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 bmr17479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.18 _LACS_plot.Line_1_terminator_val_y_1 -3.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 6.17 _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 22 MET -6.86 -0.28 0 10 ASN 0.18 0.19 1 11 GLN -0.26 0.03 1 12 ILE 0.32 -0.14 1 13 ARG -0.55 -0.68 1 14 LEU -0.37 -0.34 1 15 THR -0.77 -0.37 1 16 ASN 0.51 0.12 1 17 VAL -2.02 -1.19 1 18 ALA -4.38 -2.19 1 19 VAL -0.74 -0.63 1 20 VAL -0.33 -1.39 1 21 ARG -7.06 -1.98 1 23 LYS -1.94 -1.34 1 24 ARG -3.81 -1.01 1 25 ALA 2.13 0.19 1 27 LYS -4.30 -1.69 1 28 ARG -2.79 -0.70 1 29 PHE -5.11 -1.40 1 30 GLU -8.18 -2.59 1 31 ILE -4.34 -1.79 1 32 ALA -4.46 -2.40 1 34 TYR 1.10 0.97 1 35 LYS 2.42 2.47 1 36 ASN 2.99 1.67 1 37 LYS -2.84 -1.27 1 38 VAL 6.22 5.15 1 39 VAL 5.68 4.06 1 43 SER -0.07 0.29 1 45 VAL 2.13 1.33 1 46 GLU -2.33 -2.28 1 48 ASP -2.05 -1.35 1 49 LEU 2.33 2.43 1 50 ASP 3.12 2.37 1 51 GLU -0.45 -0.47 1 52 VAL 0.85 1.60 1 53 LEU -0.77 -1.18 1 54 GLN 4.44 2.45 1 55 THR -1.63 -2.92 1 56 HIS 0.84 -0.07 1 57 SER -0.29 0.47 1 58 VAL 0.55 -0.51 1 59 PHE -0.44 0.32 1 60 VAL 1.76 1.37 1 61 ASN -2.03 -1.04 1 62 VAL 4.85 3.60 1 63 SER 4.08 3.21 1 64 LYS -1.96 -1.13 1 66 GLN -1.02 -1.21 1 67 VAL 0.52 0.55 1 69 LYS -0.80 -0.73 1 70 LYS 5.63 4.39 1 71 GLU 4.62 3.11 1 72 ASP 3.16 2.57 1 73 LEU 5.25 2.77 1 74 ILE 4.56 3.80 1 75 SER 3.45 3.02 1 76 ALA -0.72 1.40 1 77 PHE -0.33 0.53 1 79 THR -2.17 -3.57 1 80 ASP -1.75 -2.15 1 81 ASP -0.05 -0.16 1 82 GLN 4.95 4.27 1 83 THR 7.91 5.98 1 84 GLU 2.65 1.73 1 85 ILE 5.74 4.31 1 87 LYS 5.58 4.39 1 88 GLN 4.66 3.64 1 89 ILE 5.76 4.54 1 90 LEU 3.01 2.85 1 91 THR 4.87 4.63 1 92 LYS -1.04 0.09 1 94 GLU -4.07 -2.05 1 95 VAL 1.39 0.68 1 96 GLN -1.06 -1.09 1 97 VAL -1.10 -0.84 1 98 SER -1.20 -0.27 1 99 ASP 1.08 1.49 1 100 LYS 2.00 1.58 1 101 GLU 0.88 0.87 1 102 ARG 2.08 1.55 1 103 HIS 1.58 2.42 1 104 THR 2.54 2.28 1 105 GLN 3.84 2.58 1 108 GLN 3.86 2.41 1 109 MET 3.24 3.95 1 110 PHE 4.32 4.60 1 111 ARG 4.47 2.47 1 112 ASP 3.69 3.36 1 113 ILE 5.07 4.53 1 114 ALA 2.42 2.50 1 115 THR 5.79 5.07 1 116 ILE 4.67 4.06 1 117 VAL 6.97 5.24 1 118 ALA 2.31 1.30 1 119 ASP 1.36 1.74 1 120 LYS -1.98 -0.89 1 122 VAL -6.48 -3.70 1 123 