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 bmr26767_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -2.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.94 _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 6.82 _LACS_plot.Line_2_terminator_val_y_2 5.55 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 LEU 6.82 0.72 0 10 ASP 0.50 0.65 1 11 ARG 1.01 0.63 1 12 LYS 1.28 0.99 1 13 ASN 0.16 0.38 1 14 ASP 0.24 0.44 1 15 LYS 0.39 0.55 1 16 LYS -1.30 -0.47 1 20 TYR -3.58 -2.10 1 21 LYS -0.95 -1.23 1 22 HIS -0.91 0.90 1 23 ILE -4.38 -1.26 1 24 LYS -1.61 0.89 1 25 VAL -6.71 -3.42 1 26 ASN 0.98 1.14 1 27 ARG -5.01 -2.65 1 29 ILE -2.73 -2.94 1 31 ARG 0.89 0.29 1 32 VAL 2.24 1.51 1 33 GLN -4.69 -1.42 1 34 ILE -2.10 -0.69 1 35 PHE -0.78 0.01 1 36 THR -2.70 -1.19 1 37 ALA -2.82 -1.22 1 38 ASP -2.10 -0.09 1 39 LEU 3.80 3.20 1 40 SER 2.89 2.26 1 41 GLU -1.77 -0.86 1 42 ILE -0.14 -0.55 1 44 ARG -3.82 -1.36 1 46 ASN -2.17 -0.96 1 48 LYS -4.89 -2.06 1 49 ALA 2.57 2.38 1 50 THR -0.12 -0.93 1 51 ASP 1.11 0.78 1 52 GLU 2.88 3.07 1 53 ASN -0.76 0.30 1 59 SER -1.71 0.70 1 60 GLU 0.78 -0.79 1 62 ILE 2.95 3.01 1 63 ASN 5.26 2.76 1 64 ARG 4.67 4.53 1 65 MET 3.02 3.32 1 66 LEU -0.82 -1.19 1 68 TYR -3.34 -1.91 1 73 THR 3.66 2.83 1 74 VAL -0.80 0.50 1 77 ALA -0.23 -0.04 1 80 ARG 0.63 0.53 1 83 ASN -1.98 -1.09 1 84 GLN -1.07 -0.60 1 88 LYS 1.67 1.67 1 89 ARG 4.94 1.26 1 90 GLN 0.39 -1.03 1 91 TYR -3.78 -3.58 1 93 GLU 0.96 1.41 1 94 VAL -7.12 -3.29 1 95 GLU -6.25 -2.13 1 96 ILE -0.74 -0.16 1 97 PHE -4.85 -2.11 1 98 ARG -0.17 -0.58 1 99 THR -0.65 -0.66 1 102 ARG -0.88 -1.90 1 104 TRP 0.00 0.56 1 107 ARG -5.18 -2.48 1 108 THR -2.43 -2.35 1 109 LYS 1.04 -0.11 1 110 THR -3.91 -2.10 1 111 ASP 1.70 1.16 1 112 ILE -4.00 -0.34 1 113 LYS -2.14 -1.06 1 114 LYS 2.86 3.13 1 116 GLU 0.33 1.39 1 117 PHE -0.53 0.17 1 119 ASN -4.21 -1.32 1 120 GLU -5.58 -2.78 1 122 VAL -5.07 -3.12 1 124 GLU -1.13 0.08 1 125 LEU -4.23 -1.52 1 126 ILE -5.34 -2.07 1 127 ASP -3.96 -3.07 1 128 GLU 3.79 3.78 1 129 GLU 3.66 3.29 1 130 GLU 2.38 1.73 1 132 ARG 4.94 4.10 1 133 ALA 4.13 3.13 1 134 ARG 3.91 4.16 1 135 ILE 6.24 5.33 1 136 ARG 4.99 3.92 1 137 TYR 4.69 4.36 1 138 ALA 3.70 3.57 1 139 GLN 4.23 3.37 1 140 GLU 1.39 1.39 1 141 HIS 2.23 1.30 1 142 ASP 3.56 1.76 1 144 THR 0.19 -0.23 1 145 ASN -2.91 0.22 1 148 MET -2.46 0.06 1 149 LEU -3.89 0.30 1 150 THR 4.00 3.81 1 151 LEU 0.79 1.75 1 152 ASP -0.64 -1.19 1 153 LYS 3.59 2.61 1 154 ASP -1.89 0.79 1 155 ARG -3.97 -0.02 1 156 ILE -4.35 -0.18 1 157 ILE -0.56 0.02 1 162 LYS -6.91 -2.54 1 164 ASN -1.99 -2.44 1 165 TYR 5.07 3.58 1 166 ALA 2.95 2.52 1 168 PHE 1.60 2.10 1 169 MET 1.66 2.39 1 176 ASN -0.20 -0.56 1 178 GLU -6.22 -2.68 1 179 THR -2.54 -1.93 1 180 GLN -4.77 -0.27 1 181 LYS 0.59 -0.01 1 182 TRP -4.11 -1.12 1 183 SER -0.59 -0.79 1 185 ASN 1.91 1.23 1 187 ASP -6.25 -2.27 1 188 THR 0.72 0.74 1 189 ARG -7.28 -2.48 1 190 VAL 0.51 0.23 1 193 PHE -5.99 -1.66 1 194 ALA -0.07 0.69 1 195 LEU -1.15 0.90 1 196 SER -4.37 -2.51 1 197 ASP 2.40 1.31 1 198 ILE -3.05 0.16 1 199 LYS -1.44 -1.00 1 200 ALA 2.73 2.19 1 202 THR 2.33 1.86 1 203 GLU 1.07 0.64 1 204 LEU -2.55 -1.10 1 205 THR -6.32 -2.47 1 208 TYR 1.32 -0.42 1 209 ASN 2.54 2.55 1 210 LEU 2.45 1.58 1 211 GLU -0.82 0.87 1 213 LEU -1.71 -0.20 1 215 ASN -0.21 0.54 1 217 LYS 0.49 -0.36 1 218 THR 0.79 1.26 1 219 VAL 1.55 1.11 1 224 ALA -0.17 1.06 1 226 ASN 0.20 -1.24 1 228 SER 1.16 1.70 1 230 PHE -4.38 -0.94 1 231 LEU 0.88 -0.65 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26767_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 4.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.06 _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 6.82 _LACS_plot.Line_2_terminator_val_y_2 -1.27 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 LEU 6.82 -6.10 0 10 ASP 0.50 0.15 1 11 ARG 1.01 -0.38 1 12 LYS 1.28 -0.29 1 13 ASN 0.16 0.22 1 14 ASP 0.24 0.20 1 15 LYS 0.39 0.16 1 16 LYS -1.30 0.83 1 20 TYR -3.58 1.48 1 21 LYS -0.95 -0.28 1 22 HIS -0.91 1.81 1 23 ILE -4.38 3.12 1 24 LYS -1.61 2.50 1 25 VAL -6.71 3.29 1 26 ASN 0.98 0.16 1 27 ARG -5.01 2.36 1 29 ILE -2.73 -0.21 1 31 ARG 0.89 -0.60 1 32 VAL 2.24 -0.73 1 33 GLN -4.69 3.27 1 34 ILE -2.10 1.41 1 35 PHE -0.78 0.79 1 36 THR -2.70 1.51 1 37 ALA -2.82 1.60 1 38 ASP -2.10 2.01 1 39 LEU 3.80 -0.60 1 40 SER 2.89 -0.63 1 41 GLU -1.77 0.91 1 42 ILE -0.14 -0.41 1 44 ARG -3.82 2.46 1 46 ASN -2.17 1.21 1 48 LYS -4.89 2.83 1 49 ALA 2.57 -0.19 1 50 THR -0.12 -0.81 1 51 ASP 1.11 -0.33 1 52 GLU 2.88 0.19 1 53 ASN -0.76 1.06 1 59 SER -1.71 2.41 1 60 GLU 0.78 -1.57 1 62 ILE 2.95 0.06 1 63 ASN 5.26 -2.50 1 64 ARG 4.67 -0.14 1 65 MET 3.02 0.30 1 66 LEU -0.82 -0.37 1 68 TYR -3.34 1.43 1 73 THR 3.66 -0.83 1 74 VAL -0.80 1.30 1 77 ALA -0.23 0.19 1 80 ARG 0.63 -0.10 1 83 ASN -1.98 0.89 1 84 GLN -1.07 0.47 1 88 LYS 1.67 0.00 1 89 ARG 4.94 -3.68 1 90 GLN 0.39 -1.42 1 91 TYR -3.78 0.20 1 93 GLU 0.96 0.45 1 94 VAL -7.12 3.83 1 95 GLU -6.25 4.12 1 96 ILE -0.74 0.58 1 97 PHE -4.85 2.74 1 98 ARG -0.17 -0.41 1 99 THR -0.65 -0.01 1 102 ARG -0.88 -1.02 1 104 TRP 0.00 0.56 1 107 ARG -5.18 2.70 