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 bmr5468_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 -3.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.34 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 6.25 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 TYR 8.60 -0.56 0 10 HIS -3.66 0.21 1 11 ALA 2.50 3.10 1 12 THR -3.06 -1.73 1 14 GLN 6.66 4.40 1 15 GLU 1.98 2.58 1 16 LEU 3.59 4.03 1 17 SER 3.57 2.94 1 18 ALA 4.96 3.13 1 19 ALA 3.40 2.40 1 22 ARG 5.03 3.75 1 23 LYS 3.90 1.67 1 24 ILE 6.16 5.21 1 25 VAL 5.08 4.83 1 26 GLU 3.67 2.98 1 27 ILE 5.11 4.43 1 28 ILE 5.79 5.22 1 29 GLU 3.23 2.90 1 30 ALA 2.57 1.62 1 31 SER 2.33 3.19 1 33 SER 3.57 1.65 1 34 GLN 3.97 2.08 1 35 GLN -0.55 -0.27 1 36 TRP -0.85 -1.53 1 38 LEU -0.16 -1.01 1 39 SER -2.87 -0.85 1 40 ILE -7.49 -4.23 1 41 ALA -2.56 -3.20 1 42 LEU 1.37 0.75 1 43 ALA -4.46 -1.61 1 46 SER 4.95 3.71 1 47 THR 3.30 2.80 1 49 LYS -2.98 -2.03 1 51 THR 4.34 -1.73 1 53 ALA 4.03 2.90 1 54 ARG 4.17 2.97 1 55 LEU 3.97 3.70 1 56 HIS 8.00 5.70 1 57 ASP 3.40 2.50 1 58 GLU -0.82 0.60 1 59 HIS -0.65 0.35 1 60 LEU 6.20 3.40 1 62 LEU 2.00 2.05 1 63 LEU 0.81 0.48 1 64 ARG 2.46 2.49 1 65 GLU 3.05 2.45 1 66 LYS 2.31 0.50 1 67 ARG 4.73 0.85 1 68 ALA 2.44 2.80 1 69 LEU -4.82 -2.30 1 70 ARG -2.75 -1.03 1 71 PHE -0.41 1.41 1 72 PHE -3.26 -2.04 1 73 MET -1.60 -3.16 1 75 ASP -2.68 -0.42 1 76 GLU -6.31 -1.75 1 77 ARG 0.08 1.31 1 78 MET 2.36 -2.32 1 79 VAL -1.44 -1.65 1 81 ALA 2.49 1.87 1 82 ASP -0.38 -1.43 1 83 SER -0.74 -0.63 1 84 THR 4.53 2.83 1 85 ASP -0.11 0.66 1 86 SER -1.05 -1.26 1 87 ASN 4.86 3.13 1 88 TYR 3.82 3.41 1 89 ASN 3.23 4.21 1 90 MET 5.60 3.79 1 91 ALA 4.43 2.23 1 92 ARG 6.15 3.84 1 93 GLU 3.53 3.15 1 94 VAL -0.89 -0.71 1 95 LEU 0.47 2.58 1 96 LEU 3.80 1.85 1 97 HIS 5.31 3.12 1 98 ASP -2.85 -0.75 1 99 ILE -2.05 -3.85 1 101 ASP 3.55 3.42 1 102 ASP 2.61 0.37 1 103 LEU -0.56 -0.98 1 104 VAL -0.50 0.46 1 105 PHE -1.09 0.00 1 107 PHE 2.31 1.94 1 108 ASP 0.61 -1.04 1 109 THR 0.81 -0.98 1 110 SER 4.37 3.65 1 111 ALA 0.70 -0.06 1 112 VAL 2.58 0.72 1 113 THR -0.24 -0.61 1 115 SER 1.05 0.96 1 116 ALA -2.11 -0.62 1 117 GLU -0.68 -0.30 1 118 ALA -0.94 -0.27 1 119 THR -4.43 -1.74 1 121 ALA 3.46 2.41 1 122 ASP 3.20 3.17 1 123 ALA 3.62 2.38 1 124 MET 4.17 3.00 1 