ASN -2.67 -3.22 1 125 GLU 1.69 1.93 1 126 THR -0.95 -0.96 1 127 LYS 5.72 1.37 1 128 ARG -3.78 -2.37 1 130 TYR -1.37 0.40 1 131 THR -3.98 -2.40 1 132 VAL 5.47 4.22 1 133 ILE 3.39 2.52 1 134 LEU 2.73 2.74 1 135 ILE 4.26 0.05 1 136 GLU 3.65 3.98 1 137 ARG 4.11 2.94 1 138 ALA 2.71 2.42 1 139 MET 2.21 3.91 1 141 ASP 3.43 2.95 1 142 ILE 1.48 0.27 1 143 HIS 3.61 0.50 1 144 TYR 3.14 3.14 1 145 SER -2.63 -2.75 1 146 VAL 1.36 0.53 1 147 LYS -2.77 -2.57 1 149 ASN 0.67 -0.64 1 150 LYS -5.55 -2.28 1 151 SER -1.80 -0.68 1 152 THR 5.63 3.83 1 153 LYS 4.96 3.85 1 154 GLN 4.11 2.93 1 155 GLN 3.93 4.09 1 156 ALA 3.23 2.54 1 157 LEU 4.14 2.83 1 158 GLU 3.07 2.31 1 159 VAL 6.56 4.50 1 160 ILE 6.10 5.78 1 161 LYS 4.41 3.50 1 162 GLN 3.08 2.99 1 163 LEU 3.40 2.11 1 164 LYS 3.45 2.90 1 165 GLU 0.78 0.72 1 166 LYS -3.35 -1.03 1 168 LYS 1.28 -1.27 1 169 ILE -0.67 -0.44 1 170 GLU -6.68 -2.65 1 171 ARG 0.41 -0.04 1 172 ALA -5.06 -0.73 1 173 HIS -4.17 -0.18 1 174 MET -2.88 -0.21 1 175 ARG -0.69 -1.31 1 176 LEU -5.56 -2.55 1 177 ARG -5.20 -2.34 1 178 PHE -6.00 -4.69 1 179 ILE 0.26 -0.09 1 180 LEU -4.57 -2.32 1 182 VAL 5.34 4.20 1 183 ASN 4.30 2.82 1 184 GLU 1.91 1.21 1 186 LYS 4.85 3.75 1 187 LYS 2.94 2.06 1 188 LEU 2.27 1.81 1 189 LYS 6.27 4.42 1 190 GLU 2.67 2.28 1 191 LYS 1.91 1.66 1 192 LEU 0.41 0.56 1 193 LYS -1.94 -0.81 1 195 LEU -3.42 -0.90 1 196 ILE 2.05 1.13 1 197 LYS -5.35 -1.51 1 198 VAL 1.73 0.67 1 199 ILE -0.18 1.13 1 200 GLU -1.77 -0.39 1 201 SER -4.46 -1.33 1 202 GLU -4.55 -0.67 1 203 ASP 0.26 0.19 1 204 TYR 3.07 2.82 1 206 GLN -3.64 -1.50 1 207 GLN -2.37 -1.40 1 208 LEU -5.25 -2.55 1 209 GLU -5.89 -1.79 1 210 ILE -0.55 -1.31 1 211 VAL -4.98 -2.29 1 213 LEU -5.89 -2.03 1 214 ILE 1.10 0.33 1 215 ASP 4.76 4.92 1 219 PHE 5.18 3.33 1 220 ARG 2.56 2.48 1 221 GLU 5.70 4.63 1 222 ILE 2.02 2.87 1 223 ASP 2.94 2.34 1 224 GLU 3.62 3.05 1 225 LEU 5.74 3.97 1 226 ILE 4.93 4.03 1 227 LYS 3.08 2.82 1 228 LYS 1.39 1.24 1 229 GLU -0.76 -0.81 1 230 THR 4.53 1.02 1 231 LYS 0.42 0.40 1 233 LYS -4.02 -1.24 1 235 SER -4.84 -0.94 1 236 LEU 2.17 0.04 1 238 VAL 2.28 1.44 1 239 LEU -0.44 -0.43 1 240 ASN -2.73 -2.06 1 241 LEU -4.25 -1.63 1 242 LYS 0.55 0.52 1 243 ASP -0.10 -0.47 1 244 VAL -1.09 -0.53 1 245 GLU 0.01 0.61 1 246 GLU 0.15 0.51 