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 bmr15651_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 -3.44 _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 -1.71 _LACS_plot.Line_2_terminator_val_x_2 4.32 _LACS_plot.Line_2_terminator_val_y_2 2.00 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 ASN 1.76 3.23 0 10 LEU 0.76 -0.24 1 11 ASN 0.03 -0.40 1 12 ALA -0.11 -0.55 1 13 ALA -0.09 -0.70 1 15 LYS 0.08 -0.77 1 16 ASP 1.09 0.21 1 17 ASN 2.74 0.85 1 18 THR -3.38 -1.65 1 19 TRP -3.67 -1.80 1 20 TYR -3.81 -2.10 1 21 ALA -4.57 -1.53 1 24 LYS -5.81 -2.14 1 25 LEU -5.54 -1.65 1 32 ASP -0.59 -0.46 1 33 THR 0.95 0.11 1 35 PHE 1.01 0.22 1 36 TYR 0.74 -0.33 1 38 ASN 0.33 -0.15 1 40 PHE 0.95 -0.14 1 41 GLN 0.67 -0.21 1 42 ASN 0.39 -0.18 1 43 ASN 0.14 -0.18 1 47 THR -0.22 -0.45 1 48 ARG 0.47 -0.28 1 49 ASN 0.05 -0.09 1 50 ASP -0.07 0.09 1 51 GLN -2.21 -1.19 1 52 LEU -1.39 -0.77 1 54 ALA -5.60 -1.79 1 56 ALA -6.03 -2.86 1 57 PHE -3.80 -1.63 1 60 TYR -5.53 -2.62 1 61 GLN -0.21 -1.58 1 62 VAL 3.45 2.45 1 63 ASN 1.79 0.28 1 65 TYR -2.17 -1.78 1 66 LEU -4.23 -1.67 1 68 PHE -4.02 -1.19 1 69 GLU -5.72 -1.66 1 70 MET -5.57 -2.31 1 72 TYR -4.80 -1.99 1 73 ASP -3.01 -1.34 1 78 MET -0.65 -1.01 1 79 ALA -1.30 -1.29 1 80 TYR -0.50 -0.88 1 81 LYS 1.61 0.08 1 83 SER -0.11 -0.61 1 84 VAL 0.76 -0.43 1 85 ASP 0.25 -0.22 1 86 ASN -0.34 1.25 1 88 ALA -1.49 -0.77 1 91 ALA -4.18 -1.96 1 94 VAL -3.61 -3.20 1 95 GLN -7.57 -3.15 1 96 LEU -0.05 -1.36 1 97 THR -6.05 -2.87 1 98 ALA -2.58 -2.52 1 99 LYS -2.10 -2.18 1 100 LEU -2.89 -2.40 1 102 TYR -5.30 -1.36 1 104 ILE 2.07 0.95 1 105 THR -3.87 -2.62 1 106 ASP 3.34 2.27 1 107 ASP -1.85 -1.29 1 108 LEU -3.00 -0.65 1 109 ASP -3.48 -1.82 1 110 ILE -2.57 -1.97 1 111 TYR -4.41 -1.72 1 112 THR -5.43 -3.55 1 113 ARG -3.38 -2.01 1 114 LEU -4.54 -1.76 1 117 MET -6.44 -2.14 1 118 VAL -1.20 -2.32 1 119 TRP -8.14 -4.17 1 120 ARG -3.84 -1.32 1 121 ALA -4.17 -2.13 1 122 ASP -1.70 -0.31 1 123 SER -1.16 -0.97 1 124 LYS 0.54 -0.16 1 126 ASN 0.12 -0.34 1 127 TYR 0.96 -0.14 1 128 ALA 0.65 -0.18 1 129 SER 0.73 -0.10 1 130 THR 0.21 -0.28 1 132 VAL 0.40 -0.56 1 133 SER 0.12 -0.54 1 134 ARG 0.16 -0.54 1 135 SER -0.04 -0.57 1 136 GLU -0.44 -0.52 1 137 HIS -1.40 -0.21 1 138 ASP -1.67 -0.61 1 139 THR -4.26 -2.60 1 141 VAL -2.87 -2.46 1 144 VAL -3.94 -2.43 1 145 PHE -5.85 -2.76 1 146 ALA -5.91 -2.77 1 149 VAL -5.56 -4.00 1 150 GLU -4.99 -1.98 1 151 TRP -5.48 -3.39 1 152 