125 ARG 4.71 3.81 1 126 VAL 5.34 4.12 1 127 ALA 4.12 3.34 1 128 GLU 3.13 2.68 1 129 ALA 3.55 2.71 1 130 TYR 3.23 3.98 1 132 LYS 4.31 3.33 1 133 GLN 4.30 3.55 1 134 LEU 4.05 3.03 1 135 ALA 2.41 1.25 1 136 SER 0.24 1.23 1 137 LEU -2.25 0.87 1 138 LEU 1.18 -0.02 1 140 LEU -4.47 -1.99 1 141 LYS -4.86 -1.38 1 142 SER 0.61 0.95 1 143 VAL 2.49 0.46 1 145 GLU 2.60 1.60 1 146 ALA 0.87 -0.08 1 149 LYS -1.63 -0.78 1 150 VAL -3.50 -1.98 1 152 VAL -0.35 -0.54 1 153 PHE -1.18 0.31 1 154 ASP 3.97 4.98 1 155 VAL -4.01 -1.26 1 156 VAL -1.76 -0.21 1 157 LEU -3.58 -1.96 1 158 LEU -5.81 -1.82 1 160 LEU -5.59 -2.30 1 162 SER 3.35 3.10 1 163 ASP -0.28 -0.31 1 165 HIS 1.48 0.86 1 166 THR -1.32 -1.71 1 167 ALA 5.34 2.04 1 168 SER -0.10 1.00 1 169 ILE 1.71 -0.90 1 170 PHE 0.87 1.43 1 173 SER -3.13 -0.13 1 174 GLN 5.44 3.39 1 175 ALA 2.56 2.80 1 176 GLU 3.00 2.32 1 177 LYS 0.28 -0.32 1 178 GLU 1.31 -1.89 1 179 THR 0.35 0.16 1 180 ASP 0.06 0.31 1 182 LYS 4.40 3.40 1 183 VAL -1.36 -0.39 1 184 VAL 2.13 2.37 1 185 VAL -1.44 -1.09 1 186 SER -4.27 -3.28 1 187 VAL -7.04 -3.26 1 189 PHE -5.08 -3.13 1 192 GLU -3.55 -0.76 1 193 THR 2.15 -3.34 1 194 MET -4.53 1.97 1 195 LYS -2.29 -3.01 1 197 LYS 2.78 -1.17 1 198 VAL -5.86 -3.82 1 199 TRP 2.55 3.88 1 200 ARG -6.15 -3.84 1 201 VAL -4.40 -3.35 1 202 THR -2.86 -2.47 1 203 LEU 2.52 2.05 1 204 SER -0.61 -0.29 1 206 ALA 3.03 2.77 1 207 THR 6.48 4.79 1 208 ILE 6.24 5.83 1 209 MET 2.66 3.88 1 210 GLN -0.79 -2.08 1 211 ALA -1.05 0.10 1 212 ARG 4.61 3.44 1 213 ASN -3.93 -0.14 1 214 VAL -2.39 -0.77 1 215 ILE -1.93 -1.04 1 216 VAL -1.34 -2.04 1 217 LEU -2.04 -1.35 1 218 ALA -2.81 0.04 1 219 THR -4.65 -2.64 1 221 ALA 3.28 2.71 1 222 GLU 3.96 1.68 1 223 LYS -0.22 -0.51 1 224 LYS 5.74 4.64 1 225 TRP 4.86 1.58 1 226 VAL 5.70 3.02 1 227 VAL 6.52 4.71 1 228 ASP 4.33 3.57 1 230 ILE 3.75 3.89 1 231 LEU 2.50 1.68 1 232 ALA -0.14 0.27 1 233 ASP 3.89 3.61 1 234 THR -1.79 -0.84 1 235 ALA -1.79 -1.22 1 237 LYS 1.06 -0.41 1 238 ALA -1.83 -0.64 1 240 VAL 4.98 3.70 1 241 ALA 1.98 1.14 1 242 ARG 4.75 3.25 1 243 PHE 5.63 2.33 1 244 LEU 1.85 1.06 1 245 ARG 2.87 2.24 1 248 GLU 0.26 0.49 1 250 ASN 0.01 0.39 1 251 VAL -0.37 -0.43 1 252 SER -2.71 -0.96 1 253 PHE -2.66 -1.46 1 254 LEU 1.54 0.56 1 255 LEU -5.06 -2.31 1 256 ASP -3.18 -2.32 1 257 LYS 4.07 3.19 1 258 GLU 3.36 3.08 1 259 ILE 4.49 3.05 1 260 ALA -2.22 -0.46 1 261 GLU 2.37 2.42 1 262 ASN 1.06 0.60 1 263 LEU 1.36 0.70 1 264 ALA 0.56 0.11 1 265 LYS 0.63 -0.08 1 266 PHE 0.55 1.