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 bmr11466_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.64 _LACS_plot.Line_1_terminator_val_y_1 -3.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 8.78 _LACS_plot.Line_2_terminator_val_y_2 5.96 _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 -8.64 -2.55 0 96 ARG -7.16 -0.89 0 10 ALA 3.17 2.30 1 11 VAL 4.50 3.04 1 12 PHE 3.51 4.50 1 13 GLU 3.29 2.21 1 15 TRP -2.37 -1.78 1 16 PHE -0.57 -0.12 1 18 ASN -1.03 -1.04 1 19 ARG -1.47 -1.12 1 20 ASN -0.17 0.78 1 22 PHE 0.40 3.03 1 23 TYR -0.85 0.31 1 24 THR -5.84 -3.68 1 25 TYR 3.53 2.92 1 26 ASP 3.63 2.58 1 28 LEU 6.47 2.39 1 29 VAL 6.30 4.71 1 30 SER 3.86 2.92 1 31 ALA 1.32 2.36 1 33 ASN 3.08 2.17 1 35 TYR -1.79 0.04 1 37 GLU 2.10 1.08 1 38 PHE 3.94 1.65 1 40 THR -0.65 -0.64 1 41 THR 0.60 1.56 1 43 SER -2.63 -0.79 1 44 LEU 4.13 2.85 1 45 ASP 4.20 3.08 1 46 ASP 3.00 2.85 1 47 GLN 3.45 2.78 1 48 LYS 2.23 3.18 1 49 ARG 4.17 5.34 1 50 GLU 7.83 4.81 1 51 LEU 1.91 -0.04 1 52 ALA 2.20 3.22 1 53 ALA 2.47 2.88 1 54 PHE 2.87 2.82 1 55 LEU 5.49 2.52 1 57 ASN 4.64 4.95 1 58 ILE 5.11 2.18 1 59 ASN 5.73 4.31 1 61 ALA 2.26 2.43 1 62 SER -2.53 -0.55 1 65 LEU 4.80 0.05 1 66 GLN 1.12 2.27 1 68 ILE 2.25 2.53 1 69 GLN -5.38 -2.37 1 70 GLU -0.26 0.51 1 71 GLN -0.05 -0.07 1 72 ASN 1.40 1.20 1 74 GLN -1.21 -0.79 1 75 SER -2.75 -2.49 1 76 ASP 1.11 0.32 1 77 TYR 3.86 0.87 1 79 ASP -1.35 -1.55 1 80 THR 2.69 1.53 1 81 SER 1.87 1.52 1 82 SER 0.02 -1.01 1 83 THR 2.71 1.47 1 84 GLN 2.24 1.55 1 85 TYR -2.41 -2.42 1 88 ALA -1.23 -0.98 1 89 ALA 2.40 1.06 1 91 LYS -3.01 -3.84 1 92 GLN -6.56 -1.88 1 93 TYR 2.49 -0.68 1 94 TYR -2.64 -3.25 1 99 ILE -5.44 -3.20 1 100 GLN 4.67 0.50 1 101 LEU 1.35 1.69 1 102 SER -3.33 -0.18 1 103 TRP 6.44 3.43 1 104 ASN 6.70 4.39 1 105 TYR 1.47 -0.54 1 106 ASN 3.95 2.22 1 107 TYR 6.55 4.99 1 109 GLU 3.45 2.92 1 110 ALA 4.81 1.79 1 112 ALA 3.76 2.59 1 113 ASP 3.38 2.65 1 114 LEU -0.77 -0.05 1 117 ASP 0.54 -1.94 1 118 LEU 0.95 0.17 1 119 LEU 2.12 2.01 1 120 ASN 1.16 0.86 1 121 ASN -0.16 -0.99 1 123 ASP 2.64 2.70 1 124 LEU 2.49 2.84 1 125 VAL 4.71 3.55 1 126 ALA -2.88 -1.55 1 127 GLN -0.85 0.25 1 128 ASP -3.79 -1.64 1 129 SER 3.95 2.37 1 131 VAL 7.66 5.41 1 132 ALA 5.60 4.34 1 133 TRP 2.07 3.55 1 134 ARG 5.45 5.64 1 135 THR 4.52 4.58 1 136 ALA 2.11 2.39 1 137 LEU 2.36 2.29 1 138 TRP 6.03 4.39 1 139 PHE 3.35 4.01 1 140 TRP 2.27 3.20 1 141 MET 3.17 -0.40 1 142 LYS 3.30 1.56 1 143 ARG 2.38 -1.59 1 144 ASP 4.08 1.84 1 146 HIS 1.87 3.27 1 148 ALA 4.50 2.09 1 149 ILE -3.15 -2.69 1 150 THR 