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 bmr27564_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.74 _LACS_plot.Line_1_terminator_val_y_1 -3.57 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.62 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.33 _LACS_plot.Line_2_terminator_val_x_2 9.09 _LACS_plot.Line_2_terminator_val_y_2 6.78 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 158 LEU -3.62 -4.98 0 171 LYS -1.24 -3.94 0 88 HIS -9.74 -2.44 0 90 ASP 8.14 1.82 0 10 LYS -5.69 -1.72 1 11 ASN -0.30 -1.43 1 13 THR 0.00 -0.30 1 15 THR 1.28 1.35 1 16 ILE -2.78 0.11 1 17 SER -4.83 -1.96 1 18 ILE -3.53 -1.75 1 19 SER -3.41 -1.78 1 20 GLN 2.76 2.52 1 21 LEU 1.32 0.91 1 22 ASN -0.97 -0.88 1 24 ASN -1.57 0.85 1 25 VAL -0.96 0.23 1 26 TRP -3.61 -2.12 1 27 VAL -2.24 -0.80 1 28 HIS -5.15 -1.30 1 29 THR -3.14 -0.43 1 30 GLU -6.05 -2.05 1 31 LEU -1.39 -0.80 1 33 TYR -1.57 -0.63 1 34 PHE -1.96 -0.84 1 37 GLU -4.37 -1.96 1 38 ALA -1.69 -1.42 1 39 VAL -4.59 -3.21 1 41 SER -0.50 -0.37 1 42 ASN -5.44 -1.83 1 44 LEU -6.25 -1.56 1 45 VAL -1.16 0.03 1 46 LEU -0.93 -2.34 1 47 ASN 0.02 -0.84 1 48 THR -4.04 -2.01 1 50 LYS -1.30 -1.19 1 52 LEU -3.07 -1.55 1 53 VAL -4.12 -2.42 1 54 LEU -3.40 -2.34 1 55 VAL 2.99 1.83 1 56 ASP 3.88 4.24 1 57 SER -5.34 -3.37 1 58 SER -1.05 -1.08 1 59 TRP -1.14 0.97 1 60 ASP -3.43 -1.75 1 61 ASP 3.92 5.18 1 62 LYS 5.02 4.05 1 63 LEU 1.16 2.64 1 64 THR 9.09 6.78 1 65 LYS 5.47 4.79 1 66 GLU 3.77 3.19 1 67 LEU 4.31 3.42 1 68 ILE 5.76 4.55 1 69 GLU 4.02 3.28 1 70 MET 3.28 4.36 1 71 VAL 5.15 3.10 1 72 GLU 4.72 3.61 1 73 LYS 3.36 2.75 1 74 LYS 3.32 1.96 1 75 PHE 1.24 0.84 1 76 LYS 5.22 0.78 1 77 LYS -6.29 -1.56 1 78 ARG -2.49 -1.59 1 79 VAL 1.36 -0.07 1 80 THR 1.31 0.66 1 81 ASP -7.80 -1.22 1 82 VAL -6.33 -2.91 1 83 ILE -2.25 -0.50 1 84 ILE -1.59 -2.83 1 85 THR 2.08 2.00 1 86 HIS 4.36 3.39 1 87 ALA 0.56 -0.89 1 91 ARG -3.82 -1.11 1 92 ILE -3.35 0.28 1 95 MET 2.72 1.57 1 96 LYS 7.06 5.14 1 97 THR 6.89 5.31 1 98 LEU 6.61 3.29 1 99 LYS 4.25 2.96 1 100 GLU 2.77 2.56 1 101 ARG -0.89 -0.30 1 103 ILE 0.60 0.40 1 104 LYS 0.74 0.73 1 105 ALA -3.06 -3.09 1 106 HIS 0.25 0.89 1 107 SER -3.32 0.15 1 108 THR -0.68 -0.24 1 110 LEU 4.30 2.74 1 111 THR 6.85 4.58 1 112 ALA 5.30 3.52 1 113 GLU 3.03 2.74 1 114 LEU 3.73 2.59 1 115 ALA 4.10 3.61 1 116 LYS 3.57 2.82 1 117 LYS 3.49 3.14 1 118 