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 bmr17328_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.01 _LACS_plot.Line_1_terminator_val_y_1 -2.02 _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 -1.99 _LACS_plot.Line_2_terminator_val_x_2 7.63 _LACS_plot.Line_2_terminator_val_y_2 5.27 _LACS_plot.Y_axis_chem_shift_offset 0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 139 ASP 0.68 -3.18 0 54 HIS 5.03 6.73 0 30 ARG -1.38 -1.07 1 31 LEU 0.61 -0.03 1 32 SER -2.06 -1.28 1 33 LYS 4.45 2.86 1 34 GLU 5.06 3.02 1 35 LEU 3.24 1.87 1 36 LEU 3.99 2.64 1 37 ALA 3.87 2.07 1 38 GLU 3.53 2.11 1 39 TYR 3.55 2.10 1 40 GLN 4.02 3.17 1 41 ASP 1.94 1.39 1 42 LEU 0.05 0.52 1 43 THR -3.63 -1.61 1 44 PHE 1.92 -0.29 1 45 LEU -1.76 -1.15 1 46 THR -2.99 -1.52 1 47 LYS 6.01 4.23 1 48 GLN 5.43 3.21 1 49 GLU 2.07 2.41 1 50 ILE 5.82 4.19 1 51 LEU 4.51 2.96 1 52 LEU 4.29 2.56 1 53 ALA 3.74 2.65 1 55 ARG 5.54 3.62 1 56 ARG 3.83 1.87 1 57 PHE 3.64 3.67 1 59 GLU 2.45 1.20 1 60 LEU 0.58 -1.04 1 61 LEU -1.66 -3.40 1 63 GLN 5.09 3.55 1 64 GLU 3.53 1.52 1 65 GLN -0.80 -0.92 1 66 ARG 2.75 1.03 1 67 SER -0.90 -0.88 1 68 VAL 7.63 5.25 1 69 GLU 4.75 3.17 1 70 SER 4.36 3.03 1 71 SER 3.74 3.29 1 72 LEU 3.23 1.04 1 73 ARG -1.08 -1.27 1 74 ALA -2.08 -0.18 1 75 GLN -2.75 -2.00 1 76 VAL -1.34 -0.99 1 78 PHE 3.47 0.22 1 79 GLU 4.96 3.40 1 80 GLN 1.74 1.61 1 81 ILE 3.44 0.05 1 82 LEU 2.82 1.04 1 83 SER -0.21 -0.08 1 84 LEU 2.46 0.42 1 86 GLU 4.95 2.87 1 87 LEU -1.84 -0.53 1 88 LYS 5.09 3.49 1 89 ALA -0.70 -1.48 1 90 ASN -0.96 0.01 1 92 PHE 0.90 -0.97 1 93 LYS 6.25 4.09 1 94 GLU 5.65 3.83 1 95 ARG 3.04 0.60 1 96 ILE 6.29 4.84 1 98 ARG 4.87 3.36 1 99 VAL 4.70 2.71 1 100 PHE 3.24 2.47 1 101 SER 0.10 0.35 1 102 THR 0.55 -0.71 1 103 SER -0.15 -0.34 1 105 ALA 0.01 -1.23 1 106 LYS 3.30 -0.37 1 107 ASP -1.34 -1.92 1 108 SER -2.68 -1.24 1 109 LEU -2.59 -0.81 1 110 SER -4.01 -2.20 1 111 PHE 5.26 2.75 1 112 GLU 5.27 3.48 1 113 ASP 2.05 2.78 1 114 PHE 2.59 2.10 1 115 LEU 3.86 1.80 1 116 ASP 4.20 3.03 1 117 LEU 4.36 2.46 1 118 LEU 3.54 1.75 1 119 SER 4.15 3.19 1 121 PHE 1.44 -0.32 1 122 SER -0.25 -0.08 1 123 ASP 2.90 2.06 1 124 THR 1.43 0.18 1 125 ALA -0.21 -0.59 1 128 ASP 3.90 2.23 1 129 ILE 3.74 1.88 1 130 LYS 5.08 4.15 1 131 SER 4.42 3.49 1 132 HIS 3.77 4.42 1 133 TYR 5.91 4.85 1 134 ALA 4.83 2.66 1 135 PHE 5.37 4.06 1 136 ARG 3.72 2.05 1 137 ILE 6.58 3.89 1 138 PHE 