1 248 ASP -0.29 -0.17 1 249 GLU 0.01 -0.12 1 250 LYS 0.03 -0.21 1 251 PHE -0.43 1.05 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.18 _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 -1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 -1.73 _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 22 MET -6.86 6.58 0 10 ASN 0.18 0.01 1 11 GLN -0.26 0.29 1 12 ILE 0.32 -0.46 1 13 ARG -0.55 -0.13 1 14 LEU -0.37 0.03 1 15 THR -0.77 0.40 1 16 ASN 0.51 -0.39 1 17 VAL -2.02 0.83 1 18 ALA -4.38 2.19 1 19 VAL -0.74 0.11 1 20 VAL -0.33 -1.06 1 21 ARG -7.06 5.08 1 23 LYS -1.94 0.60 1 24 ARG -3.81 2.80 1 25 ALA 2.13 -1.94 1 27 LYS -4.30 2.61 1 28 ARG -2.79 2.09 1 29 PHE -5.11 3.71 1 30 GLU -8.18 5.59 1 31 ILE -4.34 2.55 1 32 ALA -4.46 2.06 1 34 TYR 1.10 -0.13 1 35 LYS 2.42 0.05 1 36 ASN 2.99 -1.32 1 37 LYS -2.84 1.57 1 38 VAL 6.22 -1.07 1 39 VAL 5.68 -1.62 1 43 SER -0.07 0.36 1 45 VAL 2.13 -0.80 1 46 GLU -2.33 0.05 1 48 ASP -2.05 0.70 1 49 LEU 2.33 0.10 1 50 ASP 3.12 -0.75 1 51 GLU -0.45 -0.02 1 52 VAL 0.85 0.75 1 53 LEU -0.77 -0.41 1 54 GLN 4.44 -1.99 1 55 THR -1.63 -1.29 1 56 HIS 0.84 -0.91 1 57 SER -0.29 0.76 1 58 VAL 0.55 -1.06 1 59 PHE -0.44 0.76 1 60 VAL 1.76 -0.39 1 61 ASN -2.03 0.99 1 62 VAL 4.85 -1.25 1 63 SER 4.08 -0.87 1 64 LYS -1.96 0.83 1 66 GLN -1.02 -0.19 1 67 VAL 0.52 0.03 1 69 LYS -0.80 0.07 1 70 LYS 5.63 -1.24 1 71 GLU 4.62 -1.51 1 72 ASP 3.16 -0.59 1 73 LEU 5.25 -2.48 1 74 ILE 4.56 -0.76 1 75 SER 3.45 -0.43 1 76 ALA -0.72 2.12 1 77 PHE -0.33 0.86 1 79 THR -2.17 -1.40 1 80 ASP -1.75 -0.40 1 81 ASP -0.05 -0.11 1 82 GLN 4.95 -0.68 1 83 THR 7.91 -1.93 1 84 GLU 2.65 -0.92 1 85 ILE 5.74 -1.43 1 87 LYS 5.58 -1.19 1 88 GLN 4.66 -1.02 1 89 ILE 5.76 -1.22 1 90 LEU 3.01 -0.16 1 91 THR 4.87 -0.24 1 92 LYS -1.04 1.13 1 94 GLU -4.07 2.02 1 95 VAL 1.39 -0.71 1 96 GLN -1.06 -0.03 1 97 VAL -1.10 0.26 1 98 SER -1.20 0.93 1 99 ASP 1.08 0.41 1 100 LYS 2.00 -0.42 1 101 GLU 0.88 -0.01 1 102 ARG 2.08 -0.53 1 103 HIS 1.58 0.84 1 104 THR 2.54 -0.26 1 105 GLN 3.84 -1.26 1 108 GLN 3.86 -1.45 1 109 MET 3.24 0.71 1 110 PHE 4.32 0.28 1 111 ARG 4.47 -2.00 1 112 ASP 3.69 -0.33 1 113 ILE 5.07 -0.54 1 114 ALA 2.42 0.08 1 115 THR 5.79 -0.72 1 116 ILE 4.67 -0.61 1 117 VAL 6.97 -1.73 1 118 ALA 2.31 -1.01 1 119 ASP 