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5468_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 3.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.66 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 -2.35 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 TYR 8.60 -9.16 0 10 HIS -3.66 3.87 1 11 ALA 2.50 0.60 1 12 THR -3.06 1.33 1 14 GLN 6.66 -2.26 1 15 GLU 1.98 0.60 1 16 LEU 3.59 0.44 1 17 SER 3.57 -0.63 1 18 ALA 4.96 -1.83 1 19 ALA 3.40 -1.00 1 22 ARG 5.03 -1.28 1 23 LYS 3.90 -2.23 1 24 ILE 6.16 -0.95 1 25 VAL 5.08 -0.25 1 26 GLU 3.67 -0.69 1 27 ILE 5.11 -0.68 1 28 ILE 5.79 -0.57 1 29 GLU 3.23 -0.33 1 30 ALA 2.57 -0.95 1 31 SER 2.33 0.86 1 33 SER 3.57 -1.92 1 34 GLN 3.97 -1.89 1 35 GLN -0.55 0.28 1 36 TRP -0.85 -0.68 1 38 LEU -0.16 -0.85 1 39 SER -2.87 2.02 1 40 ILE -7.49 3.26 1 41 ALA -2.56 -0.64 1 42 LEU 1.37 -0.62 1 43 ALA -4.46 2.85 1 46 SER 4.95 -1.24 1 47 THR 3.30 -0.50 1 49 LYS -2.98 0.95 1 51 THR 4.34 -6.07 1 53 ALA 4.03 -1.13 1 54 ARG 4.17 -1.20 1 55 LEU 3.97 -0.27 1 56 HIS 8.00 -2.30 1 57 ASP 3.40 -0.90 1 58 GLU -0.82 1.42 1 59 HIS -0.65 1.00 1 60 LEU 6.20 -2.80 1 62 LEU 2.00 0.05 1 63 LEU 0.81 -0.33 1 64 ARG 2.46 0.03 1 65 GLU 3.05 -0.60 1 66 LYS 2.31 -1.81 1 67 ARG 4.73 -3.88 1 68 ALA 2.44 0.36 1 69 LEU -4.82 2.52 1 70 ARG -2.75 1.72 1 71 PHE -0.41 1.82 1 72 PHE -3.26 1.22 1 73 MET -1.60 -1.56 1 75 ASP -2.68 2.26 1 76 GLU -6.31 4.56 1 77 ARG 0.08 1.23 1 78 MET 2.36 -4.68 1 79 VAL -1.44 -0.21 1 81 ALA 2.49 -0.62 1 82 ASP -0.38 -1.05 1 83 SER -0.74 0.11 1 84 THR 4.53 -1.70 1 85 ASP -0.11 0.77 1 86 SER -1.05 -0.21 1 87 ASN 4.86 -1.73 1 88 TYR 3.82 -0.41 1 89 ASN 3.23 0.98 1 90 MET 5.60 -1.81 1 91 ALA 4.43 -2.20 1 92 ARG 6.15 -2.31 1 93 GLU 3.53 -0.38 1 94 VAL -0.89 0.18 1 95 LEU 0.47 2.11 1 96 LEU 3.80 -1.95 1 97 HIS 5.31 -2.19 1 98 ASP -2.85 2.10 1 99 ILE -2.05 -1.80 1 101 ASP 3.55 -0.13 1 102 ASP 2.61 -2.24 1 103 LEU -0.56 -0.42 1 104 VAL -0.50 0.96 1 105 PHE -1.09 1.09 1 107 PHE 2.31 -0.37 1 108 ASP 0.61 -1.65 1 109 THR 0.81 -1.79 1 110 SER 4.37 -0.72 1 111 ALA 0.70 -0.76 1 112 VAL 