1.35 -1.37 1 140 PHE 4.46 3.97 1 141 ASP 0.89 -1.55 1 142 ASP 2.84 1.72 1 143 ASP -0.54 -0.83 1 145 THR -2.30 -1.62 1 146 LEU 0.71 -1.98 1 147 ASN -1.89 -2.94 1 148 ARG 6.01 4.57 1 149 GLU 4.30 2.46 1 150 ASP 3.82 3.61 1 151 LEU 3.14 2.16 1 152 SER 4.39 3.17 1 155 VAL 6.43 4.33 1 156 ASN 3.53 2.78 1 158 LEU 2.05 1.05 1 159 THR 0.38 0.49 1 161 GLU 0.12 -0.06 1 164 ASP 1.17 0.33 1 165 THR 0.51 -0.18 1 166 ARG 0.84 -0.13 1 172 MET 4.08 2.47 1 173 LYS 4.97 3.29 1 174 GLN 3.84 2.62 1 175 LEU 4.41 3.01 1 176 ILE 5.62 3.73 1 177 ASP 5.37 3.24 1 178 ASN 3.61 2.82 1 179 ILE 5.13 3.79 1 180 LEU 4.01 1.76 1 193 LEU 5.90 3.62 1 194 SER 4.15 2.72 1 195 GLU 4.30 2.28 1 200 ILE 4.06 1.54 1 201 SER 2.72 1.94 1 202 ARG 1.21 0.06 1 203 SER -2.31 -2.84 1 212 ILE -0.22 -0.67 1 213 VAL -0.83 -1.13 1 214 LEU 0.76 0.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17328_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.01 _LACS_plot.Line_1_terminator_val_y_1 1.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.01 _LACS_plot.Line_2_terminator_val_x_2 7.63 _LACS_plot.Line_2_terminator_val_y_2 -2.36 _LACS_plot.Y_axis_chem_shift_offset 0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 139 ASP 0.68 -3.86 0 54 HIS 5.03 1.70 0 30 ARG -1.38 0.31 1 31 LEU 0.61 -0.64 1 32 SER -2.06 0.78 1 33 LYS 4.45 -1.59 1 34 GLU 5.06 -2.04 1 35 LEU 3.24 -1.37 1 36 LEU 3.99 -1.35 1 37 ALA 3.87 -1.80 1 38 GLU 3.53 -1.42 1 39 TYR 3.55 -1.45 1 40 GLN 4.02 -0.85 1 41 ASP 1.94 -0.55 1 42 LEU 0.05 0.47 1 43 THR -3.63 2.02 1 44 PHE 1.92 -2.21 1 45 LEU -1.76 0.61 1 46 THR -2.99 1.47 1 47 LYS 6.01 -1.78 1 48 GLN 5.43 -2.22 1 49 GLU 2.07 0.34 1 50 ILE 5.82 -1.63 1 51 LEU 4.51 -1.55 1 52 LEU 4.29 -1.73 1 53 ALA 3.74 -1.09 1 55 ARG 5.54 -1.92 1 56 ARG 3.83 -1.96 1 57 PHE 3.64 0.03 1 59 GLU 2.45 -1.25 1 60 LEU 0.58 -1.62 1 61 LEU -1.66 -1.74 1 63 GLN 5.09 -1.54 1 64 GLU 3.53 -2.01 1 65 GLN -0.80 -0.12 1 66 ARG 2.75 -1.72 1 67 SER -0.90 0.02 1 68 VAL 7.63 -2.38 1 69 GLU 4.75 -1.58 1 70 SER 4.36 -1.33 1 71 SER 3.74 -0.45 1 72 LEU 3.23 -2.19 1 73 ARG -1.08 -0.19 1 74 ALA -2.08 1.90 1 75 GLN -2.75 0.75 1 76 VAL -1.34 0.35 1 78 PHE 3.47 -3.25 1 79 GLU 4.96 -1.56 1 80 GLN 1.74 -0.13 1 81 ILE 3.44 -3.39 1 82 LEU 2.82 -1.78 1 83 SER -0.21 0.13 1 84 LEU 2.46 -2.04 1 86 GLU 4.95 -2.08 1 87 LEU -1.84 1.31 1 88 LYS 5.09 -1.60 1 89 ALA -0.70 -0.78 1 90 ASN -0.96 0.97 1 92 PHE 0.90 -1.87 1 