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 bmr19417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 -3.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.43 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 6.12 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 LEU -1.34 -4.62 0 10 TYR -6.41 -3.77 1 11 VAL -4.59 -2.08 1 12 GLU -2.66 -2.15 1 13 LEU 0.95 -0.35 1 14 SER 3.82 2.46 1 15 SER -2.00 -1.99 1 17 VAL -2.60 -0.52 1 19 VAL -1.60 -1.72 1 20 SER 2.77 2.47 1 21 GLN -1.98 -1.68 1 24 LYS -5.59 -2.25 1 25 ILE 0.29 -0.40 1 26 GLU -4.85 -1.05 1 27 VAL -2.57 -0.54 1 28 VAL -6.06 -3.33 1 29 GLU -3.48 -2.82 1 30 LEU -1.47 -0.33 1 31 PHE -6.07 -2.50 1 32 TRP -7.64 -3.30 1 33 TYR 0.86 1.94 1 37 HIS 1.92 3.40 1 39 TYR 1.06 -0.69 1 40 ALA 2.12 1.11 1 41 PHE -3.76 -3.04 1 42 GLU 8.69 6.03 1 44 THR 3.36 2.09 1 45 ILE 4.26 2.13 1 46 VAL 3.77 3.39 1 48 TRP 4.22 1.80 1 49 SER 1.08 0.88 1 50 GLU -1.17 -1.60 1 51 LYS 0.51 0.09 1 52 LEU 1.66 1.37 1 54 ALA 1.02 -1.49 1 55 ASP -2.65 -2.01 1 56 VAL -5.29 -1.16 1 57 HIS -2.83 -1.78 1 58 PHE -5.00 -2.09 1 59 VAL -4.02 -1.59 1 60 ARG -8.01 -3.27 1 61 LEU -2.45 -2.67 1 63 ALA 1.37 -2.39 1 65 PHE 0.14 -0.16 1 68 ILE 5.69 2.57 1 69 TRP 4.61 1.74 1 70 ASN 4.29 2.92 1 71 VAL -1.21 2.38 1 72 HIS 7.38 4.83 1 74 GLN 7.28 5.14 1 75 MET 6.05 4.60 1 76 PHE 2.73 2.15 1 77 LEU 7.49 5.45 1 78 THR 3.90 2.52 1 79 LEU 2.09 1.85 1 80 GLU 3.85 2.71 1 81 SER -0.11 1.52 1 82 MET -0.74 -1.18 1 84 VAL 5.24 5.61 1 86 HIS 3.56 4.87 1 89 HIS 3.96 3.52 1 90 ASN 4.14 2.12 1 91 ALA 6.33 4.62 1 92 VAL 5.36 5.15 1 93 PHE 3.61 3.16 1 94 GLU 2.83 1.70 1 95 ALA 1.65 2.14 1 96 ILE 1.14 4.12 1 97 HIS 0.37 0.22 1 98 LYS -0.84 -1.22 1 99 GLU 4.12 1.55 1 100 HIS -0.31 -0.73 1 101 LYS 1.25 1.00 1 102 LYS 2.14 -1.21 1 103 LEU -2.04 0.09 1 104 ALA -3.66 -3.07 1 105 THR 5.99 4.29 1 107 GLU 2.19 2.35 1 108 GLU 4.16 3.92 1 109 MET 2.92 1.98 1 110 ALA 3.45 2.73 1 111 ASP 3.07 2.50 1 112 PHE 3.61 1.31 1 113 LEU 2.89 1.40 1 114 ALA -1.57 -3.98 1 116 LYS 0.07 -1.03 1 118 VAL -0.73 0.34 1 119 ASP 3.51 3.51 1 120 LYS 3.79 2.75 1 121 GLU 3.12 2.15 1 122 LYS 5.30 4.39 1 123 PHE 3.56 2.75 1 124 LEU 3.79 2.41 1 125 SER 7.04 4.99 1 126 THR 3.34 3.05 1 127 TYR -0.79 0.13 1 128 ASN -1.27 0.30 1 129 SER 4.15 2.91 1 130 PHE 3.79 2.57 1 131 ALA 3.47 -0.39 1 132 ILE 5.21 3.60 1 133 LYS 3.03 2.84 1 135 GLN 3.29 2.40 1 136 MET 3.48 2.42 1 137 GLU 3.99 2.94 1 138 LYS 4.63 2.52 1 139 ALA 4.18 3.63 1 140 LYS 3.94 2.94 1 141 LYS 3.73 2.12 1 142 LEU 4.87 3.19 1 143 ALA 3.00 