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 bmr17416_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.56 _LACS_plot.Line_1_terminator_val_y_1 -3.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.64 _LACS_plot.Line_2_terminator_val_x_2 9.18 _LACS_plot.Line_2_terminator_val_y_2 6.75 _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 219 TYR -1.15 -3.76 0 235 LEU -2.73 -4.55 0 71 THR 5.54 -0.01 0 98 ILE 7.50 1.05 0 221 ASN 9.18 8.19 0 10 LYS 0.57 0.29 1 11 LEU -5.53 -2.02 1 12 SER -3.82 -1.81 1 13 PHE -5.70 -1.20 1 14 GLU -7.08 -1.93 1 16 VAL -2.64 -1.94 1 18 ILE 4.75 2.54 1 19 HIS 1.36 4.30 1 20 THR 0.49 1.52 1 22 GLU -4.72 -2.37 1 23 TYR 1.43 1.40 1 24 SER -4.46 -1.51 1 25 LYS -4.94 -1.81 1 26 LEU -6.82 -2.37 1 27 ILE -2.79 -0.27 1 28 ILE 0.63 -0.34 1 29 HIS -3.44 0.40 1 31 GLU -8.09 -2.94 1 32 LYS -1.43 -0.60 1 33 GLU 1.78 1.25 1 35 THR 4.90 4.04 1 37 ILE 0.74 -2.71 1 38 ARG -4.59 -2.30 1 39 PHE -2.41 -1.24 1 40 PHE -5.31 -2.13 1 41 LYS -4.69 -1.50 1 42 ASN 2.93 0.61 1 44 VAL -2.78 -1.18 1 45 TYR -1.02 0.14 1 46 ILE -2.65 -0.60 1 48 ALA -0.82 -2.87 1 49 ARG -8.56 -2.61 1 50 HIS 1.37 3.42 1 51 GLU 5.25 2.99 1 52 PHE 1.21 -0.22 1 53 VAL 2.37 1.41 1 54 VAL -1.63 -1.74 1 55 HIS -0.72 3.10 1 56 THR -4.72 -2.16 1 59 SER 3.54 1.82 1 60 THR 2.32 0.57 1 61 ASP -4.43 -2.40 1 62 LEU -6.49 -2.66 1 64 PHE -3.52 -0.32 1 65 LYS 3.47 0.82 1 68 ARG -4.33 -1.32 1 69 ILE -3.45 -0.94 1 70 LYS 0.50 0.27 1 72 VAL 1.18 0.21 1 73 GLU 5.32 2.70 1 74 HIS 2.33 0.39 1 75 ILE 4.40 2.95 1 76 LEU 4.90 2.87 1 77 SER 7.09 5.83 1 78 VAL 5.05 2.98 1 79 LEU 1.05 1.78 1 80 HIS 1.54 2.26 1 81 LEU -1.13 -0.72 1 82 LEU 4.09 1.47 1 83 GLU 2.21 -0.95 1 84 ILE -1.41 0.33 1 85 THR -5.14 -1.25 1 86 ASN -5.28 -0.70 1 87 VAL -0.33 -0.29 1 88 THR 0.64 -0.92 1 89 ILE -1.96 -0.97 1 91 VAL 1.41 -0.33 1 92 ILE -1.29 0.24 1 94 ASN 1.67 -1.97 1 96 ILE -4.33 -4.06 1 99 LEU -0.70 -0.55 1 100 ASP -6.00 -2.14 1 102 SER 2.29 3.99 1 104 TRP 4.38 3.28 1 105 GLU 0.90 0.98 1 106 PHE 3.02 3.90 1 107 TYR 3.18 2.09 1 108 GLU 1.13 1.88 1 109 ALA 5.97 4.71 1 110 ILE 5.10 3.00 1 111 ARG 1.14 0.26 1 112 LYS -3.31 -0.02 1 113 ASN 2.40 2.66 1 114 ILE -4.07 -1.76 1 115 LEU 0.71 1.15 1 116 ASN -0.79 -0.74 1 117 GLN 0.17 0.61 1 118 ASN -3.05 -0.77 1 119 ARG -0.13 0.16 1 120 GLU -0.14 1.01 1 121 ILE -1.15 -1.77 1 122 ASP 