93 LYS 6.25 -2.16 1 94 GLU 5.65 -1.82 1 95 ARG 3.04 -2.44 1 96 ILE 6.29 -1.45 1 98 ARG 4.87 -1.51 1 99 VAL 4.70 -1.99 1 100 PHE 3.24 -0.77 1 101 SER 0.10 0.25 1 102 THR 0.55 -1.26 1 103 SER -0.15 -0.19 1 105 ALA 0.01 -1.24 1 106 LYS 3.30 -3.67 1 107 ASP -1.34 -0.58 1 108 SER -2.68 1.44 1 109 LEU -2.59 1.78 1 110 SER -4.01 1.81 1 111 PHE 5.26 -2.51 1 112 GLU 5.27 -1.79 1 113 ASP 2.05 0.73 1 114 PHE 2.59 -0.49 1 115 LEU 3.86 -2.06 1 116 ASP 4.20 -1.17 1 117 LEU 4.36 -1.90 1 118 LEU 3.54 -1.79 1 119 SER 4.15 -0.96 1 121 PHE 1.44 -1.76 1 122 SER -0.25 0.17 1 123 ASP 2.90 -0.84 1 124 THR 1.43 -1.25 1 125 ALA -0.21 -0.38 1 128 ASP 3.90 -1.67 1 129 ILE 3.74 -1.86 1 130 LYS 5.08 -0.93 1 131 SER 4.42 -0.93 1 132 HIS 3.77 0.65 1 133 TYR 5.91 -1.06 1 134 ALA 4.83 -2.17 1 135 PHE 5.37 -1.31 1 136 ARG 3.72 -1.67 1 137 ILE 6.58 -2.69 1 138 PHE 1.35 -2.72 1 140 PHE 4.46 -0.49 1 141 ASP 0.89 -2.44 1 142 ASP 2.84 -1.12 1 143 ASP -0.54 -0.29 1 145 THR -2.30 0.68 1 146 LEU 0.71 -2.69 1 147 ASN -1.89 -1.05 1 148 ARG 6.01 -1.44 1 149 GLU 4.30 -1.84 1 150 ASP 3.82 -0.21 1 151 LEU 3.14 -0.98 1 152 SER 4.39 -1.22 1 155 VAL 6.43 -2.10 1 156 ASN 3.53 -0.75 1 158 LEU 2.05 -1.00 1 159 THR 0.38 0.11 1 161 GLU 0.12 -0.18 1 164 ASP 1.17 -0.84 1 165 THR 0.51 -0.69 1 166 ARG 0.84 -0.97 1 172 MET 4.08 -1.61 1 173 LYS 4.97 -1.68 1 174 GLN 3.84 -1.22 1 175 LEU 4.41 -1.40 1 176 ILE 5.62 -1.89 1 177 ASP 5.37 -2.13 1 178 ASN 3.61 -0.79 1 179 ILE 5.13 -1.34 1 180 LEU 4.01 -2.25 1 193 LEU 5.90 -2.28 1 194 SER 4.15 -1.43 1 195 GLU 4.30 -2.02 1 200 ILE 4.06 -2.52 1 201 SER 2.72 -0.78 1 202 ARG 1.21 -1.15 1 203 SER -2.31 -0.53 1 212 ILE -0.22 -0.45 1 213 VAL -0.83 -0.30 1 214 LEU 0.76 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17328_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.01 _LACS_plot.Line_1_terminator_val_y_1 -1.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _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 7.63 _LACS_plot.Line_2_terminator_val_y_2 2.60 _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 145 THR -2.30 -4.26 0 30 ARG -1.38 -0.42 1 31 LEU 0.61 -1.42 1 32 SER -2.06 -0.03 1 33 LYS 4.45 2.39 1 34 GLU 5.06 2.38 1 35 LEU 3.24 1.09 1 36 LEU 3.99 1.21 1 37 ALA 3.87 2.22 1 38 GLU 3.53 2.73 1 39 TYR 3.55 3.07 1 40 GLN 4.02 0.97 1 41 ASP 1.94 1.14 1 42 LEU 0.05 -0.51 1 43 THR -3.63 -1.45 1 44 PHE 1.92 -0.21 1 45 LEU -1.76 -0.49 1 46 