2.31 1 144 MET 3.37 2.29 1 145 ALA -2.96 -2.80 1 146 TYR 4.21 0.17 1 147 GLN 0.24 0.02 1 148 VAL -0.88 -0.92 1 149 THR -5.88 -2.25 1 151 VAL -2.63 0.45 1 153 THR -4.46 -3.05 1 154 MET -4.75 -2.80 1 155 VAL -3.45 -1.06 1 156 VAL -2.15 -1.08 1 157 ASN -3.09 0.80 1 159 LYS -7.68 -3.68 1 160 TYR -4.91 -1.79 1 161 ARG -2.90 -1.99 1 162 PHE -4.09 -2.31 1 163 ASP 3.97 2.12 1 164 ILE 4.91 2.78 1 166 SER -0.27 0.90 1 167 ALA 4.85 3.48 1 171 GLU 4.53 3.12 1 172 GLU 7.75 5.37 1 173 THR 4.72 1.25 1 174 LEU 4.40 3.57 1 175 LYS 4.13 1.63 1 176 LEU 4.92 3.41 1 177 ALA 4.71 3.64 1 178 ASP 3.59 2.94 1 179 TYR 2.63 1.73 1 180 LEU 5.16 4.84 1 181 ILE 3.71 1.99 1 182 GLU 3.57 2.77 1 183 LYS 0.66 1.09 1 184 GLU 4.32 3.50 1 185 ARG 2.63 1.37 1 186 ALA 1.21 0.61 1 187 ALA 0.32 -0.18 1 188 ALA 0.35 -0.13 1 189 LYS 0.78 1.15 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 4.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.57 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 -2.57 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 LEU -1.34 -3.28 0 10 TYR -6.41 2.64 1 11 VAL -4.59 2.51 1 12 GLU -2.66 0.51 1 13 LEU 0.95 -1.30 1 14 SER 3.82 -1.36 1 15 SER -2.00 0.01 1 17 VAL -2.60 2.08 1 19 VAL -1.60 -0.12 1 20 SER 2.77 -0.30 1 21 GLN -1.98 0.30 1 24 LYS -5.59 3.34 1 25 ILE 0.29 -0.69 1 26 GLU -4.85 3.80 1 27 VAL -2.57 2.03 1 28 VAL -6.06 2.73 1 29 GLU -3.48 0.66 1 30 LEU -1.47 1.14 1 31 PHE -6.07 3.57 1 32 TRP -7.64 4.34 1 33 TYR 0.86 1.08 1 37 HIS 1.92 1.48 1 39 TYR 1.06 -1.75 1 40 ALA 2.12 -1.01 1 41 PHE -3.76 0.72 1 42 GLU 8.69 -2.66 1 44 THR 3.36 -1.27 1 45 ILE 4.26 -2.13 1 46 VAL 3.77 -0.38 1 48 TRP 4.22 -2.42 1 49 SER 1.08 -0.20 1 50 GLU -1.17 -0.43 1 51 LYS 0.51 -0.42 1 52 LEU 1.66 -0.29 1 54 ALA 1.02 -2.51 1 55 ASP -2.65 0.64 1 56 VAL -5.29 4.13 1 57 HIS -2.83 1.05 1 58 PHE -5.00 2.91 1 59 VAL -4.02 2.43 1 60 ARG -8.01 4.74 1 61 LEU -2.45 -0.22 1 63 ALA 1.37 -3.76 1 65 PHE 0.14 -0.30 1 68 ILE 5.69 -3.12 1 69 TRP 4.61 -2.87 1 70 ASN 4.29 -1.37 1 71 VAL -1.21 3.59 1 72 HIS 7.38 -2.55 1 74 GLN 7.28 -2.14 1 75 MET 6.05 -1.45 1 76 PHE 2.73 -0.58 1 77 LEU 7.49 -2.04 1 78 THR 3.90 -1.38 1 79 LEU 2.09 -0.24 1 80 GLU 3.85 -1.14 1 81 SER -0.11 1.63 1 82 MET -0.74 -0.44 1 84 VAL 5.24 0.37 1 86 HIS 3.56 1.31 1 89 HIS 3.96 -0.44 1 90 ASN 4.14 -2.02 1 91 ALA 6.33 -1.71 1 92 VAL 5.36 -0.21 1 93 PHE 3.61 -0.45 1 94 GLU 2.83 -1.13 1 95 ALA 1.65 0.49 1 96 ILE 1.14 2.98 1 97 HIS 0.37 -0.15 1 98 LYS -0.84 -0.38 1 99 GLU 4.12 -2.57 1 100 HIS -0.31 -0.42 1 101 LYS 1.25 -0.25 1 