2.02 1.99 1 123 TYR 1.23 0.71 1 124 PHE -2.21 -1.75 1 125 VAL 2.77 1.80 1 126 VAL -1.14 0.89 1 127 GLU -3.60 -1.16 1 128 GLU -4.32 -1.22 1 130 ILE -3.75 -0.94 1 131 ILE -3.01 -1.44 1 132 VAL -5.57 -1.64 1 133 GLU -2.85 0.14 1 134 ASP 2.36 0.69 1 135 GLU -2.99 -1.64 1 137 ARG -3.97 0.18 1 138 LEU -3.72 -0.62 1 139 ILE -5.91 -2.17 1 140 LYS -8.29 -2.91 1 141 ALA -3.91 -0.55 1 142 GLU -1.30 -0.46 1 144 SER 0.98 0.60 1 145 ASP -4.43 -2.77 1 146 THR 2.20 1.06 1 147 LEU -4.04 -0.69 1 149 VAL -1.59 -0.61 1 150 THR -7.03 -1.44 1 151 TYR -6.23 -2.33 1 152 GLU -3.70 -1.35 1 154 GLU -2.38 -1.26 1 155 PHE -2.33 -1.86 1 157 ASN 2.97 1.55 1 158 PHE 1.83 1.34 1 159 LEU -0.71 -0.72 1 161 ARG -6.93 -0.97 1 162 GLN -5.13 -1.22 1 163 LYS -3.11 0.98 1 164 PHE -0.90 -0.01 1 165 THR -4.72 -1.22 1 166 PHE -4.21 -2.61 1 167 VAL 0.89 1.50 1 168 GLU -0.24 -0.94 1 170 ASN 7.20 5.51 1 171 GLU 4.66 3.27 1 172 GLU 0.28 0.45 1 173 GLU -1.74 0.46 1 174 ILE 3.37 2.41 1 175 VAL -0.22 -0.14 1 176 LEU -1.35 -0.65 1 177 ALA 1.16 0.48 1 178 ARG 2.06 1.80 1 179 THR -7.19 -3.66 1 180 PHE -5.13 -2.85 1 181 ALA -0.66 -2.08 1 182 PHE 6.48 2.96 1 183 ASP 4.11 1.83 1 184 TRP -1.24 0.15 1 185 GLU 5.90 4.72 1 186 ILE 3.81 2.99 1 187 GLU 2.95 4.31 1 188 HIS 4.18 3.51 1 189 ILE 3.66 2.49 1 190 LYS 3.94 3.07 1 191 LYS 1.20 -0.91 1 192 VAL -3.06 -2.34 1 194 LEU 4.82 3.66 1 196 LYS -3.84 -1.80 1 199 SER 3.34 1.36 1 200 LEU -3.29 -1.24 1 202 ASN -2.85 0.32 1 203 THR 0.14 -0.83 1 205 VAL -4.62 -1.72 1 206 LEU 3.93 3.39 1 208 LYS -2.24 -0.86 1 209 ASP -3.50 -1.55 1 210 LYS -1.35 -0.98 1 211 VAL 3.18 3.15 1 212 TYR 4.22 1.75 1 213 ASN -0.22 0.17 1 217 LEU -7.49 -3.20 1 222 GLU 4.88 3.32 1 224 VAL 4.73 3.90 1 225 ARG 6.01 5.23 1 226 HIS 7.06 5.50 1 228 VAL 5.19 4.36 1 229 PHE 3.10 3.26 1 230 ASP 5.00 3.24 1 231 LEU 5.63 5.03 1 232 ILE 3.93 3.24 1 234 ASP 0.64 1.68 1 236 TYR 1.92 0.47 1 237 LEU 2.74 2.23 1 238 LEU -3.37 -0.55 1 240 SER -3.15 -0.40 1 242 VAL -3.34 -1.98 1 245 LYS -4.98 -1.18 1 246 PHE -3.40 -1.20 1 247 TYR -5.06 -3.67 1 248 SER -2.53 -2.45 1 249 PHE 4.77 1.77 1 250 ARG 5.69 4.59 1 253 HIS 5.10 3.44 1 254 SER 2.13 1.92 1 255 LEU 3.50 2.49 1 256 ASN 5.84 4.23 1 257 VAL 5.14 4.27 1 258 LYS 5.66 3.28 1 259 LEU 6.74 5.17 1 260 VAL 4.83 3.98 1 261 LYS 2.88 2.38 1 262 GLU 3.22 2.71 1 263 LEU 2.68 1.84 1 264 ALA 2.83 2.52 1 265 LYS 1.22 0.62 1 266 LYS 0.98 0.75 1 267 GLN 1.21 0.61 1 268 LYS 0.11 0.19 1 269 LEU -0.12 -0.29 1 270 THR -0.01 -0.09 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17416_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.56 _LACS_plot.Line_1_terminator_val_y_1 5.