1.04 0.03 1 151 ALA -0.62 -0.41 1 152 SER -4.17 -3.26 1 155 SER -2.99 -3.05 1 156 PHE 5.40 4.91 1 157 SER 3.26 3.19 1 159 THR 4.83 2.94 1 160 ILE 6.06 4.63 1 161 ARG 4.39 3.37 1 162 ILE 3.80 3.88 1 163 ILE 4.72 4.57 1 164 ASN -0.96 -0.88 1 167 LEU -1.41 -0.36 1 168 GLU -1.48 1.04 1 170 ASN 3.07 1.51 1 171 GLN -2.05 -1.72 1 173 ALA 2.56 1.02 1 175 SER -2.25 -0.41 1 176 ILE 4.30 3.10 1 178 ASN 1.30 4.20 1 179 MET 4.24 3.31 1 180 GLN 6.12 4.10 1 181 MET 8.78 4.99 1 182 GLU 2.97 1.89 1 183 ASN 4.05 2.12 1 184 ARG 6.42 4.99 1 185 VAL 6.33 5.06 1 186 THR 7.72 6.09 1 187 TYR 2.26 -0.06 1 188 TYR 1.70 2.25 1 189 THR 6.21 4.96 1 190 GLN 5.36 3.54 1 191 PHE 3.47 -0.62 1 193 GLN 5.52 3.49 1 194 THR 5.82 5.21 1 195 LEU -0.37 -0.30 1 197 VAL -7.20 -4.16 1 201 THR -0.10 -0.22 1 202 ASP 0.83 -1.39 1 203 LEU -0.44 1.99 1 204 ARG -2.71 -0.78 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11466_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.64 _LACS_plot.Line_1_terminator_val_y_1 4.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.05 _LACS_plot.Line_2_terminator_val_x_2 8.78 _LACS_plot.Line_2_terminator_val_y_2 -2.82 _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 -8.64 6.09 0 96 ARG -7.16 6.27 0 10 ALA 3.17 -0.87 1 11 VAL 4.50 -1.46 1 12 PHE 3.51 0.99 1 13 GLU 3.29 -1.08 1 15 TRP -2.37 0.59 1 16 PHE -0.57 0.45 1 18 ASN -1.03 -0.01 1 19 ARG -1.47 0.35 1 20 ASN -0.17 0.95 1 22 PHE 0.40 2.63 1 23 TYR -0.85 1.16 1 24 THR -5.84 2.16 1 25 TYR 3.53 -0.61 1 26 ASP 3.63 -1.05 1 28 LEU 6.47 -4.08 1 29 VAL 6.30 -1.59 1 30 SER 3.86 -0.94 1 31 ALA 1.32 1.04 1 33 ASN 3.08 -0.91 1 35 TYR -1.79 1.83 1 37 GLU 2.10 -1.02 1 38 PHE 3.94 -2.29 1 40 THR -0.65 0.01 1 41 THR 0.60 0.96 1 43 SER -2.63 1.84 1 44 LEU 4.13 -1.28 1 45 ASP 4.20 -1.12 1 46 ASP 3.00 -0.15 1 47 GLN 3.45 -0.67 1 48 LYS 2.23 0.95 1 49 ARG 4.17 1.17 1 50 GLU 7.83 -3.02 1 51 LEU 1.91 -1.95 1 52 ALA 2.20 1.02 1 53 ALA 2.47 0.41 1 54 PHE 2.87 -0.05 1 55 LEU 5.49 -2.97 1 57 ASN 4.64 0.31 1 58 ILE 5.11 -2.93 1 59 ASN 5.73 -1.42 1 61 ALA 2.26 0.17 1 62 SER -2.53 1.98 1 65 LEU 4.80 -4.75 1 66 GLN 1.12 1.15 1 68 ILE 2.25 0.28 1 69 GLN -5.38 3.01 1 70 GLU -0.26 0.77 1 71 GLN -0.05 -0.02 1 72 ASN 1.40 -0.20 1 74 GLN -1.21 0.42 1 75 SER -2.75 0.26 1 76 ASP 1.11 -0.79 1 77 TYR 3.86 -2.99 1 79 ASP -1.35 -0.20 1 80 THR 2.69 -1.16 1 81 SER 1.87 -0.35 1 82 SER 0.02 -1.03 1 83 THR 2.71 -1.24 1 84 GLN 2.24 -0.69 1 85 TYR -2.41 -0.01 1 88 ALA -1.23 0.25 1 89 ALA 2.40 -1.34 1 91 LYS -3.01 -0.83 1 92 GLN -6.56 4.68 1 93 TYR 2.49 -3.17 1 94 TYR -2.64 -0.61 1 99 ILE -5.44 2.24 1 100 GLN 4.67 -4.17 1 101 LEU 1.35 0.34 1 102 SER -3.33 3.15 1 103 TRP 6.44 -3.01 1 104 ASN 6.70 -2.31 1 105 TYR 1.47 -2.01 1 106 ASN 3.95 -1.73 1 107 TYR 6.55 -1.56 1 109 GLU 3.45 -0.53 1 110 ALA 4.81 -3.02 1 112 ALA 3.76 -1.17 1 113 ASP 3.38 -0.73 1 114 LEU -0.77 0.72 1 117 ASP 0.54 -2.48 1 118 LEU 0.95 -0.78 1 119 LEU 2.12 -0.11 1 120 ASN 1.16 -0.30 1 121 ASN -0.16 -0.83 1 123 ASP 2.64 0.06 1 124 LEU 2.49 0.35 1 125 VAL 4.71 -1.16 1 126 ALA -2.88 1.33 1 127 GLN -0.85 1.10 1 128 ASP -3.79 2.15 1 129 SER 3.95 -1.58 1 131 VAL 7.66 -2.25 1 132 ALA 5.60 -1.26 1 133 TRP 2.07 1.48 1 134 ARG 5.45 0.19 1 135 THR 4.52 0.06 1 136 ALA 2.11 0.28 1 137 LEU 2.36 -0.07 1 138 TRP 6.03 -1.64 1 139 PHE 3.35 0.66 1 140 TRP 2.27 0.93 1 141 MET 3.17 -3.57 1 142 LYS 3.30 -1.74 1 143 ARG 2.38 -3.97 1 144 ASP 4.08 -2.24 1 146 HIS 1.87 1.40 1 148 ALA 4.50 -2.41 1 149 ILE -3.15 0.46 1 150 THR 1.04 -1.01 1 151 ALA -0.62 0.21 1 152 SER -4.17 0.91 1 155 SER -2.99 -0.06 1 156 PHE 5.40 -0.49 1 157 SER 3.26 -0.07 1 159 THR 4.83 -1.89 1 160 ILE 6.06 -1.43 1 161 ARG 4.39 -1.02 1 162 ILE 3.80 0.08 1 163 ILE 4.72 -0.15 1 164 ASN -0.96 0.08 1 167 LEU -1.41 1.05 1 168 GLU -1.48 2.52 1 170 ASN 3.07 -1.56 1 171 GLN -2.05 0.33 1 173 ALA 2.56 -1.54 1 175 SER -2.25 1.84 1 176 ILE 4.30 -1.20 1 178 ASN 1.30 2.90 1 179 MET 4.24 -0.93 1 180 GLN 6.12 -2.02 1 181 MET 8.78 -3.79 1 182 GLU 2.97 -1.08 1 183 ASN 4.05 -1.93 1 184 ARG 6.42 -1.43 1 185 VAL 6.33 -1.27 1 186 THR 7.72 -1.63 1 187 TYR 2.26 -2.32 1 188 TYR 1.70 0.55 1 189 THR 6.21 -1.25 1 190 GLN 5.36 -1.82 1 191 PHE 3.47 -4.09 1 193 GLN 5.52 -2.03 1 194 THR 5.82 -0.61 1 195 LEU -0.37 0.07 1 197 VAL -7.20 3.04 1 201 THR -0.10 -0.12 1 202 ASP 0.83 -2.22 1 203 LEU -0.44 2.43 1 204 ARG -2.71 1.93 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11466_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.64 _LACS_plot.Line_1_terminator_val_y_1 -2.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 8.78 _LACS_plot.Line_2_terminator_val_y_2 2.92 _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 77 TYR 3.86 -3.52 0 116 LEU -8.64 -0.91 0 125 VAL 4.71 -3.43 0 96 ARG -7.16 1.30 0 10 ALA 3.17 3.25 1 11 VAL 4.50 0.95 1 12 PHE 3.51 0.46 1 13 GLU 3.29 2.15 1 15 TRP -2.37 0.45 1 18 ASN -1.03 -1.23 1 19 ARG -1.47 -1.13 1 22 PHE 0.40 0.26 1 23 TYR -0.85 -0.93 1 24 THR -5.84 -0.54 1 25 TYR 3.53 0.69 1 26 ASP 3.63 2.33 1 28 LEU 6.47 0.52 1 29 VAL 6.30 3.47 1 30 SER 3.86 3.35 1 31 ALA 1.32 2.52 1 33 ASN 3.08 1.66 1 35 TYR -1.79 -1.54 1 37 GLU 2.10 2.42 1 38 PHE 