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 bmr25855_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 -3.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.83 _LACS_plot.Line_2_terminator_val_x_2 6.52 _LACS_plot.Line_2_terminator_val_y_2 5.07 _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 108 HIS -7.93 -1.75 0 23 GLU -4.03 -1.50 1 24 THR -0.47 0.49 1 25 VAL -3.70 -1.58 1 27 VAL -3.91 -1.57 1 28 PHE 0.72 0.03 1 29 ILE -1.80 -1.59 1 31 ALA 4.03 3.00 1 32 GLN 3.17 1.64 1 33 ALA -1.06 -1.08 1 34 VAL 6.52 5.14 1 36 ALA 1.59 0.74 1 37 ILE 2.91 -0.58 1 38 ILE 3.44 3.48 1 45 ILE 5.09 3.54 1 46 LYS 4.03 3.40 1 48 LEU 3.02 2.99 1 50 ARG 3.18 2.43 1 51 PHE 2.20 2.12 1 52 ALA -0.40 -0.12 1 54 ALA -7.67 -3.37 1 56 ILE -2.62 -0.91 1 57 LYS -4.77 -1.54 1 58 ILE 0.84 -0.50 1 59 ALA -0.07 -0.81 1 62 GLU 1.83 2.36 1 63 THR -1.44 -1.30 1 65 ASP -0.70 -1.34 1 67 LYS 1.34 1.04 1 68 VAL -6.55 -3.23 1 69 ARG -5.59 -3.73 1 70 MET -3.09 0.04 1 72 VAL 1.01 -0.43 1 73 ILE -1.61 -0.31 1 74 THR -2.16 -0.99 1 78 GLU 4.17 3.30 1 79 ALA 0.74 1.77 1 81 PHE 3.78 3.71 1 83 ALA 2.81 2.74 1 86 ARG 1.78 1.05 1 87 ILE 6.02 4.60 1 88 TYR 5.79 5.09 1 90 LYS 2.93 1.22 1 91 LEU 4.37 2.70 1 92 LYS 3.54 2.57 1 94 GLU -0.85 -1.21 1 95 ASN 4.25 2.40 1 96 PHE 5.06 3.93 1 97 PHE -2.08 -0.61 1 100 LYS 0.82 -0.29 1 101 GLU -3.31 -0.69 1 102 GLU -1.72 -1.22 1 103 VAL 2.06 1.15 1 104 LYS -2.90 -0.82 1 105 LEU -5.26 -2.38 1 106 GLU -1.72 0.45 1 107 THR -2.63 -0.58 1 109 ILE -4.24 -2.01 1 110 ARG -2.25 -1.16 1 111 VAL -3.82 -2.83 1 113 ALA 4.34 3.41 1 115 ALA -1.51 -0.31 1 116 ALA 3.81 2.88 1 119 VAL 3.65 2.74 1 128 ASN 2.81 2.28 1 131 GLN 3.51 3.39 1 134 THR -0.30 -0.05 1 135 ALA 2.21 1.28 1 136 ALA -2.05 -1.38 1 138 VAL -1.67 -0.98 1 139 VAL -4.85 -1.51 1 140 VAL -0.63 -1.24 1 142 ARG 0.41 0.44 1 143 ASP 1.78 0.11 1 144 GLN -2.31 -0.64 1 145 THR -0.62 -0.17 1 147 ASP -1.41 -1.48 1 148 GLU 3.59 1.96 1 149 ASN -0.91 -0.38 1 150 GLU 2.95 0.90 1 151 GLN -2.53 -0.86 1 152 VAL -4.86 -3.64 1 153 ILE -1.57 0.12 1 154 VAL -1.14 -0.45 1 155 LYS -2.91 -1.36 1 156 ILE -3.70 -0.94 1 157 ILE -2.10 -0.41 1 159 HIS -2.08 0.38 1 160 PHE 5.81 4.58 1 161 TYR 5.34 4.38 1 162 ALA 2.74 2.34 1 163 SER 2.20 1.75 1 164 GLN 4.07 3.16 1 165 MET -1.92 -2.96 1 168 ARG 3.47 2.36 1 169 LYS 6.40 4.37 1 170 ILE 5.62 4.05 1 171 ARG 3.91 3.30 1 172 ASP 4.80 4.37 1 173 ILE 3.77 2.40 1 174 LEU 1.96 1.56 1 175 ALA 2.68 2.35 1 176 GLN 2.68 1.85 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25855_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 4.