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 9.18 _LACS_plot.Line_2_terminator_val_y_2 -2.43 _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 219 TYR -1.15 -2.61 0 235 LEU -2.73 -1.82 0 71 THR 5.54 -5.55 0 98 ILE 7.50 -6.45 0 221 ASN 9.18 -0.99 0 10 LYS 0.57 -0.28 1 11 LEU -5.53 3.51 1 12 SER -3.82 2.01 1 13 PHE -5.70 4.50 1 14 GLU -7.08 5.15 1 16 VAL -2.64 0.70 1 18 ILE 4.75 -2.21 1 19 HIS 1.36 2.94 1 20 THR 0.49 1.03 1 22 GLU -4.72 2.35 1 23 TYR 1.43 -0.03 1 24 SER -4.46 2.95 1 25 LYS -4.94 3.13 1 26 LEU -6.82 4.45 1 27 ILE -2.79 2.52 1 28 ILE 0.63 -0.97 1 29 HIS -3.44 3.84 1 31 GLU -8.09 5.15 1 32 LYS -1.43 0.83 1 33 GLU 1.78 -0.53 1 35 THR 4.90 -0.86 1 37 ILE 0.74 -3.45 1 38 ARG -4.59 2.29 1 39 PHE -2.41 1.17 1 40 PHE -5.31 3.18 1 41 LYS -4.69 3.19 1 42 ASN 2.93 -2.32 1 44 VAL -2.78 1.60 1 45 TYR -1.02 1.16 1 46 ILE -2.65 2.05 1 48 ALA -0.82 -2.05 1 49 ARG -8.56 5.95 1 50 HIS 1.37 2.05 1 51 GLU 5.25 -2.26 1 52 PHE 1.21 -1.43 1 53 VAL 2.37 -0.96 1 54 VAL -1.63 -0.11 1 55 HIS -0.72 3.82 1 56 THR -4.72 2.56 1 59 SER 3.54 -1.72 1 60 THR 2.32 -1.75 1 61 ASP -4.43 2.03 1 62 LEU -6.49 3.83 1 64 PHE -3.52 3.20 1 65 LYS 3.47 -2.65 1 68 ARG -4.33 3.01 1 69 ILE -3.45 2.51 1 70 LYS 0.50 -0.23 1 72 VAL 1.18 -0.97 1 73 GLU 5.32 -2.62 1 74 HIS 2.33 -1.94 1 75 ILE 4.40 -1.45 1 76 LEU 4.90 -2.03 1 77 SER 7.09 -1.26 1 78 VAL 5.05 -2.07 1 79 LEU 1.05 0.73 1 80 HIS 1.54 0.72 1 81 LEU -1.13 0.41 1 82 LEU 4.09 -2.62 1 83 GLU 2.21 -3.16 1 84 ILE -1.41 1.74 1 85 THR -5.14 3.89 1 86 ASN -5.28 4.58 1 87 VAL -0.33 0.04 1 88 THR 0.64 -1.56 1 89 ILE -1.96 0.99 1 91 VAL 1.41 -1.74 1 92 ILE -1.29 1.53 1 94 ASN 1.67 -3.64 1 96 ILE -4.33 0.27 1 99 LEU -0.70 0.15 1 100 ASP -6.00 3.86 1 102 SER 2.29 1.70 1 104 TRP 4.38 -1.10 1 105 GLU 0.90 0.08 1 106 PHE 3.02 0.88 1 107 TYR 3.18 -1.09 1 108 GLU 1.13 0.75 1 109 ALA 5.97 -1.26 1 110 ILE 5.10 -2.10 1 111 ARG 1.14 -0.88 1 112 LYS -3.31 3.29 1 113 ASN 2.40 0.26 1 114 ILE -4.07 2.31 1 115 LEU 0.71 0.44 1 116 ASN -0.79 0.05 1 117 GLN 0.17 0.44 1 118 ASN -3.05 2.28 1 