102 LYS 2.14 -3.35 1 103 LEU -2.04 2.13 1 104 ALA -3.66 0.59 1 105 THR 5.99 -1.70 1 107 GLU 2.19 0.16 1 108 GLU 4.16 -0.24 1 109 MET 2.92 -0.94 1 110 ALA 3.45 -0.72 1 111 ASP 3.07 -0.57 1 112 PHE 3.61 -2.30 1 113 LEU 2.89 -1.49 1 114 ALA -1.57 -2.41 1 116 LYS 0.07 -1.10 1 118 VAL -0.73 1.07 1 119 ASP 3.51 0.00 1 120 LYS 3.79 -1.04 1 121 GLU 3.12 -0.97 1 122 LYS 5.30 -0.91 1 123 PHE 3.56 -0.81 1 124 LEU 3.79 -1.38 1 125 SER 7.04 -2.05 1 126 THR 3.34 -0.29 1 127 TYR -0.79 0.92 1 128 ASN -1.27 1.57 1 129 SER 4.15 -1.24 1 130 PHE 3.79 -1.22 1 131 ALA 3.47 -3.86 1 132 ILE 5.21 -1.61 1 133 LYS 3.03 -0.19 1 135 GLN 3.29 -0.89 1 136 MET 3.48 -1.06 1 137 GLU 3.99 -1.05 1 138 LYS 4.63 -2.11 1 139 ALA 4.18 -0.55 1 140 LYS 3.94 -1.00 1 141 LYS 3.73 -1.61 1 142 LEU 4.87 -1.68 1 143 ALA 3.00 -0.69 1 144 MET 3.37 -1.08 1 145 ALA -2.96 0.16 1 146 TYR 4.21 -4.04 1 147 GLN 0.24 -0.22 1 148 VAL -0.88 -0.04 1 149 THR -5.88 3.63 1 151 VAL -2.63 3.08 1 153 THR -4.46 1.41 1 154 MET -4.75 1.95 1 155 VAL -3.45 2.39 1 156 VAL -2.15 1.07 1 157 ASN -3.09 3.89 1 159 LYS -7.68 4.00 1 160 TYR -4.91 3.12 1 161 ARG -2.90 0.91 1 162 PHE -4.09 1.78 1 163 ASP 3.97 -1.85 1 164 ILE 4.91 -2.13 1 166 SER -0.27 1.17 1 167 ALA 4.85 -1.37 1 171 GLU 4.53 -1.41 1 172 GLU 7.75 -2.38 1 173 THR 4.72 -3.47 1 174 LEU 4.40 -0.83 1 175 LYS 4.13 -2.50 1 176 LEU 4.92 -1.51 1 177 ALA 4.71 -1.07 1 178 ASP 3.59 -0.65 1 179 TYR 2.63 -0.90 1 180 LEU 5.16 -0.32 1 181 ILE 3.71 -1.72 1 182 GLU 3.57 -0.80 1 183 LYS 0.66 0.43 1 184 GLU 4.32 -0.82 1 185 ARG 2.63 -1.26 1 186 ALA 1.21 -0.60 1 187 ALA 0.32 -0.50 1 188 ALA 0.35 -0.48 1 189 LYS 0.78 0.37 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19417_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.01 _LACS_plot.Line_1_terminator_val_y_1 0.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.12 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _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 30 LEU -1.47 1.66 0 10 TYR -6.41 0.70 1 11 VAL -4.59 0.35 1 12 GLU -2.66 0.86 1 13 LEU 0.95 -0.10 1 14 SER 3.82 -0.27 1 15 SER -2.00 0.18 1 17 VAL -2.60 -0.10 1 19 VAL -1.60 0.21 1 20 SER 2.77 -0.35 1 24 LYS -5.59 0.44 1 25 ILE 0.29 0.13 1 26 GLU -4.85 0.73 1 27 VAL -2.57 0.79 1 28 VAL -6.06 1.19 1 29 GLU -3.48 0.96 1 31 PHE -6.07 0.31 1 32 TRP -7.64 0.36 1 33 TYR 0.86 -0.47 1 37 HIS 1.92 -0.17 1 39 TYR 1.06 -0.96 1 40 ALA 2.12 -0.55 1 41 PHE -3.76 0.22 1 42 GLU 8.69 -0.42 1 44 THR 3.36 -0.19 1 45 ILE 4.26 -0.35 1 46 VAL 3.77 -0.58 1 48 TRP 4.22 -1.31 1 49 SER 