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 bmr6125_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.20 _LACS_plot.Line_1_terminator_val_y_1 -3.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.38 _LACS_plot.Line_2_terminator_val_x_2 9.19 _LACS_plot.Line_2_terminator_val_y_2 6.82 _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 23 PHE 3.40 6.60 0 11 THR 3.40 3.40 1 12 THR 0.80 1.50 1 13 SER -4.10 -0.90 1 14 ASP 1.20 0.60 1 15 ILE 3.10 3.50 1 16 ARG 1.20 0.20 1 17 PHE -0.90 -0.30 1 18 VAL 5.60 3.70 1 19 HIS 2.10 4.20 1 20 ASN 0.60 0.70 1 21 VAL 2.10 1.90 1 22 LEU 6.80 3.30 1 25 TYR 3.10 3.70 1 26 ALA 4.70 2.60 1 27 ARG 5.10 4.80 1 28 GLU 1.80 1.70 1 29 ARG -1.30 -0.20 1 30 LEU 4.70 5.30 1 31 ALA 4.50 3.40 1 33 PHE 3.20 3.80 1 34 VAL 6.70 5.20 1 35 THR 6.10 5.20 1 36 ALA 2.00 2.10 1 37 GLN 0.00 -0.50 1 38 GLN 4.20 3.10 1 39 PHE -0.60 -1.30 1 40 VAL -3.00 -1.40 1 41 GLU 2.70 1.50 1 43 VAL 8.60 5.30 1 44 LYS 4.70 4.30 1 45 THR 8.10 6.00 1 46 ILE 5.50 5.00 1 47 LEU 5.30 2.60 1 48 ASP 5.70 3.80 1 49 ASN 4.50 2.90 1 50 LEU 3.90 2.80 1 51 ARG 5.00 4.70 1 52 GLU 3.10 2.70 1 53 GLU 3.10 3.70 1 54 ILE 0.50 -0.30 1 55 ALA 2.50 0.10 1 56 GLN -2.50 -0.80 1 58 ALA -1.50 -1.70 1 59 ALA 0.60 1.00 1 61 ALA 5.70 3.90 1 62 GLU 5.50 4.20 1 63 GLU 3.10 2.80 1 64 LEU 4.80 2.60 1 65 ILE 5.70 5.20 1 66 ALA 4.70 3.30 1 67 THR 6.60 5.30 1 68 LEU 3.80 3.40 1 69 PHE 4.40 2.80 1 70 ALA 4.80 3.00 1 71 PHE 2.00 0.10 1 72 MET 5.10 4.90 1 73 ASP 4.20 3.30 1 74 GLU -1.60 -1.00 1 75 ASP 2.30 0.70 1 76 ARG -0.50 -0.10 1 79 THR 5.90 4.70 1 80 ALA 2.60 2.70 1 81 LEU 3.60 3.20 1 82 LYS 3.90 2.80 1 83 ALA 3.10 2.30 1 84 LEU 3.50 2.80 1 85 GLN 6.20 3.70 1 87 ILE 4.30 4.10 1 88 ILE 4.60 4.10 1 89 TRP 3.60 1.70 1 90 ARG 6.90 4.90 1 91 ASP 3.90 3.60 1 93 TYR 3.80 3.50 1 94 VAL 5.10 3.60 1 95 HIS 1.80 1.70 1 97 ASP 2.70 2.70 1 98 PHE -2.80 -2.90 1 99 THR -4.60 -2.40 1 101 HIS 0.40 4.10 1 102 LEU -7.00 -2.10 1 103 TYR 4.00 3.40 1 105 ASP -2.10 -0.90 1 106 VAL 5.50 4.20 1 107 LEU 9.20 6.90 1 109 ALA 1.60 2.00 1 110 LEU 3.60 3.20 1 111 GLU 2.60 2.90 1 112 LYS 4.50 3.10 1 113 TRP 2.20 0.80 1 114 LYS 2.90 2.10 1 115 SER 4.00 3.20 1 116 GLN 0.50 0.40 1 118 ILE 0.70 0.50 1 119 ASP -1.20 0.10 1 120 LEU -4.40 -1.60 1 121 