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 bmr11441_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.66 _LACS_plot.Line_1_terminator_val_y_1 -3.96 _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 -0.85 _LACS_plot.Line_2_terminator_val_x_2 8.50 _LACS_plot.Line_2_terminator_val_y_2 5.75 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 116 LEU -8.66 -2.56 0 96 ARG -7.25 -0.74 0 10 ALA 3.22 2.34 1 11 VAL 4.31 2.88 1 12 PHE 3.54 4.60 1 13 GLU 3.37 2.32 1 15 TRP -2.50 -1.69 1 16 PHE -0.53 0.03 1 18 ASN -1.23 -1.05 1 19 ARG -1.79 -1.22 1 20 ASN -0.21 0.71 1 22 PHE 0.20 2.97 1 23 TYR -0.46 0.69 1 24 THR -5.78 -3.59 1 25 TYR 3.40 2.91 1 26 ASP 3.64 2.54 1 28 LEU 6.19 2.35 1 29 VAL 6.30 4.74 1 30 SER 3.84 2.95 1 31 ALA 0.93 2.18 1 33 ASN 3.22 2.30 1 35 TYR -1.88 0.08 1 37 GLU 2.10 1.13 1 38 PHE 4.07 1.81 1 40 THR -1.00 -0.89 1 41 THR 0.60 1.67 1 43 SER -2.47 -0.68 1 44 LEU 4.24 2.93 1 45 ASP 3.85 2.77 1 46 ASP 3.23 3.13 1 47 GLN 3.62 2.87 1 48 LYS 2.32 3.27 1 49 ARG 4.07 5.34 1 50 GLU 7.87 4.85 1 51 LEU 1.95 0.05 1 52 ALA 2.08 3.18 1 53 ALA 2.36 2.96 1 54 PHE 3.19 2.95 1 55 LEU 5.47 2.43 1 57 ASN 4.67 5.12 1 58 ILE 5.06 1.79 1 59 ASN 5.81 4.45 1 60 GLN 3.55 1.95 1 61 GLU 2.32 2.18 1 62 SER -3.04 -0.60 1 65 LEU 4.47 -0.04 1 66 GLN 0.82 1.98 1 67 PHE 1.28 1.31 1 68 ILE 1.93 2.51 1 69 GLN -5.01 -2.05 1 70 GLU -0.36 0.39 1 71 GLN -0.16 -0.06 1 72 ASN 1.25 1.04 1 74 GLN -1.10 -0.70 1 75 SER -2.70 -2.42 1 76 ASP 1.11 0.32 1 77 TYR 3.65 0.92 1 79 ASP -1.37 -1.54 1 80 THR 2.52 1.51 1 81 SER 1.80 1.62 1 82 SER 0.02 -1.02 1 83 THR 2.67 1.50 1 84 GLN 2.22 1.57 1 85 TYR -2.46 -2.46 1 88 ALA -1.40 -1.01 1 89 ALA 2.33 1.10 1 91 LYS -3.07 -3.85 1 92 GLN -6.84 -1.95 1 93 TYR 2.37 -0.83 1 99 ILE -3.41 -2.91 1 100 GLN 4.74 0.46 1 101 LEU 1.38 1.67 1 102 SER -3.39 -0.07 1 103 TRP 6.45 3.42 1 104 ASN 6.60 4.31 1 105 TYR 1.85 -0.56 1 106 ASN 4.15 2.53 1 107 TYR 6.44 4.98 1 109 GLU 2.98 2.80 1 110 ALA 4.88 1.79 1 112 ALA 3.66 2.59 1 113 ASP 3.39 2.70 1 114 LEU -1.02 -0.08 1 117 ASP 0.62 -1.85 1 118 LEU 1.02 0.24 1 119 LEU 2.05 1.95 1 120 ASN 1.11 0.84 1 121 ASN -0.23 -1.05 1 123 ASP 2.38 2.60 1 124 LEU 2.14 2.69 1 125 VAL 4.72 3.65 1 126 ALA -2.84 -1.48 1 127 GLN -0.84 0.26 1 128 ASP -3.81 -1.69 1 129 SER 3.86 2.29 1 131 VAL 7.62 5.45 1 132 ALA 5.58 4.28 1 133 TRP 1.74 3.47 1 134 ARG 5.67 5.73 1 135 THR 4.65 4.66 1 136 ALA 1.36 2.19 1 137 LEU 2.03 2.21 1 138 TRP 5.86 4.13 1 139 PHE 3.34 4.08 1 140 TRP 2.13 3.30 1 141 MET 2.96 -0.40 1 142 LYS 3.31 1.75 1 143 ARG 2.24 -1.60 1 144 ASP 3.93 1.77 1 146 HIS 