2.58 -1.86 1 113 THR -0.24 -0.37 1 115 SER 1.05 -0.09 1 116 ALA -2.11 1.49 1 117 GLU -0.68 0.38 1 118 ALA -0.94 0.67 1 119 THR -4.43 2.69 1 121 ALA 3.46 -1.05 1 122 ASP 3.20 -0.03 1 123 ALA 3.62 -1.24 1 124 MET 4.17 -1.17 1 125 ARG 4.71 -0.90 1 126 VAL 5.34 -1.22 1 127 ALA 4.12 -0.78 1 128 GLU 3.13 -0.45 1 129 ALA 3.55 -0.84 1 130 TYR 3.23 0.75 1 132 LYS 4.31 -0.98 1 133 GLN 4.30 -0.75 1 134 LEU 4.05 -1.02 1 135 ALA 2.41 -1.16 1 136 SER 0.24 0.99 1 137 LEU -2.25 3.12 1 138 LEU 1.18 -1.20 1 140 LEU -4.47 2.48 1 141 LYS -4.86 3.48 1 142 SER 0.61 0.34 1 143 VAL 2.49 -2.03 1 145 GLU 2.60 -1.00 1 146 ALA 0.87 -0.95 1 149 LYS -1.63 0.85 1 150 VAL -3.50 1.52 1 152 VAL -0.35 -0.19 1 153 PHE -1.18 1.49 1 154 ASP 3.97 1.01 1 155 VAL -4.01 2.75 1 156 VAL -1.76 1.55 1 157 LEU -3.58 1.62 1 158 LEU -5.81 3.99 1 160 LEU -5.59 3.29 1 162 SER 3.35 -0.25 1 163 ASP -0.28 -0.03 1 165 HIS 1.48 -0.62 1 166 THR -1.32 -0.39 1 167 ALA 5.34 -3.30 1 168 SER -0.10 1.10 1 169 ILE 1.71 -2.61 1 170 PHE 0.87 0.56 1 173 SER -3.13 3.00 1 174 GLN 5.44 -2.05 1 175 ALA 2.56 0.24 1 176 GLU 3.00 -0.68 1 177 LYS 0.28 -0.60 1 178 GLU 1.31 -3.20 1 179 THR 0.35 -0.19 1 180 ASP 0.06 0.25 1 182 LYS 4.40 -1.00 1 183 VAL -1.36 0.97 1 184 VAL 2.13 0.24 1 185 VAL -1.44 0.35 1 186 SER -4.27 0.99 1 187 VAL -7.04 3.78 1 189 PHE -5.08 1.95 1 192 GLU -3.55 2.79 1 193 THR 2.15 -5.49 1 194 MET -4.53 6.50 1 195 LYS -2.29 -0.72 1 197 LYS 2.78 -3.95 1 198 VAL -5.86 2.04 1 199 TRP 2.55 1.33 1 200 ARG -6.15 2.31 1 201 VAL -4.40 1.05 1 202 THR -2.86 0.39 1 203 LEU 2.52 -0.47 1 204 SER -0.61 0.32 1 206 ALA 3.03 -0.26 1 207 THR 6.48 -1.69 1 208 ILE 6.24 -0.41 1 209 MET 2.66 1.22 1 210 GLN -0.79 -1.29 1 211 ALA -1.05 1.15 1 212 ARG 4.61 -1.17 1 213 ASN -3.93 3.79 1 214 VAL -2.39 1.62 1 215 ILE -1.93 0.89 1 216 VAL -1.34 -0.70 1 217 LEU -2.04 0.69 1 218 ALA -2.81 2.85 1 219 THR -4.65 2.01 1 221 ALA 3.28 -0.57 1 222 GLU 3.96 -2.28 1 223 LYS -0.22 -0.29 1 224 LYS 5.74 -1.10 1 225 TRP 4.86 -3.28 1 226 VAL 5.70 -2.68 1 227 VAL 6.52 -1.81 1 228 ASP 4.33 -0.76 1 230 ILE 3.75 0.14 1 231 LEU 2.50 -0.82 1 232 ALA -0.14 0.41 1 233 ASP 3.89 -0.28 1 234 THR -1.79 0.95 1 235 ALA -1.79 0.57 1 237 LYS 1.06 -1.47 1 238 ALA -1.83 1.19 1 240 VAL 4.98 -1.28 1 241 ALA 1.98 -0.84 1 242 ARG 4.75 -1.50 