TYR -3.60 -1.90 1 122 VAL -3.00 -1.70 1 123 TYR -5.10 -3.40 1 127 SER -1.40 -0.30 1 128 VAL 7.00 5.40 1 129 ALA 3.60 2.90 1 130 ALA 3.60 2.80 1 131 GLN 4.30 3.50 1 132 LYS 5.30 3.60 1 133 LEU 3.20 2.80 1 134 LEU 5.40 4.70 1 135 PHE 3.20 2.80 1 137 TYR 0.60 -1.50 1 138 SER -2.20 1.70 1 139 ASP 2.00 3.20 1 140 GLU -1.60 -2.00 1 142 ASP 0.60 -0.70 1 143 ILE 0.50 -0.70 1 144 THR 3.40 3.40 1 145 HIS 2.50 2.80 1 146 LEU 1.40 0.70 1 147 PHE 0.90 0.50 1 148 ASN 1.70 1.50 1 150 TYR -3.50 -0.30 1 151 PHE -2.90 -0.40 1 152 ASP -5.10 -2.20 1 153 THR 3.80 2.00 1 154 LEU 5.20 3.50 1 155 VAL 0.70 0.40 1 157 ALA -1.10 -0.40 1 159 ARG 1.40 -0.90 1 160 GLU -3.50 -2.40 1 161 ALA 2.80 2.90 1 162 GLN 4.10 2.30 1 163 SER 4.00 2.20 1 164 TYR 6.10 3.10 1 165 ARG 6.20 4.90 1 166 ASN 4.00 2.40 1 167 ILE 5.60 5.10 1 168 ALA 5.30 3.50 1 169 GLU 2.90 2.50 1 170 GLN 4.60 3.20 1 171 LEU 1.60 1.20 1 173 GLN -3.80 -2.30 1 176 ALA 1.20 1.00 1 177 ALA -2.00 -1.30 1 178 ILE -1.40 -1.30 1 179 LEU -6.30 -2.90 1 180 PHE -7.20 -3.80 1 181 LEU -4.40 -3.40 1 182 SER -3.40 -2.10 1 189 ASP 4.00 3.10 1 190 ALA 3.70 2.30 1 191 ALA 3.60 2.30 1 192 GLU 1.20 2.00 1 193 GLU 3.50 2.90 1 194 ALA -0.90 0.40 1 196 PHE 0.50 -0.80 1 197 ARG -0.60 -1.30 1 198 THR -4.00 -2.00 1 199 LEU -4.20 0.90 1 200 GLN -5.70 -3.10 1 201 LEU -4.10 -4.50 1 202 VAL -1.50 -2.70 1 203 ARG 1.30 0.20 1 205 ASP -0.60 0.20 1 206 ARG 0.40 0.50 1 207 ASP -3.00 -1.60 1 209 ALA -1.00 -0.60 1 210 SER -4.70 -3.30 1 214 GLN -3.30 -1.30 1 215 VAL -6.30 -3.10 1 216 GLN -1.30 0.90 1 217 ARG -6.00 -1.80 1 218 PHE 4.70 1.90 1 219 ASP 2.90 0.90 1 220 ASP -0.70 0.10 1 221 ILE 2.10 0.80 1 222 HIS -1.50 -1.00 1 224 GLU 3.00 1.10 1 225 GLN -0.80 -0.50 1 226 ILE 1.50 0.80 1 228 ALA 0.00 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6125_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.20 _LACS_plot.Line_1_terminator_val_y_1 3.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.62 _LACS_plot.Line_2_terminator_val_x_2 9.19 _LACS_plot.Line_2_terminator_val_y_2 -2.37 _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 23 PHE 3.40 3.20 0 11 THR 3.40 0.00 1 12 THR 0.80 0.70 1 13 SER -4.10 3.20 1 14 ASP 1.20 -0.60 1 15 ILE 3.10 0.40 1 16 ARG 1.20 -1.00 1 17 PHE -0.90 0.60 1 18 