119 ARG -0.13 0.29 1 120 GLU -0.14 1.15 1 121 ILE -1.15 -0.62 1 122 ASP 2.02 -0.03 1 123 TYR 1.23 -0.52 1 124 PHE -2.21 0.46 1 125 VAL 2.77 -0.97 1 126 VAL -1.14 2.03 1 127 GLU -3.60 2.44 1 128 GLU -4.32 3.10 1 130 ILE -3.75 2.81 1 131 ILE -3.01 1.57 1 132 VAL -5.57 3.93 1 133 GLU -2.85 2.99 1 134 ASP 2.36 -1.67 1 135 GLU -2.99 1.35 1 137 ARG -3.97 4.15 1 138 LEU -3.72 3.10 1 139 ILE -5.91 3.74 1 140 LYS -8.29 5.38 1 141 ALA -3.91 3.36 1 142 GLU -1.30 0.84 1 144 SER 0.98 -0.38 1 145 ASP -4.43 1.66 1 146 THR 2.20 -1.14 1 147 LEU -4.04 3.35 1 149 VAL -1.59 0.98 1 150 THR -7.03 5.59 1 151 TYR -6.23 3.90 1 152 GLU -3.70 2.35 1 154 GLU -2.38 1.12 1 155 PHE -2.33 0.47 1 157 ASN 2.97 -1.42 1 158 PHE 1.83 -0.49 1 159 LEU -0.71 -0.01 1 161 ARG -6.93 5.96 1 162 GLN -5.13 3.91 1 163 LYS -3.11 4.09 1 164 PHE -0.90 0.89 1 165 THR -4.72 3.50 1 166 PHE -4.21 1.60 1 167 VAL 0.89 0.61 1 168 GLU -0.24 -0.70 1 170 ASN 7.20 -1.69 1 171 GLU 4.66 -1.39 1 172 GLU 0.28 0.17 1 173 GLU -1.74 2.20 1 174 ILE 3.37 -0.96 1 175 VAL -0.22 0.08 1 176 LEU -1.35 0.70 1 177 ALA 1.16 -0.68 1 178 ARG 2.06 -0.26 1 179 THR -7.19 3.53 1 180 PHE -5.13 2.28 1 181 ALA -0.66 -1.42 1 182 PHE 6.48 -3.52 1 183 ASP 4.11 -2.28 1 184 TRP -1.24 1.39 1 185 GLU 5.90 -1.18 1 186 ILE 3.81 -0.82 1 187 GLU 2.95 1.36 1 188 HIS 4.18 -0.67 1 189 ILE 3.66 -1.17 1 190 LYS 3.94 -0.87 1 191 LYS 1.20 -2.11 1 192 VAL -3.06 0.72 1 194 LEU 4.82 -1.16 1 196 LYS -3.84 2.04 1 199 SER 3.34 -1.98 1 200 LEU -3.29 2.05 1 202 ASN -2.85 3.17 1 203 THR 0.14 -0.97 1 205 VAL -4.62 2.90 1 206 LEU 3.93 -0.54 1 208 LYS -2.24 1.38 1 209 ASP -3.50 1.95 1 210 LYS -1.35 0.37 1 211 VAL 3.18 -0.03 1 212 TYR 4.22 -2.47 1 213 ASN -0.22 0.39 1 217 LEU -7.49 4.29 1 222 GLU 4.88 -1.56 1 224 VAL 4.73 -0.83 1 225 ARG 6.01 -0.78 1 226 HIS 7.06 -1.56 1 228 VAL 5.19 -0.83 1 229 PHE 3.10 0.16 1 230 ASP 5.00 -1.76 1 231 LEU 5.63 -0.60 1 232 ILE 3.93 -0.69 1 234 ASP 0.64 1.04 1 236 TYR 1.92 -1.45 1 237 LEU 2.74 -0.51 1 238 LEU -3.37 2.82 1 240 SER -3.15 2.75 1 242 VAL -3.34 1.36 1 245 LYS -4.98 3.80 1 246 PHE -3.40 2.20 1 247 TYR -5.06 1.39 1 248 SER -2.53 0.08 1 249 PHE 4.77 -3.00 1 250 ARG 5.69 -1.10 1 253 HIS 5.10 -1.66 1 254 SER 2.13 -0.21 1 255 LEU 3.50 -1.01 1 256 ASN 5.84 -1.61 1 257 VAL 5.14 -0.87 1 258 LYS 5.66 -2.38 1 259 LEU 6.74 -1.57 1 260 VAL 4.83 -0.85 1 261 LYS 2.88 -0.50 1 262 GLU 3.22 -0.51 1 263 LEU 2.68 -0.84 1 264 ALA 2.83 -0.31 1 265 LYS 1.22 -0.60 1 266 LYS 0.98 -0.23 1 267 GLN 1.21 -0.60 1 268 LYS 0.11 0.08 1 269 LEU -0.12 -0.17 1 270 THR -0.01 -0.