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 bmr19078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.39 _LACS_plot.Line_1_terminator_val_y_1 -1.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _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 8.11 _LACS_plot.Line_2_terminator_val_y_2 5.45 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 138 ASP -0.74 -3.11 0 139 GLU 8.11 6.54 0 10 ASN 0.13 0.44 1 11 ILE -2.01 -0.45 1 12 ARG 0.19 -0.36 1 14 MET -2.14 -0.20 1 15 ASN 4.08 1.74 1 18 SER -2.69 -1.21 1 20 SER -0.71 -0.38 1 21 ASP 3.96 2.44 1 22 ASP 1.99 0.92 1 23 HIS -2.48 -0.43 1 25 LEU -0.04 -1.14 1 27 GLN -0.13 -0.14 1 28 LYS 3.00 2.12 1 30 TYR -3.71 -0.59 1 31 ILE -5.03 -1.03 1 33 THR 4.89 4.23 1 34 HIS -0.76 -0.89 1 37 GLN -3.15 -1.52 1 39 VAL -0.65 -0.03 1 41 GLU 3.35 3.29 1 42 SER 0.36 -0.20 1 45 LEU -2.19 -0.69 1 46 ASN 4.10 1.78 1 49 ARG -4.97 -2.02 1 51 VAL -0.88 -0.28 1 52 ALA 0.02 0.44 1 54 ASN 2.91 1.85 1 55 ARG -2.27 -0.28 1 57 ALA -2.49 -1.19 1 59 THR -0.50 -0.23 1 60 TYR 3.90 3.28 1 62 PHE -3.94 -1.32 1 63 THR -2.37 -1.90 1 66 GLN -1.55 -0.53 1 68 GLU 1.13 0.91 1 69 ARG -0.52 -0.32 1 70 ASP -2.53 -1.68 1 71 TYR -1.54 -1.85 1 72 ARG 0.77 1.44 1 73 THR -3.79 -1.87 1 77 PHE -0.17 0.34 1 78 THR 1.77 1.05 1 79 VAL -4.79 -1.81 1 80 ILE -1.36 -0.99 1 86 GLN 3.66 2.83 1 89 LEU -2.96 -1.86 1 90 SER -1.97 -0.88 1 92 ILE -1.32 -0.76 1 93 VAL -2.28 -1.36 1 94 SER -4.45 -0.66 1 95 THR -1.64 -0.90 1 96 LYS 5.97 3.66 1 97 THR 5.11 4.09 1 98 LEU 3.54 2.83 1 101 ALA -0.40 0.98 1 102 THR -2.97 -2.60 1 103 VAL -1.39 -1.24 1 105 ARG -1.34 -0.20 1 106 ALA -4.31 -0.19 1 107 TRP -5.29 -0.63 1 109 HIS -2.52 -0.01 1 112 GLU -5.05 -2.60 1 113 MET 0.52 0.11 1 116 ALA 3.51 3.00 1 117 GLN -2.58 -1.41 1 119 HIS 0.11 1.44 1 122 ARG -1.13 -0.60 1 123 ARG 3.14 2.57 1 125 PHE -4.76 -1.43 1 126 ILE -3.85 -0.72 1 128 ASN -0.36 0.75 1 129 ILE 3.09 2.59 1 130 ARG 1.78 1.99 1 131 THR -1.22 -0.14 1 133 ALA -1.29 -0.71 1 135 GLN -4.43 -1.39 1 136 ASP -0.84 1.42 1 137 VAL -1.86 -1.23 1 141 GLN 0.10 0.84 1 142 ALA 0.05 1.27 1 143 ILE 0.68 -0.90 1 146 LEU 0.71 0.69 1 151 ASN -3.08 -0.95 1 153 ILE -2.77 -0.72 1 154 ASN 0.96 1.76 1 155 THR -3.40 -2.30 1 156 VAL 5.81 2.72 1 158 SER -1.59 -2.37 1 159 PHE -0.61 -0.44 1 160 GLU -5.39 -1.94 1 162 LYS -2.00 -1.86 1 165 ALA 2.18 1.26 1 167 HIS -2.54 -0.68 1 168 LYS -3.67 -0.97 1 169 LEU 0.04 0.42 1 170 ASN -0.01 -0.42 1 171 GLU 2.61 2.26 1 172 VAL 4.05 3.12 1 173 SER -1.23 -0.31 1 174 GLN 5.45 1.44 1 175 LYS -4.13 -1.38 1 177 GLU -0.77 1.