VAL 5.60 -1.90 1 19 HIS 2.10 2.10 1 20 ASN 0.60 0.10 1 21 VAL 2.10 -0.20 1 22 LEU 6.80 -3.50 1 25 TYR 3.10 0.60 1 26 ALA 4.70 -2.10 1 27 ARG 5.10 -0.30 1 28 GLU 1.80 -0.10 1 29 ARG -1.30 1.10 1 30 LEU 4.70 0.60 1 31 ALA 4.50 -1.10 1 33 PHE 3.20 0.60 1 34 VAL 6.70 -1.50 1 35 THR 6.10 -0.90 1 36 ALA 2.00 0.10 1 37 GLN 0.00 -0.50 1 38 GLN 4.20 -1.10 1 39 PHE -0.60 -0.70 1 40 VAL -3.00 1.60 1 41 GLU 2.70 -1.20 1 43 VAL 8.60 -3.30 1 44 LYS 4.70 -0.40 1 45 THR 8.10 -2.10 1 46 ILE 5.50 -0.50 1 47 LEU 5.30 -2.70 1 48 ASP 5.70 -1.90 1 49 ASN 4.50 -1.60 1 50 LEU 3.90 -1.10 1 51 ARG 5.00 -0.30 1 52 GLU 3.10 -0.40 1 53 GLU 3.10 0.60 1 54 ILE 0.50 -0.80 1 55 ALA 2.50 -2.40 1 56 GLN -2.50 1.70 1 58 ALA -1.50 -0.20 1 59 ALA 0.60 0.40 1 61 ALA 5.70 -1.80 1 62 GLU 5.50 -1.30 1 63 GLU 3.10 -0.30 1 64 LEU 4.80 -2.20 1 65 ILE 5.70 -0.50 1 66 ALA 4.70 -1.40 1 67 THR 6.60 -1.30 1 68 LEU 3.80 -0.40 1 69 PHE 4.40 -1.60 1 70 ALA 4.80 -1.80 1 71 PHE 2.00 -1.90 1 72 MET 5.10 -0.20 1 73 ASP 4.20 -0.90 1 74 GLU -1.60 0.60 1 75 ASP 2.30 -1.60 1 76 ARG -0.50 0.40 1 79 THR 5.90 -1.20 1 80 ALA 2.60 0.10 1 81 LEU 3.60 -0.40 1 82 LYS 3.90 -1.10 1 83 ALA 3.10 -0.80 1 84 LEU 3.50 -0.70 1 85 GLN 6.20 -2.50 1 87 ILE 4.30 -0.20 1 88 ILE 4.60 -0.50 1 89 TRP 3.60 -1.90 1 90 ARG 6.90 -2.00 1 91 ASP 3.90 -0.30 1 93 TYR 3.80 -0.30 1 94 VAL 5.10 -1.50 1 95 HIS 1.80 -0.10 1 97 ASP 2.70 0.00 1 98 PHE -2.80 -0.10 1 99 THR -4.60 2.20 1 101 HIS 0.40 3.70 1 102 LEU -7.00 4.90 1 103 TYR 4.00 -0.60 1 105 ASP -2.10 1.20 1 106 VAL 5.50 -1.30 1 107 LEU 9.20 -2.30 1 109 ALA 1.60 0.40 1 110 LEU 3.60 -0.40 1 111 GLU 2.60 0.30 1 112 LYS 4.50 -1.40 1 113 TRP 2.20 -1.40 1 114 LYS 2.90 -0.80 1 115 SER 4.00 -0.80 1 116 GLN 0.50 -0.10 1 118 ILE 0.70 -0.20 1 119 ASP -1.20 1.30 1 120 LEU -4.40 2.80 1 121 TYR -3.60 1.70 1 122 VAL -3.00 1.30 1 123 TYR -5.10 1.70 1 127 SER -1.40 1.10 1 128 VAL 7.00 -1.60 1 129 ALA 3.60 -0.70 1 130 ALA 3.60 -0.80 1 131 GLN 4.30 -0.80 1 132 LYS 5.30 -1.70 1 133 LEU 3.20 -0.40 1 134 LEU 5.40 -0.70 1 135 PHE 3.20 -0.40 1 137 TYR 0.60 -2.10 1 138 SER -2.20 3.90 1 139 ASP 2.00 1.20 1 140 GLU -1.60 -0.40 1 142 ASP 0.60 -1.30 1 143 ILE 0.50 -1.20 1 144 THR 3.40 0.00 1 145 HIS 2.50 0.30 1 146 LEU 1.40 -0.70 1 147 PHE 0.90 -0.40 1 148 ASN 