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17416_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.56 _LACS_plot.Line_1_terminator_val_y_1 1.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 9.18 _LACS_plot.Line_2_terminator_val_y_2 -0.96 _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 79 LEU 1.05 -1.25 0 149 VAL -1.59 1.49 0 180 PHE -5.13 -0.56 0 10 LYS 0.57 0.51 1 11 LEU -5.53 0.33 1 12 SER -3.82 1.12 1 13 PHE -5.70 0.29 1 14 GLU -7.08 1.00 1 16 VAL -2.64 0.43 1 18 ILE 4.75 -0.81 1 19 HIS 1.36 0.19 1 20 THR 0.49 -0.27 1 22 GLU -4.72 0.12 1 23 TYR 1.43 -0.18 1 24 SER -4.46 0.55 1 25 LYS -4.94 0.76 1 26 LEU -6.82 1.43 1 27 ILE -2.79 0.67 1 28 ILE 0.63 0.42 1 29 HIS -3.44 -0.14 1 31 GLU -8.09 0.52 1 32 LYS -1.43 -0.24 1 33 GLU 1.78 -0.31 1 35 THR 4.90 -0.47 1 37 ILE 0.74 0.33 1 38 ARG -4.59 0.52 1 39 PHE -2.41 0.77 1 40 PHE -5.31 0.81 1 41 LYS -4.69 0.32 1 42 ASN 2.93 -0.50 1 44 VAL -2.78 0.07 1 45 TYR -1.02 0.75 1 46 ILE -2.65 -0.39 1 48 ALA -0.82 0.18 1 49 ARG -8.56 0.82 1 50 HIS 1.37 -0.63 1 51 GLU 5.25 -0.59 1 52 PHE 1.21 -0.01 1 53 VAL 2.37 0.14 1 54 VAL -1.63 0.60 1 55 HIS -0.72 0.02 1 56 THR -4.72 0.79 1 59 SER 3.54 -0.83 1 60 THR 2.32 0.11 1 61 ASP -4.43 0.83 1 62 LEU -6.49 1.20 1 64 PHE -3.52 0.33 1 65 LYS 3.47 -0.76 1 68 ARG -4.33 0.87 1 69 ILE -3.45 -0.29 1 70 LYS 0.50 0.10 1 71 THR 5.54 -0.19 1 72 VAL 1.18 -0.03 1 73 GLU 5.32 -0.13 1 74 HIS 2.33 -0.36 1 75 ILE 4.40 -0.30 1 76 LEU 4.90 -0.97 1 77 SER 7.09 -0.54 1 78 VAL 5.05 -0.45 1 80 HIS 1.54 -0.33 1 81 LEU -1.13 0.04 1 82 LEU 4.09 -0.98 1 83 GLU 2.21 -0.23 1 84 ILE -1.41 0.13 1 85 THR -5.14 0.67 1 86 ASN -5.28 0.52 1 87 VAL -0.33 0.82 1 88 THR 0.64 0.41 1 89 ILE -1.96 0.54 1 91 VAL 1.41 0.21 1 92 ILE -1.29 0.09 1 94 ASN 1.67 -0.35 1 96 ILE -4.33 0.37 1 98 ILE 7.50 -0.46 1 99 LEU -0.70 0.20 1 100 ASP -6.00 0.41 1 102 SER 2.29 -0.42 1 104 TRP 4.38 -0.66 1 105 GLU 0.90 -0.30 1 106 PHE 3.02 -0.77 1 107 TYR 3.18 -0.80 1 108 GLU 1.13 -0.16 1 109 ALA 5.97 -0.67 1 110 ILE 5.10 -0.49 1 111 ARG 1.14 0.03 1 112 LYS -3.31 0.25 1 113 ASN 2.40 -0.17 1 114 ILE -4.07 0.33 1 115 LEU 0.71 0.08 1 116 