1 243 PHE 5.63 -3.30 1 244 LEU 1.85 -0.79 1 245 ARG 2.87 -0.63 1 248 GLU 0.26 0.23 1 250 ASN 0.01 0.38 1 251 VAL -0.37 -0.06 1 252 SER -2.71 1.75 1 253 PHE -2.66 1.20 1 254 LEU 1.54 -0.98 1 255 LEU -5.06 2.75 1 256 ASP -3.18 0.86 1 257 LYS 4.07 -0.88 1 258 GLU 3.36 -0.28 1 259 ILE 4.49 -1.44 1 260 ALA -2.22 1.76 1 261 GLU 2.37 0.05 1 262 ASN 1.06 -0.46 1 263 LEU 1.36 -0.66 1 264 ALA 0.56 -0.45 1 265 LYS 0.63 -0.71 1 266 PHE 0.55 0.64 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5468_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.65 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 255 LEU -5.06 1.36 0 160 LEU -5.59 -0.03 0 187 VAL -7.04 1.51 0 10 HIS -3.66 -0.05 1 11 ALA 2.50 -0.19 1 12 THR -3.06 0.58 1 14 GLN 6.66 -0.36 1 15 GLU 1.98 -0.03 1 16 LEU 3.59 -1.05 1 17 SER 3.57 -0.37 1 18 ALA 4.96 -0.15 1 19 ALA 3.40 -0.35 1 22 ARG 5.03 -0.56 1 23 LYS 3.90 -0.24 1 24 ILE 6.16 -0.82 1 26 GLU 3.67 -0.37 1 27 ILE 5.11 -0.49 1 28 ILE 5.79 -0.67 1 30 ALA 2.57 -0.10 1 31 SER 2.33 -0.16 1 34 GLN 3.97 -0.25 1 35 GLN -0.55 0.03 1 39 SER -2.87 0.83 1 41 ALA -2.56 0.38 1 42 LEU 1.37 -0.14 1 43 ALA -4.46 0.74 1 51 THR 4.34 -0.15 1 53 ALA 4.03 -0.18 1 54 ARG 4.17 -0.39 1 55 LEU 3.97 -0.31 1 63 LEU 0.81 0.12 1 64 ARG 2.46 -0.07 1 65 GLU 3.05 -0.31 1 66 LYS 2.31 0.03 1 67 ARG 4.73 -0.66 1 68 ALA 2.44 -0.91 1 69 LEU -4.82 0.66 1 70 ARG -2.75 0.44 1 71 PHE -0.41 0.25 1 72 PHE -3.26 0.43 1 73 MET -1.60 -0.04 1 75 ASP -2.68 0.95 1 78 MET 2.36 -0.02 1 79 VAL -1.44 0.31 1 81 ALA 2.49 -0.07 1 82 ASP -0.38 -0.08 1 83 SER -0.74 -0.04 1 84 THR 4.53 -0.05 1 85 ASP -0.11 0.11 1 86 SER -1.05 0.03 1 87 ASN 4.86 -0.07 1 88 TYR 3.82 -0.29 1 89 ASN 3.23 -0.85 1 90 MET 5.60 -0.41 1 91 ALA 4.43 -0.42 1 93 GLU 3.53 -0.62 1 94 VAL -0.89 0.17 1 96 LEU 3.80 -0.41 1 97 HIS 5.31 -0.23 1 101 ASP 3.55 -0.54 1 102 ASP 2.61 -0.33 1 103 LEU -0.56 0.31 1 104 VAL -0.50 0.34 1 105 PHE -1.09 -0.41 1 107 PHE 2.31 -0.62 1 108 ASP 0.61 0.32 1 109 THR 0.81 -0.05 1 110 SER 4.37 -0.06 1 111 ALA 0.70 0.05 1 112 VAL 2.58 -0.14 1 113 THR -0.24 0.34 1 115 SER 1.05 -0.13 1 116 ALA -2.11 0.22 1 117 GLU -0.68 0.03 1 118 ALA -0.94 0.29 1 119 THR -4.43 0.18 1 121 ALA 3.46 -0.37 1 122 ASP 3.20 -0.39 1 123 ALA 3.62 -0.19 1 124 MET 4.17 -0.44 1 125 ARG 4.71 -0.16 1 126 