1.70 -0.20 1 150 TYR -3.50 3.20 1 151 PHE -2.90 2.50 1 152 ASP -5.10 2.90 1 153 THR 3.80 -1.80 1 154 LEU 5.20 -1.70 1 155 VAL 0.70 -0.30 1 157 ALA -1.10 0.70 1 159 ARG 1.40 -2.30 1 160 GLU -3.50 1.10 1 161 ALA 2.80 0.10 1 162 GLN 4.10 -1.80 1 163 SER 4.00 -1.80 1 164 TYR 6.10 -3.00 1 165 ARG 6.20 -1.30 1 166 ASN 4.00 -1.60 1 167 ILE 5.60 -0.50 1 168 ALA 5.30 -1.80 1 169 GLU 2.90 -0.40 1 170 GLN 4.60 -1.40 1 171 LEU 1.60 -0.40 1 173 GLN -3.80 1.50 1 176 ALA 1.20 -0.20 1 177 ALA -2.00 0.70 1 178 ILE -1.40 0.10 1 179 LEU -6.30 3.40 1 180 PHE -7.20 3.40 1 181 LEU -4.40 1.00 1 182 SER -3.40 1.30 1 189 ASP 4.00 -0.90 1 190 ALA 3.70 -1.40 1 191 ALA 3.60 -1.30 1 192 GLU 1.20 0.80 1 193 GLU 3.50 -0.60 1 194 ALA -0.90 1.30 1 196 PHE 0.50 -1.30 1 197 ARG -0.60 -0.70 1 198 THR -4.00 2.00 1 199 LEU -4.20 5.10 1 200 GLN -5.70 2.60 1 201 LEU -4.10 -0.40 1 202 VAL -1.50 -1.20 1 203 ARG 1.30 -1.10 1 205 ASP -0.60 0.80 1 206 ARG 0.40 0.10 1 207 ASP -3.00 1.40 1 209 ALA -1.00 0.40 1 210 SER -4.70 1.40 1 214 GLN -3.30 2.00 1 215 VAL -6.30 3.20 1 216 GLN -1.30 2.20 1 217 ARG -6.00 4.20 1 218 PHE 4.70 -2.80 1 219 ASP 2.90 -2.00 1 220 ASP -0.70 0.80 1 221 ILE 2.10 -1.30 1 222 HIS -1.50 0.50 1 224 GLU 3.00 -1.90 1 225 GLN -0.80 0.30 1 226 ILE 1.50 -0.70 1 228 ALA 0.00 1.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6125_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.20 _LACS_plot.Line_1_terminator_val_y_1 0.81 _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 0.26 _LACS_plot.Line_2_terminator_val_x_2 9.19 _LACS_plot.Line_2_terminator_val_y_2 -0.95 _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 210 SER -4.70 -0.38 0 123 TYR -5.10 1.62 0 180 PHE -7.20 1.72 0 191 ALA 3.60 -1.64 0 11 THR 3.40 -0.29 1 12 THR 0.80 0.04 1 13 SER -4.10 0.50 1 14 ASP 1.20 -0.09 1 15 ILE 3.10 -0.24 1 16 ARG 1.20 0.04 1 17 PHE -0.90 -0.17 1 18 VAL 5.60 -1.30 1 19 HIS 2.10 -0.60 1 20 ASN 0.60 0.04 1 21 VAL 2.10 -0.12 1 22 LEU 6.80 -1.13 1 23 PHE 3.40 -0.65 1 25 TYR 3.10 -0.29 1 26 ALA 4.70 -0.19 1 27 ARG 5.10 -0.48 1 28 GLU 1.80 -0.16 1 29 ARG -1.30 0.08 1 30 LEU 4.70 -0.53 1 31 ALA 4.50 -0.44 1 33 PHE 3.20 -0.34 1 34 VAL 6.70 -1.06 1 35 THR 6.10 -0.81 1 36 ALA 2.00 -0.10 1 37 GLN 0.00 -0.02 1 38 GLN 4.20 -0.67 1 39 PHE -0.60 0.30 1 40 VAL -3.00 0.35 1 41 GLU 2.70 -0.12 1 43 VAL 8.60 -0.71 1 44 LYS 4.70 -0.51 1 45 THR 8.10 -0.01 1 46 ILE 5.50 -0.44 1 47 LEU 5.30 -0.31 1 48 ASP 5.70 -0.26 1 49 ASN 4.50 -0.16 1 50 LEU 3.90 -0.20 1 51 ARG 5.00 -0.73 1 52 GLU 3.10 -0.21 1 53 GLU 3.10 -0.22 1 54 ILE 0.50 0.45 1 55 ALA 2.50 -0.14 1 56 GLN -2.50 0.37 1 58 ALA -1.50 0.26 1 59 ALA 0.60 -0.19 1 61 ALA 5.70 -0.73 1 62 GLU 5.50 -0.52 1 63 GLU 3.10 -0.22 1 64 LEU 4.80 -0.53 1 65 ILE 5.70 -1.02 1 66 ALA 4.70 -0.16 1 67 THR 6.60 -0.61 1 68 LEU 3.80 -0.72 1 69 PHE 4.40 -0.27 1 70 ALA 4.80 0.04 1 71 PHE 2.00 -0.10 1 72 MET 5.10 -0.35 1 73 ASP 4.20 -0.19 1 74 GLU -1.60 0.10 1 75 ASP 2.30 -0.33 1 76 ARG -0.50 0.01 1 79 THR 5.90 -0.48 1 80 ALA 2.60 -0.06 1 81 LEU 3.60 -0.52 1 83 ALA 3.10 -0.10 1 84 LEU 3.50 -0.40 1 85 GLN 6.20 -1.57 1 87 ILE 4.30 -0.41 1 88 ILE 4.60 -0.85 1 89 TRP 3.60 0.04 1 90 ARG 6.90 -0.15 1 91 ASP 3.90 -0.35 1 93 TYR 3.80 -0.78 1 94 VAL 5.10 -0.90 1 95 HIS 1.80 -0.19 1 97 ASP 2.70 -0.26 1 98 PHE -2.80 0.02 1 99 THR -4.60 0.76 1 102 LEU -7.00 0.19 1 103 TYR 4.00 -0.43 1 105 ASP -2.10 -0.17 1 106 VAL 5.50 -1.10 1 107 LEU 9.20 -0.72 1 109 ALA 1.60 -0.79 1 110 LEU 3.60 -0.66 1 111 GLU 2.60 -0.63 1 112 LYS 4.50 -0.32 1 113 TRP 2.20 0.02 1 114 LYS 2.90 0.25 1 115 SER 4.00 -0.08 1 116 GLN 0.50 0.12 1 118 ILE 0.70 -0.36 1 119 ASP -1.20 -0.05 1 120 LEU -4.40 1.20 1 121 TYR -3.60 0.84 1 122 VAL -3.00 1.11 1 127 SER -1.40 0.25 1 128 VAL 7.00 -0.70 1 129 ALA 3.60 -0.06 1 130 ALA 3.60 -0.01 1 131 GLN 4.30 -0.64 1 132 LYS 5.30 -0.70 1 133 LEU 3.20 -1.27 1 134 LEU 5.40 -0.80 1 135 PHE 3.20 -0.24 1 137 TYR 0.60 0.00 1 138 SER -2.20 0.56 1 139 ASP 2.00 -0.36 1 140 GLU -1.60 0.18 1 142 ASP 0.60 0.46 1 143 ILE 0.50 0.74 1 144 THR 3.40 -0.29 1 145 HIS 2.50 -0.35 1 146 LEU 1.40 -0.78 1 147 PHE 0.90 -0.29 1 148 ASN 1.70 -0.35 1 150 TYR -3.50 0.37 1 151 PHE -2.90 0.37 1 152 ASP -5.10 1.46 1 153 THR 3.80 0.21 1 154 LEU 5.20 -0.07 1 155 VAL 0.70 0.17 1 157 ALA -1.10 -0.04 1 159 ARG 1.40 0.28 1 160 GLU -3.50 0.37 1 161 ALA 2.80 -0.26 1 162 GLN 4.10 -0.67 1 163 SER 4.00 -0.45 1 164 TYR 6.10 -1.31 1 165 ARG 6.20 -0.33 1 166 ASN 4.00 -0.36 1 167 ILE 5.60 -1.40 1 168 ALA 5.30 -0.64 1 169 GLU 2.90 -0.30 1 170 GLN 4.60 -0.28 1 171 LEU 