1 108 THR -2.43 0.08 1 109 LYS 1.04 -1.15 1 110 THR -3.91 1.81 1 111 ASP 1.70 -0.54 1 112 ILE -4.00 3.66 1 113 LYS -2.14 1.08 1 114 LYS 2.86 0.27 1 116 GLU 0.33 1.06 1 117 PHE -0.53 0.70 1 119 ASN -4.21 2.89 1 120 GLU -5.58 2.80 1 122 VAL -5.07 1.95 1 124 GLU -1.13 1.21 1 125 LEU -4.23 2.71 1 126 ILE -5.34 3.27 1 127 ASP -3.96 0.89 1 128 GLU 3.79 -0.01 1 129 GLU 3.66 -0.37 1 130 GLU 2.38 -0.65 1 132 ARG 4.94 -0.84 1 133 ALA 4.13 -1.00 1 134 ARG 3.91 0.25 1 135 ILE 6.24 -0.91 1 136 ARG 4.99 -1.07 1 137 TYR 4.69 -0.33 1 138 ALA 3.70 -0.13 1 139 GLN 4.23 -0.86 1 140 GLU 1.39 0.00 1 141 HIS 2.23 -0.93 1 142 ASP 3.56 -1.80 1 144 THR 0.19 -0.42 1 145 ASN -2.91 3.13 1 148 MET -2.46 2.52 1 149 LEU -3.89 4.19 1 150 THR 4.00 -0.19 1 151 LEU 0.79 0.96 1 152 ASP -0.64 -0.55 1 153 LYS 3.59 -0.98 1 154 ASP -1.89 2.68 1 155 ARG -3.97 3.95 1 156 ILE -4.35 4.17 1 157 ILE -0.56 0.58 1 162 LYS -6.91 4.37 1 164 ASN -1.99 -0.45 1 165 TYR 5.07 -1.49 1 166 ALA 2.95 -0.43 1 168 PHE 1.60 0.50 1 169 MET 1.66 0.73 1 176 ASN -0.20 -0.36 1 178 GLU -6.22 3.54 1 179 THR -2.54 0.61 1 180 GLN -4.77 4.50 1 181 LYS 0.59 -0.60 1 182 TRP -4.11 2.99 1 183 SER -0.59 -0.20 1 185 ASN 1.91 -0.68 1 187 ASP -6.25 3.98 1 188 THR 0.72 0.02 1 189 ARG -7.28 4.80 1 190 VAL 0.51 -0.28 1 193 PHE -5.99 4.33 1 194 ALA -0.07 0.76 1 195 LEU -1.15 2.05 1 196 SER -4.37 1.86 1 197 ASP 2.40 -1.09 1 198 ILE -3.05 3.21 1 199 LYS -1.44 0.44 1 200 ALA 2.73 -0.54 1 202 THR 2.33 -0.47 1 203 GLU 1.07 -0.43 1 204 LEU -2.55 1.45 1 205 THR -6.32 3.85 1 208 TYR 1.32 -1.74 1 209 ASN 2.54 0.01 1 210 LEU 2.45 -0.87 1 211 GLU -0.82 1.69 1 213 LEU -1.71 1.51 1 215 ASN -0.21 0.75 1 217 LYS 0.49 -0.85 1 218 THR 0.79 0.47 1 219 VAL 1.55 -0.44 1 224 ALA -0.17 1.23 1 226 ASN 0.20 -1.44 1 228 SER 1.16 0.54 1 230 PHE -4.38 3.44 1 231 LEU 0.88 -1.53 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26767_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -2.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.82 _LACS_plot.Line_2_terminator_val_x_2 6.82 _LACS_plot.Line_2_terminator_val_y_2 1.90 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 LEU 6.82 -2.76 0 10 ASP 0.50 0.59 1 11 ARG 1.01 0.59 1 12 LYS 1.28 0.24 1 14 ASP 0.24 0.13 1 15 LYS 0.39 -0.44 1 20 TYR -3.58 -3.13 1 21 LYS -0.95 -2.50 1 22 HIS -0.91 2.31 1 23 ILE -4.38 -2.43 1 24 LYS -1.61 0.96 1 25 VAL -6.71 -2.63 1 26 ASN 0.98 0.77 1 29 ILE -2.73 1.19 1 31 ARG 0.89 0.21 1 32 VAL 2.24 -1.99 1 33 GLN -4.69 -1.62 1 34 ILE -2.10 -0.54 1 35 PHE -0.78 -1.30 1 36 THR -2.70 -0.92 1 37 ALA -2.82 -0.24 1 