VAL 5.34 -0.12 1 127 ALA 4.12 -0.32 1 128 GLU 3.13 -0.22 1 129 ALA 3.55 -0.10 1 130 TYR 3.23 -0.01 1 132 LYS 4.31 -0.26 1 133 GLN 4.30 -0.30 1 134 LEU 4.05 -0.95 1 135 ALA 2.41 -0.38 1 136 SER 0.24 -0.07 1 137 LEU -2.25 0.05 1 138 LEU 1.18 -0.22 1 140 LEU -4.47 0.49 1 141 LYS -4.86 0.23 1 142 SER 0.61 -0.04 1 143 VAL 2.49 -0.22 1 145 GLU 2.60 -0.36 1 146 ALA 0.87 -0.06 1 149 LYS -1.63 0.31 1 150 VAL -3.50 0.18 1 154 ASP 3.97 -0.04 1 155 VAL -4.01 0.89 1 156 VAL -1.76 1.14 1 157 LEU -3.58 0.94 1 158 LEU -5.81 0.44 1 163 ASP -0.28 0.48 1 165 HIS 1.48 -0.19 1 166 THR -1.32 0.07 1 167 ALA 5.34 -0.04 1 168 SER -0.10 -0.27 1 169 ILE 1.71 -0.47 1 173 SER -3.13 0.35 1 175 ALA 2.56 -0.28 1 176 GLU 3.00 -1.01 1 177 LYS 0.28 -0.03 1 179 THR 0.35 0.16 1 180 ASP 0.06 -0.14 1 182 LYS 4.40 -0.52 1 184 VAL 2.13 -0.35 1 185 VAL -1.44 0.56 1 186 SER -4.27 0.28 1 193 THR 2.15 -0.21 1 194 MET -4.53 0.34 1 197 LYS 2.78 -0.72 1 198 VAL -5.86 0.58 1 199 TRP 2.55 -0.36 1 201 VAL -4.40 1.01 1 204 SER -0.61 -0.38 1 206 ALA 3.03 -0.42 1 207 THR 6.48 -0.13 1 208 ILE 6.24 -0.85 1 209 MET 2.66 -0.04 1 210 GLN -0.79 0.07 1 211 ALA -1.05 0.19 1 212 ARG 4.61 -0.33 1 213 ASN -3.93 -0.20 1 214 VAL -2.39 0.68 1 215 ILE -1.93 0.34 1 217 LEU -2.04 0.90 1 218 ALA -2.81 0.36 1 219 THR -4.65 0.35 1 221 ALA 3.28 -0.56 1 222 GLU 3.96 0.14 1 223 LYS -0.22 0.41 1 224 LYS 5.74 -0.41 1 225 TRP 4.86 -0.21 1 227 VAL 6.52 -0.96 1 228 ASP 4.33 -0.46 1 230 ILE 3.75 -0.49 1 231 LEU 2.50 -0.42 1 232 ALA -0.14 -0.12 1 233 ASP 3.89 -0.36 1 234 THR -1.79 -0.11 1 235 ALA -1.79 0.23 1 237 LYS 1.06 -0.07 1 240 VAL 4.98 0.10 1 241 ALA 1.98 -0.64 1 243 PHE 5.63 -0.12 1 244 LEU 1.85 -0.64 1 245 ARG 2.87 -0.33 1 248 GLU 0.26 0.02 1 250 ASN 0.01 -0.04 1 251 VAL -0.37 0.81 1 252 SER -2.71 1.04 1 253 PHE -2.66 0.43 1 254 LEU 1.54 0.76 1 256 ASP -3.18 1.03 1 257 LYS 4.07 -0.63 1 258 GLU 3.36 -0.32 1 259 ILE 4.49 -0.48 1 260 ALA -2.22 -0.15 1 261 GLU 2.37 -0.41 1 262 ASN 1.06 -0.03 1 263 LEU 1.36 -0.19 1 264 ALA 0.56 -0.20 1 265 LYS 0.63 -0.18 1 266 PHE 0.55 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5468_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.49 _LACS_plot.Line_1_terminator_val_y_1 -2.