1.60 -0.29 1 173 GLN -3.80 0.26 1 176 ALA 1.20 -0.13 1 177 ALA -2.00 0.33 1 178 ILE -1.40 0.53 1 179 LEU -6.30 0.63 1 181 LEU -4.40 0.70 1 182 SER -3.40 0.04 1 190 ALA 3.70 -0.16 1 192 GLU 1.20 0.01 1 193 GLU 3.50 -0.23 1 194 ALA -0.90 -0.15 1 196 PHE 0.50 0.36 1 197 ARG -0.60 0.37 1 198 THR -4.00 1.04 1 199 LEU -4.20 -0.02 1 200 GLN -5.70 0.62 1 201 LEU -4.10 0.50 1 202 VAL -1.50 0.35 1 203 ARG 1.30 -0.03 1 205 ASP -0.60 -0.04 1 206 ARG 0.40 -0.34 1 207 ASP -3.00 0.26 1 209 ALA -1.00 -0.01 1 214 GLN -3.30 1.12 1 215 VAL -6.30 0.73 1 216 GLN -1.30 0.02 1 217 ARG -6.00 0.20 1 218 PHE 4.70 -0.40 1 219 ASP 2.90 -0.26 1 220 ASP -0.70 0.22 1 221 ILE 2.10 -0.48 1 222 HIS -1.50 0.21 1 224 GLU 3.00 -0.02 1 225 GLN -0.80 0.11 1 226 ILE 1.50 -0.16 1 228 ALA 0.00 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6125_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.20 _LACS_plot.Line_1_terminator_val_y_1 -2.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.31 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 2.62 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 180 PHE -7.20 -3.70 0 199 LEU -4.20 -5.10 0 11 THR 3.40 0.40 1 12 THR 0.80 0.10 1 13 SER -4.10 -1.90 1 14 ASP 1.20 2.10 1 15 ILE 3.10 0.20 1 16 ARG 1.20 -1.00 1 17 PHE -0.90 0.60 1 18 VAL 5.60 0.00 1 19 HIS 2.10 2.40 1 20 ASN 0.60 0.70 1 21 VAL 2.10 0.50 1 22 LEU 6.80 3.00 1 25 TYR 3.10 1.40 1 26 ALA 4.70 1.00 1 27 ARG 5.10 2.00 1 28 GLU 1.80 1.30 1 29 ARG -1.30 1.40 1 30 LEU 4.70 -0.40 1 31 ALA 4.50 3.00 1 33 PHE 3.20 0.90 1 34 VAL 6.70 0.60 1 35 THR 6.10 1.90 1 36 ALA 2.00 2.60 1 37 GLN 0.00 0.40 1 38 GLN 4.20 -1.20 1 39 PHE -0.60 -0.30 1 40 VAL -3.00 0.30 1 43 VAL 8.60 1.40 1 44 LYS 4.70 2.30 1 45 THR 8.10 1.20 1 46 ILE 5.50 2.30 1 47 LEU 5.30 1.80 1 48 ASP 5.70 3.10 1 49 ASN 4.50 3.20 1 50 LEU 3.90 0.10 1 51 ARG 5.00 2.60 1 52 GLU 3.10 2.90 1 53 GLU 3.10 2.80 1 54 ILE 0.50 -2.00 1 55 ALA 2.50 -1.50 1 58 ALA -1.50 -0.20 1 59 ALA 0.60 0.60 1 61 ALA 5.70 0.90 1 62 GLU 5.50 3.00 1 63 GLU 3.10 3.20 1 64 LEU 4.80 0.80 1 65 ILE 5.70 0.00 1 66 ALA 4.70 3.60 1 67 THR 6.60 -0.10 1 68 LEU 3.80 1.60 1 69 PHE 4.40 2.30 1 70 ALA 4.80 3.20 1 71 PHE 2.00 3.70 1 72 MET 5.10 3.00 1 73 ASP 4.20 1.40 1 74 GLU -1.60 0.20 1 75 ASP 2.30 -1.20 1 