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 6.52 _LACS_plot.Line_2_terminator_val_y_2 -1.45 _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 108 HIS -7.93 6.18 0 23 GLU -4.03 2.53 1 24 THR -0.47 0.96 1 25 VAL -3.70 2.12 1 27 VAL -3.91 2.34 1 28 PHE 0.72 -0.69 1 29 ILE -1.80 0.21 1 31 ALA 4.03 -1.03 1 32 GLN 3.17 -1.53 1 33 ALA -1.06 -0.02 1 34 VAL 6.52 -1.38 1 36 ALA 1.59 -0.85 1 37 ILE 2.91 -3.49 1 38 ILE 3.44 0.04 1 45 ILE 5.09 -1.55 1 46 LYS 4.03 -0.63 1 48 LEU 3.02 -0.03 1 50 ARG 3.18 -0.75 1 51 PHE 2.20 -0.08 1 52 ALA -0.40 0.28 1 54 ALA -7.67 4.30 1 56 ILE -2.62 1.71 1 57 LYS -4.77 3.23 1 58 ILE 0.84 -1.34 1 59 ALA -0.07 -0.74 1 62 GLU 1.83 0.53 1 63 THR -1.44 0.14 1 65 ASP -0.70 -0.64 1 67 LYS 1.34 -0.30 1 68 VAL -6.55 3.32 1 69 ARG -5.59 1.86 1 70 MET -3.09 3.13 1 72 VAL 1.01 -1.44 1 73 ILE -1.61 1.30 1 74 THR -2.16 1.17 1 78 GLU 4.17 -0.87 1 79 ALA 0.74 1.03 1 81 PHE 3.78 -0.07 1 83 ALA 2.81 -0.07 1 86 ARG 1.78 -0.73 1 87 ILE 6.02 -1.42 1 88 TYR 5.79 -0.70 1 90 LYS 2.93 -1.71 1 91 LEU 4.37 -1.67 1 92 LYS 3.54 -0.97 1 94 GLU -0.85 -0.36 1 95 ASN 4.25 -1.85 1 96 PHE 5.06 -1.13 1 97 PHE -2.08 1.47 1 100 LYS 0.82 -1.11 1 101 GLU -3.31 2.62 1 102 GLU -1.72 0.50 1 103 VAL 2.06 -0.91 1 104 LYS -2.90 2.08 1 105 LEU -5.26 2.88 1 106 GLU -1.72 2.17 1 107 THR -2.63 2.05 1 109 ILE -4.24 2.23 1 110 ARG -2.25 1.09 1 111 VAL -3.82 0.99 1 113 ALA 4.34 -0.93 1 115 ALA -1.51 1.20 1 116 ALA 3.81 -0.93 1 119 VAL 3.65 -0.91 1 128 ASN 2.81 -0.53 1 131 GLN 3.51 -0.12 1 134 THR -0.30 0.25 1 135 ALA 2.21 -0.93 1 136 ALA -2.05 0.67 1 138 VAL -1.67 0.69 1 139 VAL -4.85 3.34 1 140 VAL -0.63 -0.61 1 142 ARG 0.41 0.03 1 143 ASP 1.78 -1.67 1 144 GLN -2.31 1.67 1 145 THR -0.62 0.45 1 147 ASP -1.41 -0.07 1 148 GLU 3.59 -1.63 1 149 ASN -0.91 0.53 1 150 GLU 2.95 -2.05 1 151 GLN -2.53 1.67 1 152 VAL -4.86 1.22 1 153 ILE -1.57 1.69 1 154 VAL -1.14 0.69 1 155 LYS -2.91 1.55 1 156 ILE -3.70 2.76 1 157 ILE -2.10 1.69 1 159 HIS -2.08 2.46 1 160 PHE 5.81 -1.23 1 161 TYR 5.34 -0.96 1 162 ALA 2.74 -0.40 1 163 SER 2.20 -0.45 1 164 GLN 4.07 -0.91 1 165 MET -1.92 -1.04 1 168 ARG 3.47 -1.11 1 169 LYS 6.40 -2.03 1 170 ILE 5.62 -1.57 1 171 ARG 3.91 -0.61 1 172 ASP 4.80 -0.43 1 173 ILE 3.77 -1.37 1 174 LEU 1.96 -0.40 1 175 ALA 2.68 -0.33 1 176 GLN 2.68 -0.83 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25855_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 0.