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.04 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 2.60 _LACS_plot.Y_axis_chem_shift_offset 0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 192 GLU -3.55 -6.55 0 10 HIS -3.66 1.26 1 11 ALA 2.50 0.23 1 12 THR -3.06 0.52 1 14 GLN 6.66 3.11 1 15 GLU 1.98 2.37 1 16 LEU 3.59 0.94 1 17 SER 3.57 2.77 1 18 ALA 4.96 1.17 1 19 ALA 3.40 3.20 1 22 ARG 5.03 1.92 1 23 LYS 3.90 1.45 1 24 ILE 6.16 0.85 1 25 VAL 5.08 1.03 1 26 GLU 3.67 3.44 1 27 ILE 5.11 2.78 1 28 ILE 5.79 2.95 1 29 GLU 3.23 2.37 1 30 ALA 2.57 2.01 1 31 SER 2.33 0.42 1 33 SER 3.57 2.10 1 34 GLN 3.97 0.83 1 35 GLN -0.55 -0.95 1 36 TRP -0.85 0.72 1 38 LEU -0.16 -1.64 1 39 SER -2.87 -0.62 1 40 ILE -7.49 -4.58 1 41 ALA -2.56 -1.50 1 42 LEU 1.37 -0.71 1 43 ALA -4.46 1.45 1 47 THR 3.30 1.60 1 49 LYS -2.98 -2.10 1 52 TYR 8.60 -0.04 1 53 ALA 4.03 1.74 1 54 ARG 4.17 2.33 1 55 LEU 3.97 0.54 1 57 ASP 3.40 2.18 1 59 HIS -0.65 1.37 1 60 LEU 6.20 1.25 1 62 LEU 2.00 -1.95 1 63 LEU 0.81 0.92 1 64 ARG 2.46 -0.75 1 65 GLU 3.05 2.35 1 66 LYS 2.31 -0.75 1 67 ARG 4.73 -0.83 1 68 ALA 2.44 -0.93 1 69 LEU -4.82 -2.64 1 70 ARG -2.75 -1.96 1 71 PHE -0.41 -2.78 1 72 PHE -3.26 -1.64 1 73 MET -1.60 -1.53 1 75 ASP -2.68 -3.40 1 76 GLU -6.31 -3.23 1 77 ARG 0.08 0.49 1 78 MET 2.36 -3.35 1 79 VAL -1.44 -1.97 1 81 ALA 2.49 -1.04 1 82 ASP -0.38 -0.01 1 83 SER -0.74 2.57 1 84 THR 4.53 1.25 1 85 ASP -0.11 -1.26 1 86 SER -1.05 2.71 1 87 ASN 4.86 3.47 1 88 TYR 3.82 0.88 1 89 ASN 3.23 2.39 1 90 MET 5.60 1.65 1 91 ALA 4.43 3.48 1 92 ARG 6.15 0.92 1 93 GLU 3.53 1.40 1 94 VAL -0.89 -1.03 1 95 LEU 0.47 -2.47 1 96 LEU 3.80 0.07 1 97 HIS 5.31 0.84 1 98 ASP -2.85 -1.98 1 99 ILE -2.05 -1.02 1 101 ASP 3.55 0.86 1 102 ASP 2.61 -0.86 1 103 LEU -0.56 -3.03 1 104 VAL -0.50 -2.17 1 105 PHE -1.09 -1.59 1 107 PHE 2.31 0.60 1 108 ASP 0.61 0.37 1 109 THR 0.81 1.17 1 110 SER 4.37 0.44 1 111 ALA 0.70 -0.04 1 112 VAL 2.58 -0.86 1 113 THR -0.24 0.59 1 115 SER 1.05 -1.15 1 116 ALA -2.11 -1.63 1 117 GLU -0.68 0.12 1 118 ALA -0.94 0.34 1 119 THR -4.43 0.62 1 121 ALA 3.46 2.99 1 122 ASP 3.20 2.16 1 123 ALA 3.62 0.45 1 124 MET 4.17 2.37 1 125 ARG 4.71 3.52 1 126 VAL 5.34 2.48 1 127 ALA 4.12 1.89 1 128 GLU 3.13 3.34 1 129 ALA 3.55 3.14 1 130 TYR 3.23 3.17 1 132 LYS 4.31 2.83 1 133 GLN 4.30 3.49 1 134 LEU 4.05 0.79 1 135 ALA 2.41 0.02 1 136 SER 