79 THR 5.90 2.00 1 80 ALA 2.60 -0.70 1 81 LEU 3.60 0.40 1 82 LYS 3.90 3.50 1 83 ALA 3.10 2.90 1 84 LEU 3.50 1.20 1 85 GLN 6.20 0.10 1 87 ILE 4.30 1.10 1 88 ILE 4.60 2.50 1 89 TRP 3.60 3.00 1 90 ARG 6.90 0.80 1 91 ASP 3.90 2.30 1 93 TYR 3.80 4.50 1 94 VAL 5.10 2.10 1 95 HIS 1.80 1.20 1 97 ASP 2.70 -1.20 1 98 PHE -2.80 -2.20 1 99 THR -4.60 0.50 1 101 HIS 0.40 -0.50 1 102 LEU -7.00 -1.00 1 105 ASP -2.10 0.00 1 106 VAL 5.50 -0.30 1 109 ALA 1.60 -1.10 1 110 LEU 3.60 1.80 1 111 GLU 2.60 3.80 1 112 LYS 4.50 2.90 1 113 TRP 2.20 3.00 1 114 LYS 2.90 2.92 1 115 SER 4.00 0.80 1 116 GLN 0.50 0.10 1 118 ILE 0.70 -1.30 1 119 ASP -1.20 0.50 1 120 LEU -4.40 -2.10 1 121 TYR -3.60 0.20 1 122 VAL -3.00 -0.80 1 127 SER -1.40 1.30 1 128 VAL 7.00 1.30 1 129 ALA 3.60 2.40 1 130 ALA 3.60 3.10 1 131 GLN 4.30 1.80 1 132 LYS 5.30 4.20 1 133 LEU 3.20 -1.80 1 134 LEU 5.40 0.40 1 135 PHE 3.20 1.10 1 137 TYR 0.60 -0.40 1 138 SER -2.20 3.50 1 139 ASP 2.00 0.90 1 140 GLU -1.60 -1.00 1 142 ASP 0.60 1.70 1 143 ILE 0.50 0.60 1 144 THR 3.40 1.40 1 145 HIS 2.50 2.30 1 146 LEU 1.40 -1.00 1 147 PHE 0.90 -0.10 1 148 ASN 1.70 0.00 1 150 TYR -3.50 -2.00 1 151 PHE -2.90 -1.10 1 152 ASP -5.10 1.20 1 153 THR 3.80 2.50 1 154 LEU 5.20 2.80 1 155 VAL 0.70 -2.10 1 157 ALA -1.10 2.70 1 159 ARG 1.40 -2.10 1 160 GLU -3.50 -0.60 1 161 ALA 2.80 2.00 1 162 GLN 4.10 0.50 1 163 SER 4.00 0.20 1 164 TYR 6.10 2.00 1 165 ARG 6.20 2.70 1 166 ASN 4.00 2.80 1 167 ILE 5.60 -1.90 1 168 ALA 5.30 1.40 1 169 GLU 2.90 3.20 1 170 GLN 4.60 2.30 1 171 LEU 1.60 0.60 1 176 ALA 1.20 -0.40 1 177 ALA -2.00 -1.00 1 178 ILE -1.40 -3.60 1 179 LEU -6.30 -4.00 1 181 LEU -4.40 -2.70 1 182 SER -3.40 -1.70 1 189 ASP 4.00 2.20 1 190 ALA 3.70 -0.10 1 191 ALA 3.60 1.80 1 192 GLU 1.20 4.20 1 193 GLU 3.50 1.60 1 194 ALA -0.90 -1.30 1 196 PHE 0.50 2.40 1 197 ARG -0.60 0.30 1 198 THR -4.00 -0.80 1 200 GLN -5.70 -0.60 1 201 LEU -4.10 -2.40 1 202 VAL -1.50 -1.20 1 203 ARG 1.30 0.90 1 205 ASP -0.60 0.00 1 206 ARG 0.40 -1.20 1 209 ALA -1.00 -1.30 1 210 SER -4.70 1.20 1 214 GLN -3.30 0.70 1 215 VAL -6.30 -1.60 1 216 GLN -1.30 -1.30 1 217 ARG -6.00 0.10 1 218 PHE 4.70 1.90 1 219 ASP 2.90 -0.60 1 220 ASP -0.70 -2.10 1 221 ILE 2.10 -2.40 1 224 GLU 3.00 -0.10 1 225 GLN -0.80 -0.30 1 stop_ save_