ASN -0.53 0.18 1 120 TYR -2.41 -0.78 1 124 LEU 1.07 2.68 1 126 ASP 0.95 0.08 1 127 LEU 0.81 -0.46 1 128 GLN -1.51 -1.20 1 133 LEU -4.66 -1.48 1 134 LYS -2.52 -0.72 1 135 PHE -3.13 -1.89 1 138 MET -1.49 -0.09 1 139 LYS -1.75 -0.07 1 140 VAL -4.52 -0.95 1 141 GLU -6.54 -2.28 1 142 THR -0.13 -1.27 1 143 PHE -6.13 -2.68 1 144 TYR -4.46 -4.83 1 147 LYS -1.18 -0.07 1 149 HIS 5.97 4.27 1 150 THR -5.08 -1.95 1 151 GLU 0.87 1.57 1 152 ASP -1.16 -0.59 1 153 ASN 0.97 1.23 1 154 ILE -4.55 -1.34 1 155 VAL -4.32 -3.10 1 156 VAL -2.45 -0.96 1 157 TRP -8.22 -3.28 1 160 GLN 2.71 1.77 1 161 TYR -4.54 -1.74 1 162 GLN 5.64 2.02 1 163 ILE -4.00 -1.03 1 164 LEU -6.74 -2.46 1 165 ALA 1.06 -1.45 1 169 LEU -0.55 1.17 1 170 VAL -2.12 -1.09 1 172 SER -0.85 -0.58 1 173 ALA 3.54 2.45 1 175 SER 2.57 1.98 1 176 LYS -0.96 -1.01 1 177 ASP -3.46 -1.48 1 181 VAL -0.36 -1.67 1 182 ALA 3.74 3.39 1 183 ASP -2.27 -1.32 1 184 ALA -4.33 -1.10 1 185 TYR -0.85 -1.21 1 186 VAL 6.02 5.01 1 187 ASN 3.51 2.63 1 188 GLU 0.24 1.45 1 189 TRP 0.67 1.86 1 191 THR 5.89 4.48 1 193 ILE 6.23 3.14 1 194 GLU 4.69 3.88 1 195 ASN 4.07 2.57 1 196 VAL 6.62 5.20 1 197 LEU 2.78 2.48 1 198 LYS 1.91 1.84 1 199 ARG 3.45 2.73 1 200 TYR -1.46 -3.50 1 202 ASN -0.09 -0.66 1 203 ILE -0.64 2.17 1 204 ASN 0.52 1.68 1 205 LEU -6.08 -1.14 1 206 VAL -3.47 -1.94 1 207 VAL -4.89 -4.06 1 210 HIS -1.67 0.16 1 212 GLU 0.34 0.66 1 213 VAL 2.15 1.65 1 215 ASP -2.66 -1.76 1 216 ARG 4.10 3.78 1 218 LEU 4.88 3.97 1 219 LEU 6.42 4.47 1 220 LEU 4.85 2.83 1 221 HIS 2.86 3.79 1 223 LEU 4.04 3.29 1 224 ASP 4.17 3.18 1 225 LEU 1.20 1.03 1 226 LEU -1.14 0.22 1 227 LYS 1.82 2.29 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27564_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.74 _LACS_plot.Line_1_terminator_val_y_1 6.17 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.67 _LACS_plot.Line_2_terminator_val_x_2 9.09 _LACS_plot.Line_2_terminator_val_y_2 -2.31 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 158 LEU -3.62 -1.36 0 171 LYS -1.24 -2.70 0 88 HIS -9.74 7.30 0 90 ASP 8.14 -6.32 0 10 LYS -5.69 3.97 1 11 ASN -0.30 -1.13 1 13 THR 0.00 -0.30 1 15 THR 1.28 0.07 1 16 ILE -2.78 2.89 1 17 SER -4.83 2.87 1 18 ILE -3.53 1.78 1 19 SER -3.41 1.63 1 20 GLN 2.76 -0.24 1 21 LEU 1.32 -0.41 1 22 ASN -0.97 0.09 1 24 ASN -1.57 2.42 1 25 VAL -0.96 1.19 1 26 TRP -3.61 1.49 1 27 VAL -2.24 1.44 1 28 HIS -5.15 3.85 1 29 THR -3.14 2.71 1 30 GLU -6.05 4.00 1 31 LEU -1.39 0.59 1 33 TYR -1.57 0.94 1 34 PHE -1.96 1.12 1 37 GLU -4.37 2.41 1 38 ALA -1.69 0.27 1 39 VAL -4.59 1.38 1 41 SER -0.50 0.13 1 42 ASN -5.44 3.61 1 44 LEU -6.25 4.69 1 45 VAL -1.16 1.19 1 46 LEU -0.93 -1.41 1 47 ASN 0.02 -0.86 1 48 THR -4.04 2.03 1 50 LYS -1.30 0.11 1 52 LEU -3.07 1.52 1 53 VAL -4.12 1.70 1 54 LEU -3.40 1.06 1 55 VAL 2.99 -1.16 1 56 ASP 3.88 0.36 1 57 SER -5.34 1.97 1 58 SER -1.05 -0.03 1 59 TRP -1.14 2.11 1 60 ASP -3.43 1.68 1 61 ASP 3.92 1.26 1 62 LYS 5.02 -0.97 1 63 LEU 1.16 1.48 1 64 THR 9.09 -2.31 1 65 LYS 5.47 -0.68 1 66 GLU 3.77 -0.58 1 67 LEU 4.31 -0.89 1 68 ILE 5.76 -1.21 1 69 GLU 4.02 -0.74 1 70 MET 3.28 1.08 1 71 VAL 5.15 -2.05 1 72 GLU 4.72 -1.11 1 73 LYS 3.36 -0.61 1 74 LYS 3.32 -1.36 1 75 PHE 1.24 -0.40 1 76 LYS 5.22 -4.44 1 77 LYS -6.29 4.73 1 78 ARG -2.49 0.90 1 79 VAL 1.36 -1.43 1 80 THR 1.31 -0.65 1 81 ASP -7.80 6.58 1 82 VAL -6.33 3.42 1 83 ILE -2.25 1.75 1 84 ILE -1.59 -1.24 1 85 THR 2.08 -0.08 1 86 HIS 4.36 -0.97 1 87 ALA 0.56 -1.45 1 91 ARG -3.82 2.71 1 92 ILE -3.35 3.63 1 95 MET 2.72 -1.15 1 96 LYS 7.06 -1.92 1 97 THR 6.89 -1.58 1 98 LEU 6.61 -3.32 1 99 LYS 4.25 -1.29 1 100 GLU 2.77 -0.21 1 101 ARG -0.89 0.59 1 103 ILE 0.60 -0.20 1 104 LYS 0.74 -0.01 1 105 ALA -3.06 -0.03 1 106 HIS 0.25 0.64 1 107 SER -3.32 3.47 1 108 THR -0.68 0.44 1 110 LEU 4.30 -1.56 1 111 THR 6.85 -2.27 1 112 ALA 5.30 -1.78 1 113 GLU 3.03 -0.29 1 114 LEU 3.73 -1.14 1 115 ALA 4.10 -0.49 1 116 LYS 3.57 -0.75 1 117 LYS 3.49 -0.35 1 118 ASN -0.53 0.71 1 120 TYR -2.41 1.63 1 124 LEU 1.07 1.61 1 126 ASP 0.95 -0.87 1 127 LEU 0.81 -1.27 1 128 GLN -1.51 0.31 1 133 LEU -4.66 3.18 1 134 LYS -2.52 1.80 1 135 PHE -3.13 1.24 1 138 MET -1.49 1.40 1 139 LYS -1.75 1.68 1 140 VAL -4.52 3.57 1 141 GLU -6.54 4.26 1 142 THR -0.13 -1.14 1 143 PHE -6.13 3.45 1 144 TYR -4.46 -0.37 1 147 LYS -1.18 1.11 1 149 HIS 5.97 -1.70 1 150 THR -5.08 3.13 1 151 GLU 0.87 0.70 1 152 ASP -1.16 0.57 1 153 ASN 0.97 0.26 1 154 ILE -4.55 3.21 1 155 VAL -4.32 1.22 1 156 VAL -2.45 1.49 1 157 TRP -8.22 4.94 1 160 GLN 2.71 -0.94 1 161 TYR -4.54 2.80 1 162 GLN 5.64 -3.62 1 163 ILE -4.00 2.97 1 164 LEU -6.74 4.28 1 165 ALA 1.06 -2.51 1 169 LEU -0.55 1.72 1 170 VAL -2.12 1.03 1 172 SER -0.85 0.27 1 173 ALA 3.54 -1.09 1 175 SER 2.57 -0.59 1 176 LYS -0.96 -0.05 1 177 ASP -3.46 1.98 1 181 VAL -0.36 -1.31 1 182 ALA 3.74 -0.35 1 183 ASP -2.27 0.95 1 184 ALA -4.33 3.23 1 185 TYR -0.85 -0.36 1 186 VAL 6.02 -1.01 1 187 ASN 3.51 -0.88 1 188 GLU 0.24 1.21 1 189 TRP 0.67 1.19 1 191 THR 5.89 -1.41 1 193 ILE 6.23 -3.09 1 194 GLU 4.69 -0.81 1 195 ASN 4.07 -1.50 1 196 VAL 6.62 -1.42 1 197 LEU 2.78 -0.30 1 198 LYS 1.91 -0.07 1 199 ARG 3.45 -0.72 1 200 TYR -1.46 -2.04 1 202 ASN -0.09 -0.57 1 203 ILE -0.64 2.81 1 204 ASN 0.52 1.16 1 205 LEU -6.08 4.94 1 206 VAL -3.47 1.53 1 207 VAL -4.89 0.83 1 210 HIS -1.67 1.83 1 212 GLU 0.34 0.32 1 213 VAL 2.15 -0.50 1 215 ASP -2.66 0.90 1 216 ARG 4.10 -0.32 1 218 LEU 4.88 -0.91 1 219 LEU 6.42 -1.95 1 220 LEU 4.85 -2.02 1 221 HIS 2.86 0.93 1 223 LEU 4.04 -0.75 1 224 ASP 4.17 -0.99 1 225 LEU 1.20 -0.17 1 226 LEU -1.14 1.36 1 227 LYS 1.82 0.47 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27564_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.74 _LACS_plot.Line_1_terminator_val_y_1 -3.17 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.79 _LACS_plot.Line_2_terminator_val_x_2 9.09 _LACS_plot.Line_2_terminator_val_y_2 2.34 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 88 HIS -9.74 3.20 0 10 LYS -5.69 0.54 1 11 ASN -0.30 0.99 1 13 THR 0.00 1.17 1 15 THR 1.28 -0.41 1 16 ILE -2.78 -1.94 1 17 SER -4.83 -1.03 1 18 ILE -3.53 -1.02 1 19 SER -3.41 -0.60 1 20 GLN 2.76 -0.23 1 21 LEU 1.32 -0.67 1 22 ASN -0.97 -0.99 1 24 ASN -1.57 -1.76 1 25 VAL -0.96 -3.08 1 26 TRP -3.61 -1.25 1 27 VAL -2.24 0.64 1 28 HIS -5.15 -1.95 1 29 THR -3.14 0.27 1 30 GLU -6.05 -0.44 1 31 LEU -1.39 -2.82 1 33 TYR -1.57 -0.73 1 34 PHE -1.96 -0.11 1 37 GLU -4.37 -2.49 1 38 ALA -1.69 -0.28 1 39 VAL -4.59 -2.08 1 41 SER -0.50 -1.70 1 42 ASN -5.44 1.34 1 44 LEU -6.25 -0.65 1 45 VAL -1.16 -3.03 1 46 LEU -0.93 -2.72 1 47 ASN 0.02 -0.97 1 48 THR -4.04 1.50 1 50 LYS -1.30 -0.88 1 52 LEU -3.07 -2.28 1 53 VAL -4.12 -0.56 1 54 LEU -3.40 -0.46 1 55 VAL 2.99 -0.38 1 56 ASP 3.88 -2.48 1 57 SER -5.34 -4.50 1 58 SER -1.05 -0.61 1 59 TRP -1.14 -0.15 1 60 ASP -3.43 1.20 1 62 LYS 5.02 3.89 1 63 LEU 1.16 1.49 1 64 THR 9.09 0.51 1 65 LYS 5.47 0.72 1 66 GLU 3.77 1.93 1 67 LEU 4.31 -0.07 1 68 ILE 5.76 0.79 1 69 GLU 4.02 3.00 1 70 MET 3.28 3.49 1 71 VAL 5.15 1.18 1 72 GLU 4.72 4.23 1 73 LYS 3.36 1.86 1 74 LYS 3.32 1.28 1 75 PHE 1.24 -1.01 1 76 LYS 5.22 -1.61 1 77 LYS -6.29 -3.12 1 78 ARG -2.49 1.11 1 79 VAL 1.36 0.07 1 80 THR 1.31 1.48 1 81 ASP -7.80 -3.09 1 82 VAL -6.33 -1.95 1 83 ILE -2.25 -3.02 1 84 ILE -1.59 1.32 1 85 THR 2.08 2.40 1 86 HIS 4.36 -1.74 1 87 ALA 0.56 -1.78 1 90 ASP 8.14 -3.39 1 91 ARG -3.82 3.84 1 92 ILE -3.35 -2.20 1 95 MET 2.72 1.63 1 96 LYS 7.06 2.59 1 97 THR 6.89 1.24 1 98 LEU 6.61 1.06 1 99 LYS 4.25 4.40 1 100 GLU 2.77 1.72 1 101 ARG -0.89 0.16 1 103 ILE 0.60 -1.15 1 104 LYS 0.74 -2.55 1 105 ALA -3.06 -3.69 1 106 HIS 0.25 0.18 1 107 SER -3.32 -0.98 1 108 THR -0.68 3.59 1 110 LEU 4.30 0.74 1 111 THR 6.85 1.53 1 112 ALA 5.30 0.51 1 113 GLU 3.03 3.42 1 114 LEU 3.73 1.92 1 115 ALA 4.10 1.09 1 116 LYS 3.57 4.52 1 117 LYS 3.49 0.96 1 118 ASN -0.53 -0.61 1 120 TYR -2.41 -0.15 1 124 LEU 1.07 1.70 1 126 ASP 0.95 0.40 1 127 LEU 0.81 -0.08 1 128 GLN -1.51 -0.28 1 133 LEU -4.66 -2.25 1 134 LYS -2.52 -2.00 1 135 PHE -3.13 -0.27 1 138 MET -1.49 -1.28 1 139 LYS -1.75 -1.15 1 140 VAL -4.52 -3.03 1 141 GLU -6.54 -0.86 1 142 THR -0.13 -1.30 1 143 PHE -6.13 -2.36 1 144 TYR -4.46 -4.01 1 147 LYS -1.18 1.64 1 149 HIS 5.97 -0.91 1 150 THR -5.08 2.06 1 151 GLU 0.87 -1.41 1 152 ASP -1.16 -1.32 1 153 ASN 0.97 0.30 1 154 ILE -4.55 0.89 1 155 VAL -4.32 -2.62 1 156 VAL -2.45 -3.90 1 157 TRP -8.22 -2.03 1 158 LEU -3.62 -2.40 1 160 GLN 2.71 -0.15 1 161 TYR -4.54 -2.08 1 162 GLN 5.64 -1.02 1 163 ILE -4.00 -4.14 1 164 LEU -6.74 -2.20 1 165 ALA 1.06 -0.87 1 169 LEU -0.55 -3.33 1 170 VAL -2.12 -1.90 1 171 LYS -1.24 -1.97 1 172 SER -0.85 0.97 1 173 ALA 3.54 -3.03 1 177 ASP -3.46 -1.43 1 181 VAL -0.36 0.88 1 182 ALA 3.74 0.51 1 183 ASP -2.27 -2.31 1 184 ALA -4.33 -0.42 1 185 TYR -0.85 1.72 1 186 VAL 6.02 1.07 1 187 ASN 3.51 1.37 1 188 GLU 0.24 -0.29 1 189 TRP 0.67 2.62 1 191 THR 5.89 1.48 1 193 ILE 6.23 2.08 1 194 GLU 4.69 2.50 1 195 ASN 4.07 3.55 1 196 VAL 6.62 0.02 1 197 LEU 2.78 1.35 1 198 LYS 1.91 0.73 1 199 ARG 3.45 -0.06 1 200 TYR -1.46 -1.19 1 202 ASN -0.09 -1.01 1 203 ILE -0.64 -0.79 1 204 ASN 0.52 -1.10 1 205 LEU -6.08 -2.78 1 206 VAL -3.47 -2.72 1 207 VAL -4.89 -1.57 1 210 HIS -1.67 0.52 1 212 GLU 0.34 0.32 1 213 VAL 2.15 -0.42 1 215 ASP -2.66 0.03 1 216 ARG 4.10 0.97 1 218 LEU 4.88 3.51 1 219 LEU 6.42 -0.18 1 220 LEU 4.85 1.65 1 221 HIS 2.86 2.39 1 223 LEU 4.04 2.15 1 224 ASP 4.17 2.44 1 225 LEU 1.20 0.15 1 226 LEU -1.14 -1.46 1 227 LYS 1.82 4.82 1 stop_ save_