0.24 0.14 1 137 LEU -2.25 -1.39 1 138 LEU 1.18 -2.55 1 140 LEU -4.47 0.08 1 141 LYS -4.86 -1.29 1 142 SER 0.61 -0.37 1 143 VAL 2.49 0.10 1 145 GLU 2.60 0.77 1 146 ALA 0.87 -0.40 1 149 LYS -1.63 0.14 1 150 VAL -3.50 -2.37 1 152 VAL -0.35 -1.31 1 153 PHE -1.18 1.15 1 154 ASP 3.97 0.73 1 155 VAL -4.01 -2.09 1 156 VAL -1.76 -2.85 1 157 LEU -3.58 -3.32 1 158 LEU -5.81 -1.88 1 160 LEU -5.59 -1.05 1 162 SER 3.35 -1.03 1 163 ASP -0.28 1.94 1 165 HIS 1.48 -2.22 1 166 THR -1.32 -3.31 1 167 ALA 5.34 -0.98 1 168 SER -0.10 2.27 1 169 ILE 1.71 -2.42 1 170 PHE 0.87 0.50 1 173 SER -3.13 1.23 1 174 GLN 5.44 2.97 1 175 ALA 2.56 0.76 1 176 GLU 3.00 -0.71 1 177 LYS 0.28 1.65 1 178 GLU 1.31 -0.26 1 179 THR 0.35 0.68 1 180 ASP 0.06 0.18 1 182 LYS 4.40 -0.03 1 183 VAL -1.36 0.25 1 184 VAL 2.13 -0.26 1 185 VAL -1.44 -2.43 1 186 SER -4.27 -0.86 1 187 VAL -7.04 -1.49 1 189 PHE -5.08 -3.96 1 193 THR 2.15 -1.27 1 194 MET -4.53 -2.23 1 195 LYS -2.29 -4.10 1 197 LYS 2.78 -3.38 1 198 VAL -5.86 -1.92 1 199 TRP 2.55 -1.61 1 200 ARG -6.15 -0.18 1 201 VAL -4.40 -0.73 1 202 THR -2.86 -2.91 1 203 LEU 2.52 -0.97 1 204 SER -0.61 -0.52 1 206 ALA 3.03 0.84 1 207 THR 6.48 3.29 1 208 ILE 6.24 0.78 1 209 MET 2.66 -0.39 1 210 GLN -0.79 -0.80 1 211 ALA -1.05 1.25 1 212 ARG 4.61 1.54 1 213 ASN -3.93 -2.58 1 214 VAL -2.39 -2.28 1 215 ILE -1.93 -3.33 1 216 VAL -1.34 -1.94 1 217 LEU -2.04 -1.50 1 218 ALA -2.81 -4.82 1 219 THR -4.65 -0.81 1 221 ALA 3.28 2.27 1 222 GLU 3.96 -0.14 1 223 LYS -0.22 0.09 1 224 LYS 5.74 1.53 1 225 TRP 4.86 1.83 1 226 VAL 5.70 0.43 1 227 VAL 6.52 1.92 1 228 ASP 4.33 2.18 1 230 ILE 3.75 -0.43 1 231 LEU 2.50 0.56 1 232 ALA -0.14 0.26 1 233 ASP 3.89 0.58 1 234 THR -1.79 -2.10 1 235 ALA -1.79 -1.33 1 237 LYS 1.06 -3.60 1 238 ALA -1.83 0.19 1 240 VAL 4.98 2.26 1 241 ALA 1.98 -2.74 1 242 ARG 4.75 -0.26 1 243 PHE 5.63 0.41 1 244 LEU 1.85 -0.50 1 245 ARG 2.87 0.97 1 248 GLU 0.26 1.41 1 250 ASN 0.01 -0.03 1 251 VAL -0.37 -0.98 1 252 SER -2.71 -2.59 1 253 PHE -2.66 -2.58 1 254 LEU 1.54 -4.17 1 255 LEU -5.06 -0.42 1 256 ASP -3.18 -0.05 1 257 LYS 4.07 1.90 1 258 GLU 3.36 2.54 1 259 ILE 4.49 -1.12 1 260 ALA -2.22 0.50 1 261 GLU 2.37 0.31 1 262 ASN 1.06 0.31 1 263 LEU 1.36 -0.46 1 264 ALA 0.56 -0.75 1 265 LYS 0.63 -1.29 1 266 PHE 0.55 4.40 1 stop_ save_