1.08 -0.34 1 50 GLU -1.17 0.03 1 51 LYS 0.51 -0.66 1 52 LEU 1.66 -0.13 1 54 ALA 1.02 -0.05 1 55 ASP -2.65 0.86 1 56 VAL -5.29 0.32 1 57 HIS -2.83 0.84 1 58 PHE -5.00 -0.18 1 59 VAL -4.02 0.73 1 60 ARG -8.01 0.40 1 61 LEU -2.45 -0.42 1 63 ALA 1.37 0.17 1 64 LEU -1.34 0.07 1 65 PHE 0.14 -0.09 1 68 ILE 5.69 -0.99 1 69 TRP 4.61 -0.23 1 70 ASN 4.29 0.00 1 71 VAL -1.21 0.14 1 72 HIS 7.38 -0.35 1 74 GLN 7.28 -0.09 1 75 MET 6.05 0.17 1 76 PHE 2.73 -0.56 1 77 LEU 7.49 0.18 1 78 THR 3.90 -0.21 1 79 LEU 2.09 0.03 1 80 GLU 3.85 -0.19 1 81 SER -0.11 -0.26 1 82 MET -0.74 0.14 1 84 VAL 5.24 -0.36 1 86 HIS 3.56 -0.30 1 89 HIS 3.96 0.06 1 90 ASN 4.14 -0.05 1 91 ALA 6.33 -1.01 1 92 VAL 5.36 -0.71 1 93 PHE 3.61 -0.60 1 94 GLU 2.83 -0.53 1 95 ALA 1.65 -0.30 1 96 ILE 1.14 -0.70 1 97 HIS 0.37 0.21 1 98 LYS -0.84 -0.02 1 99 GLU 4.12 -0.48 1 100 HIS -0.31 -0.04 1 101 LYS 1.25 -0.20 1 102 LYS 2.14 -1.10 1 103 LEU -2.04 -0.02 1 104 ALA -3.66 0.37 1 105 THR 5.99 -0.46 1 107 GLU 2.19 -0.24 1 108 GLU 4.16 -0.83 1 109 MET 2.92 -0.87 1 110 ALA 3.45 -0.29 1 111 ASP 3.07 -0.39 1 112 PHE 3.61 -1.08 1 113 LEU 2.89 0.41 1 114 ALA -1.57 0.17 1 116 LYS 0.07 -0.26 1 118 VAL -0.73 -0.26 1 119 ASP 3.51 -0.19 1 120 LYS 3.79 -0.23 1 121 GLU 3.12 -0.17 1 122 LYS 5.30 -0.29 1 123 PHE 3.56 -0.57 1 124 LEU 3.79 -0.26 1 125 SER 7.04 -0.47 1 126 THR 3.34 -0.25 1 127 TYR -0.79 0.04 1 128 ASN -1.27 -0.02 1 129 SER 4.15 -0.28 1 130 PHE 3.79 -0.21 1 131 ALA 3.47 -0.38 1 132 ILE 5.21 -0.43 1 133 LYS 3.03 -0.18 1 135 GLN 3.29 -0.51 1 136 MET 3.48 -0.37 1 137 GLU 3.99 -0.32 1 138 LYS 4.63 -0.21 1 139 ALA 4.18 -0.27 1 140 LYS 3.94 -0.32 1 141 LYS 3.73 -0.61 1 142 LEU 4.87 -0.39 1 143 ALA 3.00 -0.21 1 144 MET 3.37 -0.21 1 145 ALA -2.96 0.10 1 146 TYR 4.21 -0.49 1 147 GLN 0.24 0.01 1 148 VAL -0.88 -0.02 1 149 THR -5.88 0.47 1 151 VAL -2.63 0.33 1 153 THR -4.46 1.19 1 154 MET -4.75 1.25 1 155 VAL -3.45 0.94 1 156 VAL -2.15 0.17 1 157 ASN -3.09 0.20 1 159 LYS -7.68 1.57 1 160 TYR -4.91 1.32 1 161 ARG -2.90 0.51 1 162 PHE -4.09 0.07 1 163 ASP 3.97 -0.11 1 164 ILE 4.91 -0.29 1 166 SER -0.27 -0.06 1 167 ALA 4.85 -0.50 1 171 GLU 4.53 -0.58 1 172 GLU 7.75 0.11 1 173 THR 4.72 -0.81 1 174 LEU 4.40 -0.43 1 175 LYS 4.13 -0.84 1 176 LEU 4.92 -0.52 1 177 ALA 4.71 -0.09 1 178 ASP 3.59 -0.30 1 179 TYR 2.63 -0.77 1 180 LEU 5.16 -0.74 1 181 ILE 3.71 -0.31 1 182 GLU 3.57 -0.45 1 183 LYS 0.66 -0.27 1 184 GLU 4.32 -0.50 1 185 ARG 2.63 -0.20 1 186 ALA 1.21 -0.11 1 187 ALA 0.32 -0.03 1 188 ALA 0.35 -0.02 1 189 LYS 0.78 -0.15 1 stop_ save_