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.39 _LACS_plot.Line_1_terminator_val_y_1 3.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _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 8.11 _LACS_plot.Line_2_terminator_val_y_2 -2.66 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 138 ASP -0.74 -2.37 0 139 GLU 8.11 -1.57 0 10 ASN 0.13 0.31 1 11 ILE -2.01 1.56 1 12 ARG 0.19 -0.55 1 14 MET -2.14 1.94 1 15 ASN 4.08 -2.34 1 18 SER -2.69 1.48 1 20 SER -0.71 0.33 1 21 ASP 3.96 -1.52 1 22 ASP 1.99 -1.07 1 23 HIS -2.48 2.05 1 25 LEU -0.04 -1.10 1 27 GLN -0.13 -0.01 1 28 LYS 3.00 -0.88 1 30 TYR -3.71 3.12 1 31 ILE -5.03 4.00 1 33 THR 4.89 -0.66 1 34 HIS -0.76 -0.13 1 37 GLN -3.15 1.63 1 39 VAL -0.65 0.62 1 41 GLU 3.35 -0.06 1 42 SER 0.36 -0.56 1 45 LEU -2.19 1.50 1 46 ASN 4.10 -2.32 1 49 ARG -4.97 2.95 1 51 VAL -0.88 0.60 1 52 ALA 0.02 0.42 1 54 ASN 2.91 -1.06 1 55 ARG -2.27 1.99 1 57 ALA -2.49 1.30 1 59 THR -0.50 0.27 1 60 TYR 3.90 -0.62 1 62 PHE -3.94 2.62 1 63 THR -2.37 0.47 1 66 GLN -1.55 1.02 1 68 GLU 1.13 -0.22 1 69 ARG -0.52 0.20 1 70 ASP -2.53 0.85 1 71 TYR -1.54 -0.31 1 72 ARG 0.77 0.67 1 73 THR -3.79 1.92 1 77 PHE -0.17 0.51 1 78 THR 1.77 -0.72 1 79 VAL -4.79 2.98 1 80 ILE -1.36 0.37 1 86 GLN 3.66 -0.83 1 89 LEU -2.96 1.10 1 90 SER -1.97 1.09 1 92 ILE -1.32 0.56 1 93 VAL -2.28 0.92 1 94 SER -4.45 3.79 1 95 THR -1.64 0.74 1 96 LYS 5.97 -2.31 1 97 THR 5.11 -1.02 1 98 LEU 3.54 -0.71 1 101 ALA -0.40 1.38 1 102 THR -2.97 0.37 1 103 VAL -1.39 0.15 1 105 ARG -1.34 1.14 1 106 ALA -4.31 4.12 1 107 TRP -5.29 4.66 1 109 HIS -2.52 2.51 1 112 GLU -5.05 2.45 1 113 MET 0.52 -0.41 1 116 ALA 3.51 -0.51 1 117 GLN -2.58 1.17 1 119 HIS 0.11 1.33 1 122 ARG -1.13 0.53 1 123 ARG 3.14 -0.57 1 125 PHE -4.76 3.33 1 126 ILE -3.85 3.13 1 128 ASN -0.36 1.11 1 129 ILE 3.09 -0.50 1 130 ARG 1.78 0.21 1 131 THR -1.22 1.08 1 133 ALA -1.29 0.58 1 135 GLN -4.43 3.04 1 136 ASP -0.84 2.26 1 137 VAL -1.86 0.63 1 141 GLN 0.10 0.74 1 142 ALA 0.05 1.22 1 143 ILE 0.68 -1.58 1 146 LEU 0.71 -0.02 1 151 ASN -3.08 2.13 1 153 ILE -2.77 2.05 1 154 ASN 0.96 0.80 1 155 THR -3.40 1.10 1 156 VAL 5.81 -3.09 1 158 SER -1.59 -0.78 1 159 PHE -0.61 0.17 1 160 GLU -5.39 3.45 1 162 LYS -2.00 0.14 1 165 ALA 2.18 -0.92 1 167 HIS -2.54 1.86 1 168 LYS -3.67 2.70 1 169 LEU 0.04 0.38 1 170 ASN -0.01 -0.41 1 171 GLU 2.61 -0.35 1 172 VAL 4.05 -0.93 1 173 SER -1.23 0.92 1 174 GLN 