1.36 0.38 1 120 LYS -1.98 1.09 1 122 VAL -6.48 2.78 1 123 ASN -2.67 -0.55 1 125 GLU 1.69 0.24 1 126 THR -0.95 -0.01 1 127 LYS 5.72 -4.35 1 128 ARG -3.78 1.41 1 130 TYR -1.37 1.77 1 131 THR -3.98 1.58 1 132 VAL 5.47 -1.25 1 133 ILE 3.39 -0.87 1 134 LEU 2.73 0.01 1 135 ILE 4.26 -4.21 1 136 GLU 3.65 0.33 1 137 ARG 4.11 -1.17 1 138 ALA 2.71 -0.29 1 139 MET 2.21 1.70 1 141 ASP 3.43 -0.48 1 142 ILE 1.48 -1.21 1 143 HIS 3.61 -3.11 1 144 TYR 3.14 0.00 1 145 SER -2.63 -0.12 1 146 VAL 1.36 -0.83 1 147 LYS -2.77 0.20 1 149 ASN 0.67 -1.31 1 150 LYS -5.55 3.27 1 151 SER -1.80 1.12 1 152 THR 5.63 -1.80 1 153 LYS 4.96 -1.11 1 154 GLN 4.11 -1.18 1 155 GLN 3.93 0.16 1 156 ALA 3.23 -0.69 1 157 LEU 4.14 -1.31 1 158 GLU 3.07 -0.76 1 159 VAL 6.56 -2.06 1 160 ILE 6.10 -0.32 1 161 LYS 4.41 -0.91 1 162 GLN 3.08 -0.09 1 163 LEU 3.40 -1.29 1 164 LYS 3.45 -0.55 1 165 GLU 0.78 -0.06 1 166 LYS -3.35 2.32 1 168 LYS 1.28 -2.55 1 169 ILE -0.67 0.23 1 170 GLU -6.68 4.03 1 171 ARG 0.41 -0.45 1 172 ALA -5.06 4.33 1 173 HIS -4.17 3.99 1 174 MET -2.88 2.67 1 175 ARG -0.69 -0.62 1 176 LEU -5.56 3.01 1 177 ARG -5.20 2.86 1 178 PHE -6.00 1.31 1 179 ILE 0.26 -0.35 1 180 LEU -4.57 2.25 1 182 VAL 5.34 -1.14 1 183 ASN 4.30 -1.48 1 184 GLU 1.91 -0.70 1 186 LYS 4.85 -1.10 1 187 LYS 2.94 -0.88 1 188 LEU 2.27 -0.46 1 189 LYS 6.27 -1.85 1 190 GLU 2.67 -0.39 1 191 LYS 1.91 -0.25 1 192 LEU 0.41 0.15 1 193 LYS -1.94 1.13 1 195 LEU -3.42 2.52 1 196 ILE 2.05 -0.92 1 197 LYS -5.35 3.84 1 198 VAL 1.73 -1.06 1 199 ILE -0.18 1.31 1 200 GLU -1.77 1.38 1 201 SER -4.46 3.13 1 202 GLU -4.55 3.88 1 203 ASP 0.26 -0.07 1 204 TYR 3.07 -0.25 1 206 GLN -3.64 2.14 1 207 GLN -2.37 0.97 1 208 LEU -5.25 2.70 1 209 GLU -5.89 4.10 1 210 ILE -0.55 -0.76 1 211 VAL -4.98 2.69 1 213 LEU -5.89 3.86 1 214 ILE 1.10 -0.77 1 215 ASP 4.76 0.16 1 219 PHE 5.18 -1.85 1 220 ARG 2.56 -0.08 1 221 GLU 5.70 -1.07 1 222 ILE 2.02 0.85 1 223 ASP 2.94 -0.60 1 224 GLU 3.62 -0.57 1 225 LEU 5.74 -1.77 1 226 ILE 4.93 -0.90 1 227 LYS 3.08 -0.26 1 228 LYS 1.39 -0.15 1 229 GLU -0.76 -0.05 1 230 THR 4.53 -3.51 1 231 LYS 0.42 -0.02 1 233 LYS -4.02 2.78 1 235 SER -4.84 3.90 1 236 LEU 2.17 -2.13 1 238 VAL 2.28 -0.84 1 239 LEU -0.44 0.01 1 240 ASN -2.73 0.67 1 241 LEU -4.25 2.62 1 242 LYS 0.55 -0.03 1 243 