1.91 3.33 1 148 ALA 4.24 1.99 1 149 ILE -3.34 -2.66 1 150 THR 0.96 0.06 1 151 ALA -0.74 -0.46 1 152 SER -3.95 -3.09 1 155 SER -3.21 -2.98 1 156 PHE 5.28 4.89 1 157 SER 2.94 3.18 1 159 THR 5.00 2.98 1 160 ILE 6.15 4.78 1 161 ARG 4.27 3.49 1 162 ILE 3.59 3.72 1 163 ILE 4.48 4.69 1 164 ASN -1.18 -0.89 1 167 LEU -1.58 -0.32 1 168 GLU -1.47 1.14 1 170 ASN 2.92 1.45 1 171 GLN -2.13 -1.77 1 173 ALA 2.56 1.06 1 175 SER -2.22 -0.39 1 176 ILE 4.41 3.21 1 178 ASN 1.11 4.20 1 179 MET 4.05 3.26 1 180 GLN 5.81 3.98 1 181 MET 8.50 5.06 1 182 GLU 2.73 1.78 1 183 ASN 4.18 2.32 1 184 ARG 6.11 4.92 1 185 VAL 6.33 5.02 1 186 THR 7.14 5.43 1 187 TYR 2.10 0.09 1 188 TYR 1.74 2.30 1 189 THR 6.16 4.95 1 190 GLN 3.60 -0.48 1 191 PHE 5.55 3.67 1 193 GLN 5.87 5.24 1 194 THR -0.47 -0.32 1 195 LEU -7.38 -4.12 1 197 VAL -0.03 -0.16 1 201 THR 0.72 -1.35 1 202 ASP -0.44 2.06 1 203 LEU -2.86 -0.85 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11441_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.66 _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 -1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.15 _LACS_plot.Line_2_terminator_val_x_2 8.50 _LACS_plot.Line_2_terminator_val_y_2 -2.75 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 116 LEU -8.66 6.10 0 96 ARG -7.25 6.51 0 10 ALA 3.22 -0.88 1 11 VAL 4.31 -1.43 1 12 PHE 3.54 1.06 1 13 GLU 3.37 -1.05 1 15 TRP -2.50 0.81 1 16 PHE -0.53 0.56 1 18 ASN -1.23 0.18 1 19 ARG -1.79 0.57 1 20 ASN -0.21 0.92 1 22 PHE 0.20 2.77 1 23 TYR -0.46 1.15 1 24 THR -5.78 2.19 1 25 TYR 3.40 -0.49 1 26 ASP 3.64 -1.10 1 28 LEU 6.19 -3.84 1 29 VAL 6.30 -1.56 1 30 SER 3.84 -0.89 1 31 ALA 0.93 1.25 1 33 ASN 3.22 -0.92 1 35 TYR -1.88 1.96 1 37 GLU 2.10 -0.97 1 38 PHE 4.07 -2.26 1 40 THR -1.00 0.11 1 41 THR 0.60 1.07 1 43 SER -2.47 1.79 1 44 LEU 4.24 -1.31 1 45 ASP 3.85 -1.08 1 46 ASP 3.23 -0.10 1 47 GLN 3.62 -0.75 1 48 LYS 2.32 0.95 1 49 ARG 4.07 1.27 1 50 GLU 7.87 -3.02 1 51 LEU 1.95 -1.90 1 52 ALA 2.08 1.10 1 53 ALA 2.36 0.60 1 54 PHE 3.19 -0.24 1 55 LEU 5.47 -3.04 1 57 ASN 4.67 0.45 1 58 ILE 5.06 -3.27 1 59 ASN 5.81 -1.36 1 60 GLN 3.55 -1.60 1 61 GLU 2.32 -0.14 1 62 SER -3.04 2.44 1 65 LEU 4.47 -4.51 1 66 GLN 0.82 1.16 1 67 PHE 1.28 0.03 1 68 ILE 1.93 0.58 1 69 GLN -5.01 2.96 1 70 GLU -0.36 0.75 1 71 GLN -0.16 0.10 1 72 ASN 1.25 -0.21 1 74 GLN -1.10 0.40 1 75 SER -2.70 0.28 1 76 ASP 1.11 -0.79 1 77 TYR 3.65 -2.73 1 79 ASP -1.37 -0.17 1 80 THR 2.52 -1.01 1 81 SER 1.80 -0.18 1 82 SER 0.02 -1.04 1 83 THR 2.67 -1.17 1 84 GLN 2.22 -0.65 1 85 TYR -2.46 0.00 1 88 ALA -1.40 0.39 1 89 ALA 