ASN -0.79 0.11 1 117 GLN 0.17 0.24 1 118 ASN -3.05 0.07 1 119 ARG -0.13 0.13 1 120 GLU -0.14 -0.42 1 121 ILE -1.15 0.25 1 122 ASP 2.02 -0.29 1 123 TYR 1.23 -0.18 1 124 PHE -2.21 0.62 1 125 VAL 2.77 -0.27 1 126 VAL -1.14 0.00 1 127 GLU -3.60 0.17 1 128 GLU -4.32 0.41 1 130 ILE -3.75 0.97 1 131 ILE -3.01 0.43 1 132 VAL -5.57 0.89 1 133 GLU -2.85 0.07 1 134 ASP 2.36 -0.39 1 135 GLU -2.99 0.46 1 137 ARG -3.97 1.02 1 138 LEU -3.72 1.44 1 139 ILE -5.91 1.19 1 140 LYS -8.29 0.85 1 141 ALA -3.91 -0.13 1 142 GLU -1.30 -0.17 1 144 SER 0.98 -0.13 1 145 ASP -4.43 0.17 1 146 THR 2.20 0.77 1 147 LEU -4.04 1.02 1 150 THR -7.03 0.79 1 151 TYR -6.23 1.02 1 152 GLU -3.70 0.19 1 154 GLU -2.38 0.22 1 155 PHE -2.33 0.24 1 157 ASN 2.97 -0.10 1 158 PHE 1.83 -0.49 1 159 LEU -0.71 0.82 1 161 ARG -6.93 0.72 1 162 GLN -5.13 1.51 1 163 LYS -3.11 0.13 1 164 PHE -0.90 0.59 1 165 THR -4.72 0.08 1 166 PHE -4.21 0.09 1 167 VAL 0.89 -0.44 1 168 GLU -0.24 0.74 1 170 ASN 7.20 -0.24 1 171 GLU 4.66 -0.43 1 172 GLU 0.28 -0.15 1 173 GLU -1.74 0.30 1 174 ILE 3.37 -0.69 1 175 VAL -0.22 0.20 1 176 LEU -1.35 0.12 1 177 ALA 1.16 -0.54 1 178 ARG 2.06 -1.23 1 179 THR -7.19 1.21 1 181 ALA -0.66 0.36 1 182 PHE 6.48 -0.99 1 183 ASP 4.11 0.07 1 184 TRP -1.24 0.23 1 185 GLU 5.90 -0.72 1 186 ILE 3.81 -0.33 1 187 GLU 2.95 -0.34 1 188 HIS 4.18 -0.61 1 189 ILE 3.66 0.17 1 190 LYS 3.94 -0.22 1 191 LYS 1.20 0.28 1 192 VAL -3.06 0.53 1 194 LEU 4.82 -0.54 1 196 LYS -3.84 -0.38 1 199 SER 3.34 0.43 1 200 LEU -3.29 -0.23 1 202 ASN -2.85 0.12 1 203 THR 0.14 0.54 1 205 VAL -4.62 0.70 1 206 LEU 3.93 0.15 1 208 LYS -2.24 0.26 1 209 ASP -3.50 0.11 1 210 LYS -1.35 0.43 1 211 VAL 3.18 -0.48 1 212 TYR 4.22 -0.46 1 213 ASN -0.22 -0.29 1 217 LEU -7.49 0.16 1 219 TYR -1.15 0.50 1 221 ASN 9.18 -0.92 1 222 GLU 4.88 -0.18 1 224 VAL 4.73 -0.68 1 225 ARG 6.01 -0.90 1 226 HIS 7.06 -0.66 1 228 VAL 5.19 -0.90 1 229 PHE 3.10 -0.57 1 230 ASP 5.00 -0.26 1 231 LEU 5.63 -0.84 1 232 ILE 3.93 -0.18 1 234 ASP 0.64 -0.52 1 235 LEU -2.73 0.02 1 236 TYR 1.92 0.04 1 237 LEU 2.74 -0.20 1 238 LEU -3.37 0.24 1 240 SER -3.15 1.17 1 242 VAL -3.34 1.25 1 245 LYS -4.98 1.08 1 246 PHE -3.40 0.83 1 247 TYR -5.06 0.70 1 248 SER -2.53 0.48 1 249 PHE 4.77 -0.64 1 250 ARG 5.69 -0.34 1 253 HIS 5.10 -0.33 1 254 SER 2.13 -0.22 1 255 LEU 3.50 -0.62 1 256 ASN 5.84 -0.57 1 257 VAL 