ALA 0.81 -1.08 1 153 VAL 3.02 1.40 1 154 THR -4.60 -3.14 1 155 ARG 4.32 2.46 1 156 ASP -1.89 -0.66 1 157 ILE -1.92 -1.75 1 158 ALA -5.41 -3.08 1 159 THR -3.23 -2.30 1 160 ARG -4.95 -2.93 1 161 LEU -3.71 -1.75 1 162 GLU -6.57 -2.70 1 163 TYR -3.78 -1.71 1 171 ASP -0.93 -0.68 1 172 ALA 0.49 -0.31 1 174 THR 0.00 -0.49 1 175 VAL 1.55 -0.07 1 177 THR -0.90 -1.19 1 178 ARG -0.64 -2.32 1 183 MET -4.71 -1.70 1 184 LEU -2.44 -1.98 1 185 SER -4.58 -1.80 1 186 LEU -4.97 -2.37 1 188 VAL -4.09 -2.46 1 189 SER -4.59 -2.30 1 190 TYR -4.90 -2.52 1 191 ARG -1.15 -1.54 1 192 PHE -0.35 -0.52 1 194 GLN 0.40 -0.27 1 195 GLU 0.07 -0.34 1 196 ASP 0.18 -0.22 1 197 ALA 0.02 -0.89 1 198 ALA 0.27 -0.50 1 200 VAL 0.91 -0.26 1 201 VAL 0.03 -0.95 1 202 ALA -0.19 -0.76 1 204 ALA 0.11 -0.63 1 206 ALA -1.75 -1.01 1 208 ALA -2.01 -1.03 1 210 GLU 0.09 -0.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15651_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 4.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 4.32 _LACS_plot.Line_2_terminator_val_y_2 -2.32 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 ASN 1.76 1.47 0 10 LEU 0.76 -1.00 1 11 ASN 0.03 -0.43 1 12 ALA -0.11 -0.44 1 13 ALA -0.09 -0.61 1 15 LYS 0.08 -0.85 1 16 ASP 1.09 -0.88 1 17 ASN 2.74 -1.89 1 18 THR -3.38 1.73 1 19 TRP -3.67 1.87 1 20 TYR -3.81 1.71 1 21 ALA -4.57 3.04 1 24 LYS -5.81 3.67 1 25 LEU -5.54 3.89 1 32 ASP -0.59 0.13 1 33 THR 0.95 -0.84 1 35 PHE 1.01 -0.79 1 36 TYR 0.74 -1.07 1 38 ASN 0.33 -0.48 1 40 PHE 0.95 -1.09 1 41 GLN 0.67 -0.88 1 42 ASN 0.39 -0.57 1 43 ASN 0.14 -0.32 1 47 THR -0.22 -0.23 1 48 ARG 0.47 -0.75 1 49 ASN 0.05 -0.14 1 50 ASP -0.07 0.16 1 51 GLN -2.21 1.02 1 52 LEU -1.39 0.62 1 54 ALA -5.60 3.81 1 56 ALA -6.03 3.17 1 57 PHE -3.80 2.17 1 60 TYR -5.53 2.91 1 61 GLN -0.21 -1.37 1 62 VAL 3.45 -1.00 1 63 ASN 1.79 -1.51 1 65 TYR -2.17 0.39 1 66 LEU -4.23 2.56 1 68 PHE -4.02 2.83 1 69 GLU -5.72 4.06 1 70 MET -5.57 3.26 1 72 TYR -4.80 2.81 1 73 ASP -3.01 1.67 1 78 MET -0.65 -0.36 1 79 ALA -1.30 0.01 1 80 TYR -0.50 -0.38 1 81 LYS 1.61 -1.53 1 83 SER -0.11 -0.50 1 84 VAL 0.76 -1.19 1 85 ASP 0.25 -0.47 1 86 ASN -0.34 1.59 1 88 ALA -1.49 0.72 1 91 ALA -4.18 2.22 1 94 VAL -3.61 0.41 1 95 GLN -7.57 4.42 1 96 LEU -0.05 -1.31 1 97 THR -6.05 3.18 1 98 ALA -2.58 0.06 1 99 LYS -2.10 -0.08 1 100 LEU -2.89 0.49 1 102 TYR -5.30 3.94 1 104 ILE 2.07 -1.12 1 105 THR -3.87 1.25 1 106 ASP 3.34 -1.07 1 107 ASP -1.85 0.56 1 108 LEU -3.00 2.35 1 109 ASP -3.48 1.66 1 110 ILE -2.57 0.60 1 111 TYR -4.41 2.69 1 112 THR -5.43 1.88 1 113 ARG -3.38 1.37 1 114 LEU -4.54 2.78 1 117 MET -6.44 4.30 1 118 VAL -1.20 -1.12 1 119 TRP -8.14 3.97 1 120 ARG -3.84 2.52 1 121 ALA -4.17 2.04 1 122 ASP -1.70 1.39 1 123 SER -1.16 0.19 1 124 LYS 0.54 -0.70 1 126 ASN 0.12 -0.46 1 127 TYR 0.96 -1.10 1 128 ALA 0.65 -0.83 1 129 SER 0.73 -0.83 1 130 THR 0.21 -0.49 1 132 VAL 0.40 -0.96 1 133 SER 0.12 -0.66 1 134 ARG 0.16 -0.70 1 135 SER -0.04 -0.53 1 136 GLU -0.44 -0.08 1 137 HIS -1.40 1.19 1 138 ASP -1.67 1.06 1 139 THR -4.26 1.66 1 141 VAL -2.87 0.41 1 144 VAL -3.94 1.51 1 145 PHE -5.85 3.09 1 146 ALA -5.91 3.14 1 149 VAL -5.56 1.56 1 150 GLU -4.99 3.01 1 151 TRP -5.48 2.09 1 152 ALA 0.81 -1.89 1 153 VAL 3.02 -1.62 1 154 THR -4.60 1.46 1 155 ARG 4.32 -1.86 1 156 ASP -1.89 1.23 1 157 ILE -1.92 0.17 1 158 ALA -5.41 2.33 1 159 THR -3.23 0.93 1 160 ARG -4.95 2.02 1 161 LEU -3.71 1.96 1 162 GLU -6.57 3.87 1 163 TYR -3.78 2.07 1 171 ASP -0.93 0.25 1 172 ALA 0.49 -0.80 1 174 THR 0.00 -0.49 1 175 VAL 1.55 -1.62 1 177 THR -0.90 -0.29 1 178 ARG -0.64 -1.68 1 183 MET -4.71 3.01 1 184 LEU -2.44 0.46 1 185 SER -4.58 2.78 1 186 LEU -4.97 2.60 1 188 VAL -4.09 1.63 1 189 SER -4.59 2.29 1 190 TYR -4.90 2.38 1 191 ARG -1.15 -0.39 1 192 PHE -0.35 -0.17 1 194 GLN 0.40 -0.67 1 195 GLU 0.07 -0.41 1 196 ASP 0.18 -0.40 1 197 ALA 0.02 -0.91 1 198 ALA 0.27 -0.77 1 200 VAL 0.91 -1.17 1 201 VAL 0.03 -0.98 1 202 ALA -0.19 -0.57 1 204 ALA 0.11 -0.74 1 206 ALA -1.75 0.74 1 208 ALA -2.01 0.98 1 210 GLU 0.09 -0.56 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15651_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 -3.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.30 _LACS_plot.Line_2_terminator_val_x_2 4.32 _LACS_plot.Line_2_terminator_val_y_2 0.79 _LACS_plot.Y_axis_chem_shift_offset 0.65 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 ASN 1.76 1.92 0 152 ALA 0.81 -2.72 0 119 TRP -8.14 -1.49 0 10 LEU 0.76 -0.95 1 11 ASN 0.03 -0.81 1 12 ALA -0.11 -1.15 1 13 ALA -0.09 -0.50 1 15 LYS 0.08 -0.92 1 16 ASP 1.09 -0.88 1 17 ASN 2.74 -0.97 1 18 THR -3.38 -2.38 1 19 TRP -3.67 -0.13 1 20 TYR -3.81 -2.22 1 21 ALA -4.57 -2.40 1 24 LYS -5.81 -3.63 1 25 LEU -5.54 -2.39 1 32 ASP -0.59 0.01 1 33 THR 0.95 0.59 1 35 PHE 1.01 -0.39 1 36 TYR 0.74 0.20 1 38 ASN 0.33 0.41 1 40 PHE 0.95 -0.15 1 41 GLN 0.67 -0.77 1 42 ASN 0.39 -0.58 1 43 ASN 0.14 -1.33 1 47 THR -0.22 -0.13 1 48 ARG 0.47 -0.40 1 49 ASN 0.05 -0.64 1 50 ASP -0.07 -0.60 1 51 GLN -2.21 -0.81 1 52 LEU -1.39 -1.58 1 54 ALA -5.60 -2.26 1 56 ALA -6.03 -1.33 1 57 PHE -3.80 -2.98 1 60 TYR -5.53 -2.45 1 61 GLN -0.21 -1.63 1 62 VAL 3.45 -0.54 1 63 ASN 1.79 -0.77 1 65 TYR -2.17 -0.75 1 66 LEU -4.23 -3.73 1 68 PHE -4.02 -2.41 1 69 GLU -5.72 -2.04 1 70 MET -5.57 -1.71 1 72 TYR -4.80 -2.62 1 73 ASP -3.01 -2.70 1 78 MET -0.65 -1.75 1 79 ALA -1.30 -1.17 1 80 TYR -0.50 -0.30 1 81 LYS 1.61 0.05 1 83 SER -0.11 0.03 1 84 VAL 0.76 -0.77 1 85 ASP 0.25 -1.56 1 86 ASN -0.34 0.77 1 88 ALA -1.49 -0.97 1 91 ALA -4.18 -3.02 1 94 VAL -3.61 -2.60 1 95 GLN -7.57 -1.97 1 96 LEU -0.05 -2.28 1 97 THR -6.05 -1.45 1 98 ALA -2.58 -2.85 1 99 LYS -2.10 -2.31 1 100 LEU -2.89 -2.34 1 102 TYR -5.30 -1.40 1 104 ILE 2.07 0.25 1 105 THR -3.87 -0.36 1 106 ASP 3.34 -0.61 1 107 ASP -1.85 -2.13 1 108 LEU -3.00 -3.28 1 109 ASP -3.48 -0.05 1 110 ILE -2.57 -2.66 1 111 TYR -4.41 -3.06 1 112 THR -5.43 -0.85 1 113 ARG -3.38 -1.26 1 114 LEU -4.54 -1.79 1 117 MET -6.44 -1.74 1 118 VAL -1.20 -2.31 1 120 ARG -3.84 -1.35 1 121 ALA -4.17 -1.85 1 122 ASP -1.70 -0.67 1 123 SER -1.16 -0.28 1 124 LYS 0.54 0.24 1 126 ASN 0.12 1.45 1 127 TYR 0.96 1.01 1 128 ALA 0.65 -0.04 1 129 SER 0.73 0.34 1 130 THR 0.21 0.50 1 132 VAL 0.40 -0.31 1 133 SER 0.12 -0.28 1 134 ARG 0.16 -0.38 1 135 SER -0.04 -0.24 1 136 GLU -0.44 -0.32 1 137 HIS -1.40 -0.57 1 138 ASP -1.67 -1.36 1 139 THR -4.26 -1.88 1 141 VAL -2.87 -0.26 1 144 VAL -3.94 -3.47 1 145 PHE -5.85 -2.14 1 146 ALA -5.91 -1.54 1 149 VAL -5.56 -2.14 1 150 GLU -4.99 -2.71 1 151 TRP -5.48 -1.73 1 153 VAL 3.02 0.31 1 154 THR -4.60 -0.82 1 155 ARG 4.32 0.45 1 156 ASP -1.89 -2.08 1 157 ILE -1.92 -2.22 1 158 ALA -5.41 -1.23 1 159 THR -3.23 -2.49 1 160 ARG -4.95 -2.20 1 161 LEU -3.71 -3.21 1 162 GLU -6.57 -3.22 1 163 TYR -3.78 -2.47 1 171 ASP -0.93 -0.55 1 172 ALA 0.49 0.31 1 174 THR 0.00 0.04 1 175 VAL 1.55 0.23 1 177 THR -0.90 -1.13 1 178 ARG -0.64 -2.37 1 183 MET -4.71 -2.25 1 184 LEU -2.44 -2.36 1 185 SER -4.58 -3.31 1 186 LEU -4.97 -2.27 1 188 VAL -4.09 -3.18 1 189 SER -4.59 -2.90 1 190 TYR -4.90 -1.84 1 191 ARG -1.15 -1.47 1 192 PHE -0.35 0.58 1 194 GLN 0.40 0.20 1 195 GLU 0.07 -0.45 1 196 ASP 0.18 -0.63 1 197 ALA 0.02 -0.95 1 198 ALA 0.27 0.97 1 200 VAL 0.91 -0.27 1 201 VAL 0.03 -1.17 1 202 ALA -0.19 -0.75 1 204 ALA 0.11 -0.20 1 206 ALA -1.75 -0.34 1 208 ALA -2.01 -0.49 1 210 GLU 0.09 -0.33 1 stop_ save_