2.33 -1.23 1 91 LYS -3.07 -0.78 1 92 GLN -6.84 4.89 1 93 TYR 2.37 -3.20 1 99 ILE -3.41 0.50 1 100 GLN 4.74 -4.28 1 101 LEU 1.38 0.29 1 102 SER -3.39 3.32 1 103 TRP 6.45 -3.03 1 104 ASN 6.60 -2.29 1 105 TYR 1.85 -2.41 1 106 ASN 4.15 -1.62 1 107 TYR 6.44 -1.46 1 109 GLU 2.98 -0.18 1 110 ALA 4.88 -3.09 1 112 ALA 3.66 -1.07 1 113 ASP 3.39 -0.69 1 114 LEU -1.02 0.94 1 117 ASP 0.62 -2.47 1 118 LEU 1.02 -0.78 1 119 LEU 2.05 -0.10 1 120 ASN 1.11 -0.27 1 121 ASN -0.23 -0.82 1 123 ASP 2.38 0.22 1 124 LEU 2.14 0.55 1 125 VAL 4.72 -1.07 1 126 ALA -2.84 1.36 1 127 GLN -0.84 1.10 1 128 ASP -3.81 2.12 1 129 SER 3.86 -1.57 1 131 VAL 7.62 -2.17 1 132 ALA 5.58 -1.30 1 133 TRP 1.74 1.73 1 134 ARG 5.67 0.06 1 135 THR 4.65 0.01 1 136 ALA 1.36 0.83 1 137 LEU 2.03 0.18 1 138 TRP 5.86 -1.73 1 139 PHE 3.34 0.74 1 140 TRP 2.13 1.17 1 141 MET 2.96 -3.36 1 142 LYS 3.31 -1.56 1 143 ARG 2.24 -3.84 1 144 ASP 3.93 -2.16 1 146 HIS 1.91 1.42 1 148 ALA 4.24 -2.25 1 149 ILE -3.34 0.68 1 150 THR 0.96 -0.90 1 151 ALA -0.74 0.28 1 152 SER -3.95 0.86 1 155 SER -3.21 0.23 1 156 PHE 5.28 -0.39 1 157 SER 2.94 0.24 1 159 THR 5.00 -2.02 1 160 ILE 6.15 -1.37 1 161 ARG 4.27 -0.78 1 162 ILE 3.59 0.13 1 163 ILE 4.48 0.21 1 164 ASN -1.18 0.29 1 167 LEU -1.58 1.26 1 168 GLU -1.47 2.61 1 170 ASN 2.92 -1.47 1 171 GLN -2.13 0.36 1 173 ALA 2.56 -1.50 1 175 SER -2.22 1.83 1 176 ILE 4.41 -1.20 1 178 ASN 1.11 3.09 1 179 MET 4.05 -0.79 1 180 GLN 5.81 -1.83 1 181 MET 8.50 -3.44 1 182 GLU 2.73 -0.95 1 183 ASN 4.18 -1.86 1 184 ARG 6.11 -1.19 1 185 VAL 6.33 -1.31 1 186 THR 7.14 -1.71 1 187 TYR 2.10 -2.01 1 188 TYR 1.74 0.56 1 189 THR 6.16 -1.21 1 190 GLN 3.60 -4.08 1 191 PHE 5.55 -1.88 1 193 GLN 5.87 -0.63 1 194 THR -0.47 0.15 1 195 LEU -7.38 3.26 1 197 VAL -0.03 -0.13 1 201 THR 0.72 -2.07 1 202 ASP -0.44 2.50 1 203 LEU -2.86 2.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11441_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.66 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.63 _LACS_plot.Line_2_terminator_val_x_2 8.50 _LACS_plot.Line_2_terminator_val_y_2 2.79 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 116 LEU -8.66 -0.92 0 125 VAL 4.72 -3.53 0 96 ARG -7.25 1.23 0 10 ALA 3.22 3.24 1 11 VAL 4.31 0.95 1 12 PHE 3.54 0.43 1 13 GLU 3.37 2.08 1 15 TRP -2.50 0.49 1 18 ASN -1.23 -1.21 1 19 ARG -1.79 -0.96 1 20 ASN -0.21 1.59 1 23 TYR -0.46 0.17 1 24 THR -5.78 -0.44 1 25 TYR 3.40 0.68 1 26 ASP 3.64 2.38 1 28 LEU 6.19 0.59 1 29 VAL 6.30 3.49 1 30 SER 3.84 3.33 1 31 ALA 0.93 2.41 1 33 ASN 3.22 1.67 1 35 TYR -1.88 -1.58 1 37 GLU 2.10 2.44 1 