200 HIS -4.70 0.74 1 201 TYR -1.85 0.72 1 202 ASP -6.07 0.73 1 203 GLU -4.27 1.12 1 204 VAL -8.37 1.47 1 205 MET 0.91 0.49 1 206 LYS -2.89 0.32 1 207 GLN 0.33 0.19 1 208 ASP -0.89 0.39 1 210 HIS -0.01 0.65 1 211 VAL -5.03 0.89 1 212 TRP -5.01 1.33 1 213 VAL -5.24 0.55 1 215 TYR 1.06 0.16 1 216 THR 3.14 -0.27 1 218 ASN 0.11 0.03 1 219 SER -1.67 0.05 1 221 GLN -0.09 0.11 1 222 ARG -1.86 0.11 1 223 ILE -4.04 0.78 1 224 TYR -2.74 0.63 1 225 LEU -1.88 0.23 1 228 ARG -0.61 -0.13 1 229 THR -3.10 0.32 1 230 TRP -2.06 -0.42 1 231 ASN 2.77 -1.53 1 232 LYS 4.02 -0.23 1 233 SER -0.73 -0.03 1 234 THR 1.83 -0.37 1 235 ASN -0.85 0.06 1 236 THR -3.44 0.68 1 237 LEU 1.11 -0.19 1 239 VAL -0.95 -0.25 1 240 LEU 0.77 0.52 1 241 TRP -2.93 0.29 1 243 THR -2.60 1.21 1 244 ILE -0.64 -0.02 1 stop_ save_