5.45 -4.01 1 175 LYS -4.13 2.75 1 177 GLU -0.77 2.25 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.39 _LACS_plot.Line_1_terminator_val_y_1 0.60 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 8.11 _LACS_plot.Line_2_terminator_val_y_2 -0.91 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 LYS 5.97 -2.34 0 10 ASN 0.13 0.08 1 11 ILE -2.01 0.02 1 12 ARG 0.19 -0.04 1 14 MET -2.14 -0.07 1 15 ASN 4.08 -0.64 1 18 SER -2.69 0.25 1 20 SER -0.71 0.04 1 21 ASP 3.96 -0.41 1 22 ASP 1.99 -0.26 1 23 HIS -2.48 0.16 1 25 LEU -0.04 0.31 1 27 GLN -0.13 0.02 1 28 LYS 3.00 -0.25 1 30 TYR -3.71 0.70 1 31 ILE -5.03 0.61 1 33 THR 4.89 -0.51 1 37 GLN -3.15 0.44 1 39 VAL -0.65 -0.17 1 41 GLU 3.35 -0.53 1 42 SER 0.36 0.06 1 45 LEU -2.19 0.01 1 46 ASN 4.10 -0.82 1 49 ARG -4.97 0.34 1 51 VAL -0.88 0.45 1 52 ALA 0.02 -0.29 1 54 ASN 2.91 -0.28 1 57 ALA -2.49 0.47 1 59 THR -0.50 0.12 1 60 TYR 3.90 -0.36 1 62 PHE -3.94 0.94 1 63 THR -2.37 0.57 1 66 GLN -1.55 0.62 1 68 GLU 1.13 -0.31 1 69 ARG -0.52 0.25 1 70 ASP -2.53 -0.02 1 71 TYR -1.54 0.23 1 72 ARG 0.77 -0.16 1 73 THR -3.79 0.68 1 77 PHE -0.17 0.39 1 78 THR 1.77 0.18 1 79 VAL -4.79 0.30 1 80 ILE -1.36 0.30 1 86 GLN 3.66 -0.30 1 89 LEU -2.96 0.32 1 90 SER -1.97 0.11 1 92 ILE -1.32 0.16 1 93 VAL -2.28 0.41 1 94 SER -4.45 0.58 1 95 THR -1.64 0.67 1 97 THR 5.11 -0.73 1 98 LEU 3.54 -0.47 1 101 ALA -0.40 0.09 1 102 THR -2.97 0.45 1 103 VAL -1.39 0.39 1 105 ARG -1.34 0.16 1 106 ALA -4.31 0.94 1 107 TRP -5.29 0.95 1 109 HIS -2.52 -0.21 1 112 GLU -5.05 0.30 1 113 MET 0.52 0.13 1 116 ALA 3.51 -0.22 1 117 GLN -2.58 0.23 1 119 HIS 0.11 -0.44 1 122 ARG -1.13 0.11 1 123 ARG 3.14 -0.20 1 125 PHE -4.76 0.66 1 126 ILE -3.85 0.34 1 128 ASN -0.36 -0.17 1 129 ILE 3.09 -0.23 1 130 ARG 1.78 0.06 1 131 THR -1.22 0.05 1 133 ALA -1.29 -0.02 1 135 GLN -4.43 0.60 1 136 ASP -0.84 -0.64 1 137 VAL -1.86 -0.29 1 138 ASP -0.74 0.27 1 139 GLU 8.11 -1.12 1 141 GLN 0.10 -0.12 1 142 ALA 0.05 -0.16 1 143 ILE 0.68 -0.02 1 146 LEU 0.71 -0.18 1 151 ASN -3.08 0.35 1 153 ILE -2.77 0.22 1 154 ASN 0.96 0.21 1 155 THR -3.40 0.37 1 156 VAL 5.81 -0.53 1 158 SER -1.59 -0.10 1 159 PHE -0.61 0.45 1 160 GLU -5.39 0.14 1 162 LYS -2.00 0.38 1 165 ALA 2.18 -0.15 1 167 HIS -2.54 0.20 1 168 LYS -3.67 0.26 1 169 LEU 0.04 -0.14 1 170 ASN -0.01 0.05 1 171 GLU 2.61 -0.43 1 172 VAL 4.05 -0.22 1 173 SER -1.23 -0.06 1 174 GLN 5.45 -0.75 1 175 LYS -4.13 0.44 1 177 GLU -0.77 