ASP -0.10 -0.37 1 244 VAL -1.09 0.56 1 245 GLU 0.01 0.60 1 246 GLU 0.15 0.36 1 248 ASP -0.29 0.12 1 249 GLU 0.01 -0.13 1 250 LYS 0.03 -0.24 1 251 PHE -0.43 1.48 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.18 _LACS_plot.Line_1_terminator_val_y_1 0.64 _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 0.05 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 -0.97 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 THR 7.91 -0.16 0 210 ILE -0.55 1.02 0 10 ASN 0.18 -0.21 1 11 GLN -0.26 -0.17 1 12 ILE 0.32 -0.23 1 13 ARG -0.55 -0.11 1 14 LEU -0.37 -0.17 1 15 THR -0.77 -0.15 1 16 ASN 0.51 -0.26 1 17 VAL -2.02 -0.01 1 18 ALA -4.38 0.23 1 19 VAL -0.74 0.43 1 20 VAL -0.33 0.43 1 21 ARG -7.06 1.05 1 22 MET -6.86 0.26 1 23 LYS -1.94 0.88 1 24 ARG -3.81 -0.03 1 25 ALA 2.13 -0.45 1 27 LYS -4.30 -0.02 1 28 ARG -2.79 0.09 1 29 PHE -5.11 0.60 1 30 GLU -8.18 1.19 1 31 ILE -4.34 0.64 1 32 ALA -4.46 0.16 1 34 TYR 1.10 0.10 1 35 LYS 2.42 -0.65 1 36 ASN 2.99 -0.29 1 37 LYS -2.84 0.13 1 38 VAL 6.22 -0.69 1 39 VAL 5.68 -0.54 1 43 SER -0.07 -0.17 1 45 VAL 2.13 -0.36 1 46 GLU -2.33 -0.10 1 48 ASP -2.05 0.17 1 49 LEU 2.33 -0.87 1 50 ASP 3.12 -0.01 1 51 GLU -0.45 -0.23 1 52 VAL 0.85 -0.17 1 53 LEU -0.77 -0.14 1 54 GLN 4.44 -0.69 1 55 THR -1.63 0.14 1 56 HIS 0.84 -0.03 1 57 SER -0.29 -0.41 1 58 VAL 0.55 -0.08 1 59 PHE -0.44 0.07 1 60 VAL 1.76 0.19 1 61 ASN -2.03 -0.17 1 62 VAL 4.85 -1.47 1 63 SER 4.08 -0.62 1 64 LYS -1.96 -0.05 1 66 GLN -1.02 0.09 1 67 VAL 0.52 -0.29 1 69 LYS -0.80 -0.11 1 70 LYS 5.63 -0.62 1 71 GLU 4.62 -0.52 1 72 ASP 3.16 -0.17 1 73 LEU 5.25 -0.42 1 74 ILE 4.56 -0.94 1 75 SER 3.45 -0.50 1 76 ALA -0.72 -0.39 1 77 PHE -0.33 -0.28 1 79 THR -2.17 0.09 1 80 ASP -1.75 -0.32 1 81 ASP -0.05 -0.37 1 82 GLN 4.95 -0.89 1 84 GLU 2.65 -0.60 1 85 ILE 5.74 -1.39 1 87 LYS 5.58 -0.87 1 88 GLN 4.66 -0.42 1 89 ILE 5.76 -0.68 1 90 LEU 3.01 -0.78 1 91 THR 4.87 -0.33 1 92 LYS -1.04 0.11 1 94 GLU -4.07 0.27 1 95 VAL 1.39 -0.04 1 96 GLN -1.06 -0.08 1 97 VAL -1.10 0.05 1 98 SER -1.20 -0.11 1 99 ASP 1.08 -0.28 1 100 LYS 2.00 -0.30 1 101 GLU 0.88 -0.33 1 102 ARG 2.08 -0.34 1 103 HIS 1.58 -0.35 1 104 THR 2.54 -0.34 1 105 GLN 3.84 -0.23 1 108 GLN 3.86 -0.47 1 109 MET 3.24 -0.44 1 110 PHE 4.32 -0.99 1 111 ARG 4.47 -0.32 