THR -2.99 1.27 1 47 LYS 6.01 1.57 1 48 GLN 5.43 2.97 1 49 GLU 2.07 2.96 1 50 ILE 5.82 1.29 1 51 LEU 4.51 3.00 1 52 LEU 4.29 1.27 1 53 ALA 3.74 1.95 1 54 HIS 5.03 3.39 1 55 ARG 5.54 3.08 1 56 ARG 3.83 2.33 1 57 PHE 3.64 1.61 1 59 GLU 2.45 0.70 1 60 LEU 0.58 -0.79 1 61 LEU -1.66 -2.78 1 63 GLN 5.09 1.75 1 64 GLU 3.53 0.68 1 65 GLN -0.80 -1.86 1 66 ARG 2.75 -0.05 1 67 SER -0.90 0.87 1 68 VAL 7.63 2.00 1 69 GLU 4.75 2.62 1 70 SER 4.36 3.67 1 71 SER 3.74 1.50 1 72 LEU 3.23 -0.14 1 73 ARG -1.08 -0.33 1 74 ALA -2.08 -1.01 1 75 GLN -2.75 -0.52 1 76 VAL -1.34 -1.17 1 78 PHE 3.47 1.39 1 79 GLU 4.96 1.79 1 80 GLN 1.74 2.18 1 81 ILE 3.44 0.78 1 82 LEU 2.82 -1.17 1 83 SER -0.21 0.19 1 84 LEU 2.46 0.94 1 86 GLU 4.95 -0.19 1 87 LEU -1.84 0.55 1 88 LYS 5.09 0.27 1 89 ALA -0.70 -0.92 1 90 ASN -0.96 2.16 1 92 PHE 0.90 1.13 1 93 LYS 6.25 -0.63 1 94 GLU 5.65 2.29 1 95 ARG 3.04 1.67 1 96 ILE 6.29 0.78 1 98 ARG 4.87 2.12 1 99 VAL 4.70 0.82 1 100 PHE 3.24 -0.76 1 101 SER 0.10 2.67 1 102 THR 0.55 1.07 1 103 SER -0.15 2.64 1 105 ALA 0.01 -0.73 1 106 LYS 3.30 -1.46 1 107 ASP -1.34 -0.43 1 108 SER -2.68 -1.72 1 109 LEU -2.59 -1.22 1 110 SER -4.01 0.18 1 111 PHE 5.26 0.98 1 112 GLU 5.27 1.92 1 113 ASP 2.05 1.38 1 114 PHE 2.59 0.57 1 115 LEU 3.86 1.44 1 116 ASP 4.20 0.77 1 117 LEU 4.36 0.27 1 118 LEU 3.54 2.33 1 121 PHE 1.44 -0.33 1 122 SER -0.25 1.76 1 123 ASP 2.90 1.00 1 124 THR 1.43 -0.10 1 125 ALA -0.21 -0.64 1 128 ASP 3.90 1.92 1 129 ILE 3.74 1.71 1 130 LYS 5.08 2.61 1 131 SER 4.42 1.15 1 132 HIS 3.77 3.80 1 133 TYR 5.91 1.76 1 134 ALA 4.83 -0.88 1 135 PHE 5.37 -0.24 1 136 ARG 3.72 3.25 1 137 ILE 6.58 -0.20 1 138 PHE 1.35 -2.13 1 139 ASP 0.68 0.62 1 140 PHE 4.46 1.19 1 141 ASP 0.89 0.01 1 142 ASP 2.84 -1.08 1 143 ASP -0.54 1.99 1 146 LEU 0.71 -2.10 1 148 ARG 6.01 2.21 1 149 GLU 4.30 2.96 1 151 LEU 3.14 0.89 1 152 SER 4.39 1.62 1 155 VAL 6.43 2.60 1 156 ASN 3.53 2.40 1 158 LEU 2.05 0.81 1 159 THR 0.38 1.06 1 161 GLU 0.12 0.38 1 164 ASP 1.17 0.16 1 165 THR 0.51 -0.31 1 166 ARG 0.84 0.14 1 172 MET 4.08 0.91 1 173 LYS 4.97 1.41 1 174 GLN 3.84 2.10 1 175 LEU 4.41 1.75 1 176 ILE 5.62 1.44 1 177 ASP 5.37 3.28 1 178 ASN 3.61 2.52 1 179 ILE 5.13 2.60 1 180 LEU 4.01 1.80 1 193 LEU 5.90 0.84 1 194 SER 4.15 3.35 1 195 GLU 4.30 2.17 1 200 ILE 4.06 1.30 1 201 SER 2.72 0.76 1 202 ARG 1.21 -0.08 1 203 SER -2.31 -1.96 1 212 ILE -0.22 -1.74 1 213 VAL -0.83 -1.88 1 stop_ save_