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19078_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.39 _LACS_plot.Line_1_terminator_val_y_1 -1.34 _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 -0.64 _LACS_plot.Line_2_terminator_val_x_2 8.11 _LACS_plot.Line_2_terminator_val_y_2 1.24 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 177 GLU -0.77 4.69 0 10 ASN 0.13 -0.63 1 11 ILE -2.01 -2.51 1 12 ARG 0.19 -0.55 1 14 MET -2.14 0.09 1 15 ASN 4.08 1.46 1 18 SER -2.69 -2.16 1 20 SER -0.71 -0.61 1 21 ASP 3.96 -1.52 1 22 ASP 1.99 -2.03 1 23 HIS -2.48 -1.47 1 25 LEU -0.04 -0.76 1 27 GLN -0.13 -0.83 1 28 LYS 3.00 0.61 1 30 TYR -3.71 -0.89 1 31 ILE -5.03 -1.34 1 33 THR 4.89 0.22 1 34 HIS -0.76 0.86 1 37 GLN -3.15 -1.79 1 39 VAL -0.65 -0.18 1 41 GLU 3.35 1.08 1 42 SER 0.36 -0.39 1 45 LEU -2.19 0.14 1 46 ASN 4.10 0.23 1 49 ARG -4.97 -1.77 1 51 VAL -0.88 -1.26 1 52 ALA 0.02 -3.88 1 54 ASN 2.91 -1.93 1 55 ARG -2.27 -2.36 1 57 ALA -2.49 -0.49 1 59 THR -0.50 -0.82 1 60 TYR 3.90 0.39 1 62 PHE -3.94 -0.17 1 63 THR -2.37 -1.75 1 66 GLN -1.55 -0.25 1 68 GLU 1.13 0.14 1 69 ARG -0.52 -2.48 1 70 ASP -2.53 0.20 1 71 TYR -1.54 -0.10 1 72 ARG 0.77 1.03 1 73 THR -3.79 -0.14 1 77 PHE -0.17 0.80 1 78 THR 1.77 -1.14 1 79 VAL -4.79 -2.53 1 80 ILE -1.36 -0.53 1 86 GLN 3.66 0.72 1 90 SER -1.97 0.11 1 92 ILE -1.32 -1.78 1 93 VAL -2.28 -0.85 1 94 SER -4.45 1.62 1 95 THR -1.64 1.07 1 96 LYS 5.97 1.85 1 97 THR 5.11 2.05 1 98 LEU 3.54 1.15 1 101 ALA -0.40 -0.59 1 102 THR -2.97 1.99 1 103 VAL -1.39 0.68 1 105 ARG -1.34 0.40 1 106 ALA -4.31 -3.06 1 107 TRP -5.29 -0.25 1 109 HIS -2.52 0.25 1 112 GLU -5.05 -0.44 1 113 MET 0.52 1.58 1 116 ALA 3.51 1.01 1 117 GLN -2.58 -0.77 1 119 HIS 0.11 0.85 1 122 ARG -1.13 -1.04 1 123 ARG 3.14 0.41 1 125 PHE -4.76 -2.46 1 126 ILE -3.85 -0.67 1 128 ASN -0.36 2.50 1 129 ILE 3.09 -0.33 1 130 ARG 1.78 1.96 1 131 THR -1.22 1.98 1 133 ALA -1.29 0.05 1 135 GLN -4.43 -1.55 1 136 ASP -0.84 -0.68 1 137 VAL -1.86 -2.65 1 138 ASP -0.74 -0.42 1 139 GLU 8.11 -0.60 1 141 GLN 0.10 1.22 1 142 ALA 0.05 -0.52 1 143 ILE 0.68 -2.80 1 146 LEU 0.71 0.64 1 151 ASN -3.08 -2.56 1 153 ILE -2.77 -1.41 1 154 ASN 0.96 -0.19 1 155 THR -3.40 -0.58 1 156 VAL 5.81 0.17 1 158 SER -1.59 -0.83 1 159 PHE -0.61 -3.21 1 160 GLU -5.39 -2.08 1 162 LYS -2.00 -0.02 1 165 ALA 2.18 1.54 1 167 HIS -2.54 -1.28 1 168 LYS -3.67 -1.23 1 169 LEU 0.04 -1.47 1 170 ASN -0.01 1.10 1 171 GLU 2.61 0.95 1 172 VAL 4.05 1.10 1 173 SER -1.23 0.47 1 174 GLN 5.45 -2.78 1 175 LYS -4.13 -0.26 1 stop_ save_