1 112 ASP 3.69 -0.42 1 113 ILE 5.07 -0.90 1 114 ALA 2.42 -0.72 1 115 THR 5.79 -0.69 1 116 ILE 4.67 -0.54 1 117 VAL 6.97 -1.05 1 118 ALA 2.31 -0.38 1 119 ASP 1.36 -0.26 1 120 LYS -1.98 0.22 1 122 VAL -6.48 0.17 1 123 ASN -2.67 0.13 1 125 GLU 1.69 -0.34 1 126 THR -0.95 -0.32 1 127 LYS 5.72 -1.15 1 128 ARG -3.78 -0.29 1 130 TYR -1.37 -0.05 1 131 THR -3.98 0.17 1 132 VAL 5.47 -0.81 1 133 ILE 3.39 -0.31 1 134 LEU 2.73 -0.39 1 135 ILE 4.26 -0.73 1 136 GLU 3.65 -0.52 1 137 ARG 4.11 -0.48 1 138 ALA 2.71 -0.31 1 139 MET 2.21 -0.56 1 141 ASP 3.43 -0.41 1 142 ILE 1.48 0.14 1 143 HIS 3.61 -0.60 1 144 TYR 3.14 -0.54 1 145 SER -2.63 -0.03 1 146 VAL 1.36 -0.38 1 147 LYS -2.77 0.23 1 149 ASN 0.67 -0.15 1 150 LYS -5.55 0.22 1 151 SER -1.80 0.17 1 152 THR 5.63 -0.71 1 153 LYS 4.96 -0.60 1 154 GLN 4.11 -0.57 1 155 GLN 3.93 -0.51 1 156 ALA 3.23 -0.89 1 157 LEU 4.14 -0.56 1 158 GLU 3.07 -0.47 1 159 VAL 6.56 -1.14 1 160 ILE 6.10 -1.14 1 161 LYS 4.41 -0.61 1 162 GLN 3.08 -0.35 1 163 LEU 3.40 -0.55 1 164 LYS 3.45 0.00 1 165 GLU 0.78 -0.26 1 166 LYS -3.35 0.04 1 168 LYS 1.28 0.22 1 169 ILE -0.67 -0.22 1 170 GLU -6.68 0.14 1 171 ARG 0.41 0.32 1 172 ALA -5.06 0.14 1 173 HIS -4.17 0.35 1 174 MET -2.88 -0.08 1 175 ARG -0.69 0.89 1 176 LEU -5.56 0.81 1 177 ARG -5.20 0.91 1 178 PHE -6.00 1.02 1 179 ILE 0.26 0.46 1 180 LEU -4.57 0.28 1 182 VAL 5.34 -0.59 1 183 ASN 4.30 -0.36 1 184 GLU 1.91 -0.13 1 186 LYS 4.85 -0.51 1 187 LYS 2.94 -0.35 1 188 LEU 2.27 -0.48 1 189 LYS 6.27 -0.86 1 190 GLU 2.67 -0.47 1 191 LYS 1.91 -0.36 1 192 LEU 0.41 -0.45 1 193 LYS -1.94 0.07 1 195 LEU -3.42 0.07 1 196 ILE 2.05 -0.14 1 197 LYS -5.35 0.01 1 198 VAL 1.73 -0.29 1 199 ILE -0.18 -0.34 1 200 GLU -1.77 -0.08 1 201 SER -4.46 0.40 1 202 GLU -4.55 0.25 1 203 ASP 0.26 -0.27 1 204 TYR 3.07 -0.35 1 206 GLN -3.64 0.01 1 207 GLN -2.37 0.35 1 208 LEU -5.25 1.08 1 209 GLU -5.89 0.59 1 211 VAL -4.98 1.08 1 213 LEU -5.89 0.74 1 214 ILE 1.10 0.51 1 215 ASP 4.76 -0.99 1 219 PHE 5.18 -0.71 1 220 ARG 2.56 -0.60 1 221 GLU 5.70 -0.99 1 222 ILE 2.02 -0.84 1 223 ASP 2.94 -0.64 1 224 GLU 3.62 -0.43 1 225 LEU 5.74 -0.96 1 226 ILE 4.93 -0.59 1 227 LYS 3.08 -0.36 1 228 LYS 1.39 -0.24 1 229 GLU -0.76 0.18 1 230 THR 4.53 -0.43 1 231 LYS 0.42 -0.12 1 233 LYS -4.02 0.17 1 235 SER -4.84 0.89 1 236 LEU 2.17 -0.08 1 238 VAL 2.28 -0.23 1 239 LEU -0.44 -0.45 1 240 ASN -2.73 0.48 1 241 LEU -4.25 0.14 1 242 LYS 0.55 -0.24 1 243 ASP -0.10 -0.27 1 244 VAL -1.09 -0.22 1 245 GLU 0.01 -0.32 1 246 GLU 0.15 -0.25 1 248 ASP -0.29 -0.30 1 249 GLU 0.01 -0.22 1 250 LYS 0.03 -0.21 1 251 PHE -0.43 -0.40 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.18 _LACS_plot.Line_1_terminator_val_y_1 -2.99 _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 -0.77 _LACS_plot.Line_2_terminator_val_x_2 6.96 _LACS_plot.Line_2_terminator_val_y_2 2.59 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 THR -2.17 6.36 0 10 ASN 0.18 -0.31 1 11 GLN -0.26 -0.24 1 12 ILE 0.32 -0.57 1 13 ARG -0.55 -0.29 1 14 LEU -0.37 -0.31 1 15 THR -0.77 -0.61 1 17 VAL -2.02 -1.24 1 18 ALA -4.38 -2.57 1 19 VAL -0.74 -0.78 1 20 VAL -0.33 -2.14 1 21 ARG -7.06 -1.30 1 22 MET -6.86 -3.02 1 23 LYS -1.94 -0.42 1 24 ARG -3.81 -1.71 1 25 ALA 2.13 -0.71 1 27 LYS -4.30 -2.96 1 28 ARG -2.79 -2.75 1 29 PHE -5.11 -1.26 1 30 GLU -8.18 -1.68 1 31 ILE -4.34 -2.99 1 32 ALA -4.46 -1.72 1 34 TYR 1.10 1.39 1 36 ASN 2.99 0.79 1 37 LYS -2.84 0.56 1 39 VAL 5.68 2.92 1 43 SER -0.07 0.45 1 45 VAL 2.13 -0.04 1 46 GLU -2.33 -1.56 1 49 LEU 2.33 1.12 1 50 ASP 3.12 0.71 1 51 GLU -0.45 -0.94 1 52 VAL 0.85 -0.96 1 53 LEU -0.77 -0.88 1 54 GLN 4.44 -0.18 1 55 THR -1.63 -2.13 1 57 SER -0.29 -3.40 1 58 VAL 0.55 -0.66 1 59 PHE -0.44 0.39 1 60 VAL 1.76 -0.80 1 62 VAL 4.85 1.90 1 64 LYS -1.96 0.06 1 66 GLN -1.02 -0.54 1 67 VAL 0.52 -0.87 1 69 LYS -0.80 1.84 1 70 LYS 5.63 1.60 1 71 GLU 4.62 2.66 1 72 ASP 3.16 2.03 1 73 LEU 5.25 1.19 1 74 ILE 4.56 3.60 1 75 SER 3.45 0.83 1 76 ALA -0.72 0.32 1 77 PHE -0.33 1.17 1 80 ASP -1.75 -0.43 1 81 ASP -0.05 -0.38 1 82 GLN 4.95 1.85 1 84 GLU 2.65 2.85 1 85 ILE 5.74 1.49 1 87 LYS 5.58 2.64 1 88 GLN 4.66 2.35 1 89 ILE 5.76 1.88 1 90 LEU 3.01 1.04 1 91 THR 4.87 1.01 1 92 LYS -1.04 1.39 1 94 GLU -4.07 0.31 1 95 VAL 1.39 -0.31 1 96 GLN -1.06 -0.23 1 97 VAL -1.10 -0.30 1 98 SER -1.20 -0.04 1 100 LYS 2.00 1.33 1 101 GLU 0.88 1.12 1 102 ARG 2.08 1.10 1 104 THR 2.54 1.40 1 105 GLN 3.84 2.58 1 108 GLN 3.86 0.50 1 109 MET 3.24 1.35 1 110 PHE 4.32 0.91 1 111 ARG 4.47 3.20 1 112 ASP 3.69 3.14 1 113 ILE 5.07 0.35 1 114 ALA 2.42 1.17 1 116 