38 ASP -2.10 1.27 1 39 LEU 3.80 1.30 1 40 SER 2.89 0.80 1 41 GLU -1.77 -0.03 1 44 ARG -3.82 -0.21 1 46 ASN -2.17 1.16 1 48 LYS -4.89 1.51 1 49 ALA 2.57 -0.09 1 50 THR -0.12 0.77 1 51 ASP 1.11 -0.42 1 52 GLU 2.88 0.68 1 59 SER -1.71 0.21 1 60 GLU 0.78 -1.53 1 62 ILE 2.95 0.89 1 63 ASN 5.26 2.52 1 64 ARG 4.67 3.83 1 65 MET 3.02 0.59 1 66 LEU -0.82 -2.59 1 68 TYR -3.34 0.24 1 73 THR 3.66 -0.06 1 74 VAL -0.80 -0.66 1 77 ALA -0.23 0.28 1 80 ARG 0.63 -1.23 1 83 ASN -1.98 -0.98 1 84 GLN -1.07 -0.17 1 88 LYS 1.67 -0.43 1 89 ARG 4.94 -1.66 1 90 GLN 0.39 -1.41 1 93 GLU 0.96 -1.02 1 94 VAL -7.12 -1.65 1 95 GLU -6.25 -2.24 1 96 ILE -0.74 -0.25 1 97 PHE -4.85 -4.27 1 98 ARG -0.17 -0.93 1 102 ARG -0.88 -2.09 1 104 TRP 0.00 0.01 1 107 ARG -5.18 -1.12 1 108 THR -2.43 0.47 1 109 LYS 1.04 -1.29 1 110 THR -3.91 -2.11 1 111 ASP 1.70 0.15 1 112 ILE -4.00 -0.97 1 113 LYS -2.14 -0.95 1 114 LYS 2.86 0.01 1 116 GLU 0.33 -0.66 1 117 PHE -0.53 -1.40 1 119 ASN -4.21 -3.71 1 120 GLU -5.58 -2.59 1 122 VAL -5.07 -1.11 1 124 GLU -1.13 -0.96 1 125 LEU -4.23 -2.99 1 126 ILE -5.34 -2.11 1 127 ASP -3.96 0.35 1 128 GLU 3.79 1.94 1 129 GLU 3.66 2.68 1 130 GLU 2.38 1.59 1 132 ARG 4.94 3.27 1 133 ALA 4.13 3.37 1 134 ARG 3.91 4.46 1 135 ILE 6.24 1.32 1 136 ARG 4.99 2.35 1 137 TYR 4.69 3.51 1 138 ALA 3.70 2.55 1 139 GLN 4.23 4.22 1 140 GLU 1.39 0.34 1 141 HIS 2.23 -1.54 1 144 THR 0.19 -0.05 1 145 ASN -2.91 -3.25 1 148 MET -2.46 -0.65 1 149 LEU -3.89 -1.97 1 150 THR 4.00 -1.88 1 151 LEU 0.79 -2.28 1 152 ASP -0.64 -0.71 1 153 LYS 3.59 -0.24 1 154 ASP -1.89 -0.17 1 155 ARG -3.97 -2.69 1 156 ILE -4.35 -2.73 1 157 ILE -0.56 -1.05 1 162 LYS -6.91 -3.22 1 164 ASN -1.99 0.73 1 165 TYR 5.07 1.83 1 166 ALA 2.95 0.36 1 168 PHE 1.60 -1.63 1 169 MET 1.66 1.92 1 176 ASN -0.20 0.38 1 178 GLU -6.22 -1.33 1 179 THR -2.54 1.45 1 180 GLN -4.77 -0.23 1 181 LYS 0.59 -1.15 1 182 TRP -4.11 -0.57 1 183 SER -0.59 -0.10 1 185 ASN 1.91 0.34 1 187 ASP -6.25 -1.59 1 188 THR 0.72 -1.34 1 189 ARG -7.28 -1.18 1 190 VAL 0.51 -0.37 1 193 PHE -5.99 0.03 1 194 ALA -0.07 2.80 1 195 LEU -1.15 -1.70 1 196 SER -4.37 -2.99 1 197 ASP 2.40 1.09 1 198 ILE -3.05 -1.02 1 199 LYS -1.44 1.39 1 200 ALA 2.73 -0.80 1 202 THR 2.33 -0.86 1 203 GLU 1.07 -0.66 1 204 LEU -2.55 -2.00 1 205 THR -6.32 -1.53 1 208 TYR 1.32 2.38 1 209 ASN 2.54 0.44 1 210 LEU 2.45 0.60 1 211 GLU -0.82 0.00 1 213 LEU -1.71 -1.13 1 215 ASN -0.21 0.81 1 217 LYS 0.49 -0.04 1 218 THR 0.79 -1.11 1 219 VAL 1.55 -1.13 1 226 ASN 0.20 -0.81 1 228 SER 1.16 1.24 1 230 PHE -4.38 -2.44 1 231 LEU 0.88 -2.06 1 stop_ save_