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.52 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _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 103 VAL 2.06 -1.35 0 70 MET -3.09 -0.68 0 36 ALA 1.59 -1.33 0 23 GLU -4.03 0.23 1 24 THR -0.47 0.95 1 25 VAL -3.70 0.31 1 27 VAL -3.91 0.60 1 28 PHE 0.72 0.29 1 29 ILE -1.80 0.44 1 31 ALA 4.03 -0.73 1 32 GLN 3.17 -0.16 1 33 ALA -1.06 -0.36 1 34 VAL 6.52 -1.23 1 37 ILE 2.91 -0.72 1 38 ILE 3.44 -0.28 1 45 ILE 5.09 -0.28 1 46 LYS 4.03 -0.18 1 48 LEU 3.02 -0.30 1 50 ARG 3.18 -0.18 1 51 PHE 2.20 -0.30 1 52 ALA -0.40 -0.56 1 54 ALA -7.67 0.61 1 56 ILE -2.62 0.82 1 57 LYS -4.77 0.43 1 58 ILE 0.84 0.54 1 59 ALA -0.07 0.19 1 62 GLU 1.83 -0.31 1 63 THR -1.44 0.18 1 65 ASP -0.70 0.00 1 67 LYS 1.34 0.02 1 68 VAL -6.55 1.07 1 69 ARG -5.59 0.35 1 72 VAL 1.01 0.54 1 73 ILE -1.61 0.76 1 74 THR -2.16 1.28 1 78 GLU 4.17 -0.22 1 79 ALA 0.74 0.05 1 81 PHE 3.78 -0.52 1 83 ALA 2.81 -0.38 1 86 ARG 1.78 -0.18 1 87 ILE 6.02 -0.69 1 88 TYR 5.79 -0.75 1 90 LYS 2.93 -0.14 1 91 LEU 4.37 -0.20 1 92 LYS 3.54 0.00 1 94 GLU -0.85 -0.09 1 95 ASN 4.25 -0.23 1 96 PHE 5.06 -0.46 1 97 PHE -2.08 -0.07 1 100 LYS 0.82 0.04 1 101 GLU -3.31 0.04 1 102 GLU -1.72 -0.05 1 104 LYS -2.90 0.29 1 105 LEU -5.26 0.57 1 106 GLU -1.72 0.56 1 107 THR -2.63 1.17 1 108 HIS -7.93 1.33 1 109 ILE -4.24 0.47 1 110 ARG -2.25 0.89 1 111 VAL -3.82 0.43 1 113 ALA 4.34 -0.41 1 115 ALA -1.51 0.17 1 116 ALA 3.81 -0.73 1 119 VAL 3.65 -0.47 1 128 ASN 2.81 -0.25 1 131 GLN 3.51 -0.05 1 134 THR -0.30 -0.03 1 135 ALA 2.21 -0.21 1 136 ALA -2.05 0.22 1 138 VAL -1.67 0.76 1 139 VAL -4.85 0.10 1 140 VAL -0.63 0.18 1 142 ARG 0.41 -0.11 1 143 ASP 1.78 -0.23 1 144 GLN -2.31 0.03 1 145 THR -0.62 0.01 1 147 ASP -1.41 -0.09 1 148 GLU 3.59 -0.18 1 149 ASN -0.91 0.20 1 150 GLU 2.95 -0.58 1 151 GLN -2.53 0.68 1 152 VAL -4.86 0.46 1 153 ILE -1.57 0.46 1 154 VAL -1.14 0.11 1 155 LYS -2.91 0.83 1 156 ILE -3.70 0.87 1 157 ILE -2.10 0.93 1 159 HIS -2.08 0.81 1 160 PHE 5.81 -1.43 1 161 TYR 5.34 -1.11 1 162 ALA 2.74 -0.27 1 163 SER 2.20 -0.64 1 164 GLN 4.07 -0.43 1 165 MET -1.92 -0.45 1 168 ARG 3.47 -0.19 1 169 LYS 6.40 -0.64 1 170 ILE 5.62 -0.47 1 171 ARG 3.91 -0.21 1 172 ASP 4.80 -0.52 1 173 ILE 3.77 -0.44 1 174 LEU 1.96 -0.18 1 175 ALA 2.68 -0.25 1 176 GLN 2.68 -0.29 1 stop_ save_