3.94 -0.22 1 40 THR -0.65 -0.40 1 41 THR 0.60 -1.62 1 43 SER -2.63 0.06 1 44 LEU 4.13 0.50 1 45 ASP 4.20 1.33 1 46 ASP 3.00 1.30 1 47 GLN 3.45 2.71 1 48 LYS 2.23 1.80 1 49 ARG 4.17 3.18 1 50 GLU 7.83 0.99 1 51 LEU 1.91 2.08 1 52 ALA 2.20 2.52 1 53 ALA 2.47 2.37 1 54 PHE 2.87 0.93 1 55 LEU 5.49 2.03 1 57 ASN 4.64 3.62 1 58 ILE 5.11 2.95 1 59 ASN 5.73 1.44 1 61 ALA 2.26 0.06 1 62 SER -2.53 0.57 1 65 LEU 4.80 -2.22 1 66 GLN 1.12 0.26 1 68 ILE 2.25 -1.81 1 69 GLN -5.38 -2.74 1 70 GLU -0.26 -1.77 1 71 GLN -0.05 -0.48 1 72 ASN 1.40 -1.83 1 74 GLN -1.21 -1.47 1 75 SER -2.75 -2.21 1 76 ASP 1.11 0.03 1 79 ASP -1.35 1.75 1 80 THR 2.69 0.76 1 81 SER 1.87 0.34 1 82 SER 0.02 1.09 1 83 THR 2.71 0.99 1 84 GLN 2.24 -0.85 1 85 TYR -2.41 -4.25 1 88 ALA -1.23 0.00 1 89 ALA 2.40 1.40 1 91 LYS -3.01 -0.72 1 92 GLN -6.56 -0.41 1 93 TYR 2.49 -2.62 1 94 TYR -2.64 -2.91 1 99 ILE -5.44 -1.17 1 100 GLN 4.67 -1.51 1 101 LEU 1.35 -2.29 1 102 SER -3.33 -1.27 1 103 TRP 6.44 2.04 1 104 ASN 6.70 0.36 1 105 TYR 1.47 1.17 1 106 ASN 3.95 1.18 1 107 TYR 6.55 2.51 1 109 GLU 3.45 0.51 1 110 ALA 4.81 1.77 1 112 ALA 3.76 2.61 1 113 ASP 3.38 2.27 1 114 LEU -0.77 -0.48 1 117 ASP 0.54 0.44 1 118 LEU 0.95 -0.74 1 119 LEU 2.12 1.08 1 120 ASN 1.16 -0.48 1 124 LEU 2.49 0.58 1 126 ALA -2.88 -2.14 1 127 GLN -0.85 0.04 1 128 ASP -3.79 -0.75 1 129 SER 3.95 1.61 1 131 VAL 7.66 1.66 1 132 ALA 5.60 4.04 1 133 TRP 2.07 3.00 1 134 ARG 5.45 2.76 1 135 THR 4.52 0.50 1 136 ALA 2.11 1.39 1 137 LEU 2.36 -0.41 1 138 TRP 6.03 0.63 1 139 PHE 3.35 0.61 1 140 TRP 2.27 1.89 1 141 MET 3.17 3.17 1 142 LYS 3.30 2.50 1 143 ARG 2.38 -0.75 1 144 ASP 4.08 1.70 1 146 HIS 1.87 2.29 1 148 ALA 4.50 1.79 1 149 ILE -3.15 -2.25 1 150 THR 1.04 -2.27 1 151 ALA -0.62 -3.32 1 152 SER -4.17 0.20 1 155 SER -2.99 -1.04 1 156 PHE 5.40 4.75 1 157 SER 3.26 1.70 1 159 THR 4.83 -0.06 1 160 ILE 6.06 1.85 1 161 ARG 4.39 3.15 1 162 ILE 3.80 1.09 1 163 ILE 4.72 0.71 1 164 ASN -0.96 1.26 1 167 LEU -1.41 -0.02 1 168 GLU -1.48 -0.20 1 170 ASN 3.07 -0.47 1 171 GLN -2.05 -0.41 1 173 ALA 2.56 1.18 1 175 SER -2.25 0.37 1 176 ILE 4.30 1.89 1 178 ASN 1.30 1.01 1 179 MET 4.24 2.47 1 180 GLN 6.12 0.51 1 181 MET 8.78 2.14 1 182 GLU 2.97 3.08 1 183 ASN 4.05 1.08 1 184 ARG 6.42 1.58 1 185 VAL 6.33 2.84 1 186 THR 7.72 0.73 1 187 TYR 2.26 0.37 1 188 TYR 1.70 2.06 1 189 THR 6.21 2.88 1 190 GLN 5.36 3.08 1 191 PHE 3.47 3.53 1 193 GLN 5.52 4.21 1 194 THR 5.82 1.55 1 195 LEU -0.37 -1.74 1 197 VAL -7.20 -3.87 1 201 THR -0.10 1.30 1 202 ASP 0.83 -0.92 1 203 LEU -0.44 -3.44 1 204 ARG -2.71 -0.08 1 stop_ save_