5.14 -0.38 1 258 LYS 5.66 -0.36 1 259 LEU 6.74 -0.86 1 260 VAL 4.83 -1.10 1 261 LYS 2.88 -0.23 1 262 GLU 3.22 -0.25 1 263 LEU 2.68 -0.17 1 264 ALA 2.83 -0.18 1 265 LYS 1.22 -0.04 1 266 LYS 0.98 0.04 1 267 GLN 1.21 0.00 1 268 LYS 0.11 0.14 1 269 LEU -0.12 0.03 1 270 THR -0.01 -0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17416_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.56 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 1.93 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 187 GLU 2.95 5.44 0 19 HIS 1.36 5.25 0 79 LEU 1.05 5.44 0 10 LYS 0.57 0.21 1 11 LEU -5.53 -2.25 1 12 SER -3.82 -1.78 1 13 PHE -5.70 -1.71 1 14 GLU -7.08 -2.90 1 16 VAL -2.64 0.22 1 18 ILE 4.75 -1.63 1 20 THR 0.49 3.38 1 22 GLU -4.72 -0.37 1 23 TYR 1.43 -0.45 1 24 SER -4.46 -3.44 1 25 LYS -4.94 -2.90 1 26 LEU -6.82 -1.47 1 27 ILE -2.79 -1.53 1 28 ILE 0.63 -2.31 1 31 GLU -8.09 -1.34 1 32 LYS -1.43 -0.37 1 33 GLU 1.78 0.80 1 35 THR 4.90 1.14 1 37 ILE 0.74 0.22 1 38 ARG -4.59 -2.41 1 39 PHE -2.41 -0.55 1 40 PHE -5.31 -2.69 1 41 LYS -4.69 -1.54 1 42 ASN 2.93 -0.63 1 44 VAL -2.78 -1.63 1 45 TYR -1.02 0.04 1 48 ALA -0.82 0.18 1 49 ARG -8.56 -1.53 1 50 HIS 1.37 2.03 1 51 GLU 5.25 0.31 1 52 PHE 1.21 -1.33 1 53 VAL 2.37 1.39 1 54 VAL -1.63 -0.65 1 55 HIS -0.72 -1.67 1 56 THR -4.72 -2.17 1 59 SER 3.54 2.21 1 60 THR 2.32 -1.69 1 61 ASP -4.43 0.12 1 62 LEU -6.49 -1.18 1 64 PHE -3.52 -1.52 1 68 ARG -4.33 -1.24 1 69 ILE -3.45 -2.31 1 70 LYS 0.50 -0.57 1 71 THR 5.54 0.65 1 72 VAL 1.18 1.69 1 74 HIS 2.33 0.02 1 75 ILE 4.40 0.68 1 76 LEU 4.90 2.51 1 77 SER 7.09 0.81 1 78 VAL 5.05 -0.30 1 80 HIS 1.54 1.65 1 81 LEU -1.13 -3.12 1 82 LEU 4.09 -1.83 1 83 GLU 2.21 0.71 1 84 ILE -1.41 -1.68 1 85 THR -5.14 -1.89 1 86 ASN -5.28 -2.60 1 87 VAL -0.33 -0.90 1 88 THR 0.64 -1.93 1 89 ILE -1.96 -1.63 1 91 VAL 1.41 -0.95 1 92 ILE -1.29 -0.53 1 94 ASN -4.33 0.03 1 98 ILE 7.50 -1.27 1 99 LEU -0.70 -0.37 1 100 ASP -6.00 1.14 1 102 SER 2.29 -0.06 1 104 TRP 4.38 4.11 1 105 GLU 0.90 0.63 1 106 PHE 3.02 -0.06 1 107 TYR 3.18 1.48 1 108 GLU 1.13 2.13 1 109 ALA 5.97 1.97 1 110 ILE 5.10 1.10 1 111 ARG 1.14 -0.47 1 112 LYS -3.31 -1.41 1 113 ASN 2.40 -1.53 1 114 ILE -4.07 -2.54 1 115 LEU 0.71 0.34 1 116 ASN -0.79 -1.33 1 117 GLN 0.17 -0.24 1 118 ASN -3.05 -1.92 1 119 ARG -0.13 -0.17 1 120 GLU -0.14 -0.27 1 121 ILE -1.15 -1.34 1 122 ASP 2.02 0.53 1 123 TYR 1.23 -1.61 1 124 PHE -2.21 -0.46 1 125 VAL 2.77 0.32 1 126 VAL -1.14 -0.76 1 127 GLU -4.32 -3.48 1 130 ILE -3.75 -0.85 1 131 ILE -3.01 -2.60 1 132 VAL -5.57 -1.29 1 133 GLU -2.85 -0.85 1 134 ASP 2.36 -0.27 1 135 GLU -2.99 -0.95 1 137 ARG -3.97 -3.32 1 138 LEU -3.72 -3.77 1 139 ILE -5.91 -2.03 1 140 LYS -8.29 -2.15 1 141 ALA -1.30 -1.68 1 144 SER 0.98 -0.65 1 145 ASP -4.43 -0.71 1 146 THR 2.20 -3.12 1 147 LEU -4.04 -2.41 1 149 VAL -1.59 -1.88 1 150 THR -7.03 -3.28 1 151 TYR -6.23 -3.68 1 152 GLU -3.70 -2.61 1 154 GLU -2.38 0.92 1 155 PHE -2.33 1.42 1 157 ASN 2.97 -0.54 1 158 PHE 1.83 0.68 1 159 LEU -0.71 0.22 1 161 ARG -6.93 -2.01 1 162 GLN -5.13 -1.83 1 163 LYS -3.11 -3.27 1 164 PHE -0.90 -2.37 1 165 THR -4.72 -3.08 1 166 PHE -4.21 -2.89 1 167 VAL 0.89 -1.34 1 168 GLU -0.24 2.01 1 170 ASN 7.20 1.58 1 171 GLU 4.66 0.31 1 172 GLU 0.28 0.31 1 173 GLU -1.74 0.51 1 174 ILE 3.37 -2.51 1 175 VAL -0.22 -0.78 1 176 LEU -1.35 -0.11 1 177 ALA 1.16 -1.63 1 178 ARG 2.06 -4.21 1 179 THR -7.19 -4.54 1 180 PHE -5.13 -3.13 1 181 ALA -0.66 2.19 1 182 PHE 6.48 2.56 1 183 ASP 4.11 0.42 1 184 TRP -1.24 1.19 1 185 GLU 5.90 0.81 1 186 ILE 3.81 2.07 1 188 HIS 4.18 1.29 1 189 ILE 3.66 4.89 1 190 LYS 3.94 2.16 1 191 LYS 1.20 -0.08 1 192 VAL -3.06 -0.88 1 194 LEU 4.82 1.48 1 196 LYS 3.34 0.09 1 200 LEU -3.29 -4.32 1 202 ASN -2.85 -0.90 1 203 THR 0.14 -1.24 1 205 VAL -4.62 -1.57 1 206 LEU -2.24 -1.63 1 209 ASP -3.50 -2.61 1 210 LYS -1.35 -0.36 1 211 VAL 3.18 0.72 1 212 TYR -0.22 0.87 1 217 LEU -1.15 0.94 1 221 ASN 4.88 1.88 1 224 VAL 4.73 1.88 1 225 ARG 6.01 2.52 1 226 HIS 7.06 -0.36 1 228 VAL 5.19 1.79 1 229 PHE 3.10 0.61 1 230 ASP 5.00 -0.01 1 231 LEU 5.63 1.97 1 232 ILE 3.93 2.66 1 234 ASP 0.64 0.67 1 235 LEU -2.73 2.18 1 236 TYR 1.92 0.48 1 237 LEU 2.74 1.74 1 238 LEU -3.15 -0.27 1 242 VAL -3.34 -0.86 1 245 LYS -4.98 -0.55 1 246 PHE -3.40 -3.18 1 247 TYR -5.06 -3.24 1 248 SER -2.53 -1.13 1 249 PHE 4.77 -0.07 1 250 ARG 5.10 2.02 1 254 SER 2.13 -0.10 1 255 LEU 3.50 2.59 1 256 ASN 5.84 0.81 1 257 VAL 5.14 2.46 1 258 LYS 5.66 0.48 1 259 LEU 6.74 0.42 1 260 VAL 4.83 0.60 1 261 LYS 2.88 3.24 1 262 GLU 3.22 1.85 1 263 LEU 2.68 2.03 1 264 ALA 2.83 1.78 1 265 LYS 1.22 1.48 1 266 LYS 0.98 -0.06 1 267 GLN 1.21 0.21 1 268 LYS 0.11 0.19 1 269 LEU -0.12 -1.78 1 stop_ save_