38 PHE 4.07 -0.23 1 40 THR -1.00 -0.41 1 41 THR 0.60 -1.63 1 43 SER -2.47 0.06 1 44 LEU 4.24 0.50 1 45 ASP 3.85 1.34 1 46 ASP 3.23 1.44 1 47 GLN 3.62 2.69 1 48 LYS 2.32 1.80 1 49 ARG 4.07 3.15 1 50 GLU 7.87 1.00 1 51 LEU 1.95 2.07 1 52 ALA 2.08 2.52 1 53 ALA 2.36 2.35 1 54 PHE 3.19 1.14 1 55 LEU 5.47 1.74 1 57 ASN 4.67 2.99 1 58 ILE 5.06 3.24 1 59 ASN 5.81 1.35 1 60 GLN 3.55 1.31 1 61 GLU 2.32 -0.03 1 62 SER -3.04 0.76 1 65 LEU 4.47 -2.37 1 66 GLN 0.82 0.14 1 67 PHE 1.28 -1.40 1 68 ILE 1.93 -2.13 1 69 GLN -5.01 -2.69 1 70 GLU -0.36 -1.82 1 71 GLN -0.16 -0.49 1 72 ASN 1.25 -1.81 1 74 GLN -1.10 -1.48 1 75 SER -2.70 -2.19 1 76 ASP 1.11 0.17 1 77 TYR 3.65 -3.51 1 79 ASP -1.37 1.71 1 80 THR 2.52 0.76 1 81 SER 1.80 0.31 1 82 SER 0.02 1.08 1 83 THR 2.67 0.98 1 84 GLN 2.22 -0.86 1 85 TYR -2.46 -4.26 1 88 ALA -1.40 -0.01 1 89 ALA 2.33 1.38 1 91 LYS -3.07 -0.71 1 92 GLN -6.84 -0.37 1 93 TYR 2.37 -2.66 1 99 ILE -3.41 -1.52 1 100 GLN 4.74 -1.04 1 101 LEU 1.38 -2.16 1 102 SER -3.39 -1.25 1 103 TRP 6.45 2.00 1 104 ASN 6.60 0.34 1 105 TYR 1.85 1.09 1 106 ASN 4.15 1.21 1 107 TYR 6.44 2.58 1 109 GLU 2.98 0.60 1 110 ALA 4.88 1.76 1 112 ALA 3.66 2.68 1 113 ASP 3.39 2.29 1 114 LEU -1.02 -0.49 1 117 ASP 0.62 0.44 1 118 LEU 1.02 -0.70 1 119 LEU 2.05 1.15 1 120 ASN 1.11 -0.49 1 121 ASN -0.23 -2.18 1 124 LEU 2.14 0.44 1 126 ALA -2.84 -2.17 1 127 GLN -0.84 0.04 1 128 ASP -3.81 -0.76 1 129 SER 3.86 1.67 1 131 VAL 7.62 1.61 1 132 ALA 5.58 4.14 1 133 TRP 1.74 3.03 1 134 ARG 5.67 2.79 1 135 THR 4.65 0.34 1 136 ALA 1.36 1.92 1 137 LEU 2.03 -0.52 1 138 TRP 5.86 0.61 1 140 TRP 2.13 1.89 1 141 MET 2.96 3.18 1 142 LYS 3.31 2.41 1 143 ARG 2.24 -0.74 1 144 ASP 3.93 1.67 1 146 HIS 1.91 2.25 1 148 ALA 4.24 1.77 1 149 ILE -3.34 -2.25 1 150 THR 0.96 -2.29 1 151 ALA -0.74 -3.34 1 152 SER -3.95 0.16 1 155 SER -3.21 -1.07 1 156 PHE 5.28 4.76 1 157 SER 2.94 1.65 1 159 THR 5.00 -0.12 1 160 ILE 6.15 1.82 1 161 ARG 4.27 3.15 1 162 ILE 3.59 0.98 1 163 ILE 4.48 0.85 1 164 ASN -1.18 1.25 1 167 LEU -1.58 -0.03 1 168 GLU -1.47 -0.23 1 170 ASN 2.92 -0.50 1 173 ALA 2.56 1.17 1 175 SER -2.22 0.30 1 176 ILE 4.41 1.89 1 178 ASN 1.11 1.00 1 179 MET 4.05 2.47 1 180 GLN 5.81 0.46 1 181 MET 8.50 2.11 1 182 GLU 2.73 3.07 1 183 ASN 4.18 1.04 1 184 ARG 6.11 1.56 1 185 VAL 6.33 2.84 1 186 THR 7.14 0.68 1 187 TYR 2.10 0.35 1 188 TYR 1.74 2.03 1 189 THR 6.16 2.90 1 190 GLN 3.60 3.53 1 191 PHE 5.55 4.19 1 193 GLN 5.87 1.54 1 194 THR -0.47 -1.72 1 195 LEU -7.38 -3.90 1 197 VAL -0.03 1.31 1 201 THR 0.72 -0.94 1 202 ASP -0.44 -3.45 1 203 LEU -2.86 -0.09 1 stop_ save_