ILE 4.67 1.62 1 117 VAL 6.97 1.51 1 118 ALA 2.31 -4.75 1 119 ASP 1.36 2.17 1 120 LYS -1.98 0.34 1 122 VAL -6.48 -2.13 1 123 ASN -2.67 0.50 1 127 LYS 5.72 -2.91 1 128 ARG -3.78 -0.40 1 130 TYR -1.37 -0.44 1 132 VAL 5.47 0.98 1 133 ILE 3.39 1.89 1 134 LEU 2.73 2.78 1 135 ILE 4.26 1.44 1 136 GLU 3.65 2.54 1 137 ARG 4.11 2.14 1 138 ALA 2.71 2.50 1 139 MET 2.21 2.33 1 141 ASP 3.43 2.12 1 142 ILE 1.48 -0.79 1 143 HIS 3.61 0.47 1 144 TYR 3.14 -0.59 1 145 SER -2.63 -1.89 1 146 VAL 1.36 -0.69 1 147 LYS -2.77 0.58 1 149 ASN 0.67 -1.06 1 150 LYS -5.55 -0.37 1 153 LYS 4.96 1.54 1 154 GLN 4.11 3.82 1 155 GLN 3.93 1.01 1 156 ALA 3.23 0.77 1 157 LEU 4.14 2.40 1 158 GLU 3.07 2.48 1 159 VAL 6.56 1.44 1 161 LYS 4.41 2.80 1 162 GLN 3.08 4.10 1 163 LEU 3.40 1.64 1 164 LYS 3.45 1.20 1 165 GLU 0.78 0.62 1 166 LYS -3.35 -1.23 1 168 LYS 1.28 -1.45 1 169 ILE -0.67 -5.30 1 170 GLU -6.68 -1.64 1 171 ARG 0.41 -1.43 1 172 ALA -5.06 -2.19 1 174 MET -2.88 -2.70 1 175 ARG -0.69 -1.78 1 176 LEU -5.56 -2.72 1 177 ARG -5.20 -0.53 1 178 PHE -6.00 -0.83 1 179 ILE 0.26 -0.78 1 180 LEU -4.57 -2.53 1 182 VAL 5.34 1.51 1 183 ASN 4.30 2.17 1 184 GLU 1.91 1.59 1 186 LYS 4.85 2.62 1 188 LEU 2.27 0.94 1 189 LYS 6.27 1.52 1 190 GLU 2.67 2.34 1 191 LYS 1.91 0.87 1 192 LEU 0.41 0.28 1 193 LYS -1.94 -2.28 1 195 LEU -3.42 -0.82 1 196 ILE 2.05 0.34 1 197 LYS -5.35 -1.82 1 198 VAL 1.73 -0.84 1 199 ILE -0.18 0.07 1 200 GLU -1.77 -2.85 1 201 SER -4.46 -2.70 1 202 GLU -4.55 -1.99 1 203 ASP 0.26 -0.52 1 204 TYR -3.64 -2.16 1 207 GLN -2.37 -3.59 1 208 LEU -5.25 -0.36 1 209 GLU -5.89 -2.30 1 210 ILE -0.55 0.07 1 211 VAL -4.98 -0.38 1 213 LEU -5.89 -0.10 1 214 ILE 1.10 1.01 1 215 ASP 4.76 -0.36 1 219 PHE 5.18 2.31 1 220 ARG 2.56 2.61 1 221 GLU 5.70 -0.06 1 222 ILE 2.02 2.57 1 223 ASP 2.94 2.16 1 224 GLU 5.74 3.28 1 226 ILE 4.93 2.59 1 227 LYS 3.08 3.84 1 228 LYS 1.39 1.59 1 229 GLU -0.76 0.94 1 230 THR 4.53 -0.02 1 231 LYS 0.42 1.52 1 233 LYS -4.02 -2.70 1 235 SER -4.84 -2.33 1 236 LEU 2.17 -0.21 1 238 VAL 2.28 -0.43 1 239 LEU -0.44 -3.22 1 240 ASN -2.73 -1.51 1 241 LEU -4.25 -2.00 1 242 LYS 0.55 -0.16 1 243 ASP -0.10 -0.33 1 244 VAL 0.01 0.73 1 246 GLU 0.15 0.21 1 248 ASP -0.29 -0.58 1 249 GLU 0.01 -0.35 1 250 LYS 0.03 -1.24 1 251 PHE -0.43 4.34 1 stop_ save_