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 bmr18479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 -2.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 8.78 _LACS_plot.Line_2_terminator_val_y_2 6.42 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 157 TYR 4.54 0.59 0 94 HIS 3.54 5.09 0 93 ILE 5.69 1.30 0 42 LYS -5.33 -0.42 0 111 MET -5.36 -0.40 0 11 ALA -0.21 0.07 1 14 VAL 1.52 0.52 1 16 LYS 8.78 5.04 1 18 ALA 2.36 1.93 1 19 LEU 2.88 3.82 1 21 ILE 6.23 3.77 1 22 GLN 2.99 3.34 1 23 LEU 4.88 3.05 1 24 ILE 2.85 1.10 1 25 GLN -1.33 -0.39 1 26 ASN 3.32 1.41 1 27 HIS -4.08 -0.36 1 28 PHE -2.87 -2.61 1 29 VAL -1.81 -2.22 1 30 ASP 0.16 0.43 1 31 GLU -1.70 -0.98 1 32 TYR -0.15 0.88 1 33 ASP -0.28 0.35 1 35 THR 0.03 0.33 1 37 GLU -4.75 -2.04 1 38 ASP -4.09 -1.67 1 39 SER -4.44 -2.43 1 40 TYR -5.34 -1.02 1 41 ARG -4.86 -1.73 1 44 VAL -5.85 -2.73 1 45 VAL 0.21 -0.41 1 46 ILE -1.99 -0.88 1 47 ASP 3.15 1.09 1 49 GLU -3.85 -1.93 1 50 THR 3.27 1.92 1 52 LEU -3.53 -1.58 1 53 LEU -1.18 -1.52 1 54 ASP -2.07 -1.19 1 57 ASP -1.49 -1.06 1 58 THR -2.05 -0.11 1 59 ALA -2.52 -0.88 1 61 GLN 0.58 0.45 1 62 GLU 1.66 1.23 1 63 GLU -0.12 0.05 1 64 TYR 0.74 0.34 1 65 SER -1.29 -1.25 1 66 ALA 3.23 2.26 1 67 MET 2.79 2.42 1 68 ARG 4.24 3.15 1 69 ASP 2.39 3.52 1 70 GLN 5.45 3.79 1 72 MET 4.80 3.09 1 73 ARG 4.01 3.66 1 74 THR 0.49 0.56 1 76 GLU -2.23 0.16 1 78 PHE -4.43 -0.98 1 81 VAL -1.29 -0.89 1 82 PHE -3.14 -2.29 1 83 ALA -5.39 -2.79 1 84 ILE 3.20 2.49 1 85 ASN 0.03 -0.88 1 87 THR 6.24 5.03 1 88 LYS 5.14 3.31 1 89 SER 3.69 3.49 1 90 PHE 1.68 2.22 1 91 GLU 3.41 2.57 1 92 ASP 1.86 1.93 1 95 GLN 4.15 2.63 1 96 TYR 6.12 4.97 1 97 ARG 6.01 4.02 1 98 GLU 3.15 2.32 1 99 GLN 4.86 3.44 1 100 ILE 3.31 2.37 1 101 LYS 4.39 3.46 1 102 ARG 4.04 2.82 1 103 VAL 4.31 3.16 1 104 LYS 0.87 -1.15 1 105 ASP 1.72 0.36 1 106 SER -2.66 -1.42 1 107 ASP -0.19 0.18 1 108 ASP -1.05 -1.17 1 109 VAL -2.82 -0.68 1 112 VAL -6.08 -1.75 1 113 LEU -2.62 -1.27 1 114 VAL -4.26 -2.10 1 116 ASN -3.71 -1.58 1 117 LYS 4.33 1.08 1 119 ASP -0.05 0.09 1 120 LEU 0.11 -0.34 1 121 ALA 0.48 0.51 1 122 ALA 0.12 -1.28 1 123 ARG -2.22 -0.36 1 124 THR 0.74 -0.03 1 125 VAL -0.98 -0.79 1 126 GLU -0.52 -0.37 1 127 SER 5.67 4.50 1 128 ARG 4.03 2.80 1 129 GLN -3.02 -3.61 1 130 ALA 2.99 2.39 1 131 GLN 4.07 3.22 1 132 ASP 4.45 3.08 1 133 LEU 3.70 2.78 1 134 ALA 4.46 3.46 1 135 ARG 4.79 3.50 1 136 SER 4.48 3.17 1 137 TYR -2.99 -3.16 1 139 ILE 0.04 -0.12 1 141 TYR -5.25 -2.95 1 142 ILE -5.02 -1.63 1 143 GLU -0.52 -0.84 1 144 THR -5.86 -2.23 1 145 SER -1.48 -1.02 1 146 ALA 2.72 2.16 1 147 LYS 1.29 2.05 1 148 THR -0.04 -0.24 1 149 ARG 4.18 3.75 1 150 GLN 2.78 1.82 1 152 VAL 7.71 6.15 1 153 GLU 4.99 3.78 1 154 ASP 4.44 3.18 1 155 ALA 5.38 3.79 1 156 PHE 5.24 5.22 1 159 LEU 5.16 2.93 1 160 VAL 7.33 5.15 1 161 ARG 6.43 4.95 1 162 GLU 1.69 2.24 1 163 ILE 5.36 4.76 1 164 ARG 2.74 2.98 1 165 GLN 0.41 0.32 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 3.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 8.78 _LACS_plot.Line_2_terminator_val_y_2 -2.36 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 157 TYR 4.54 -3.95 0 94 HIS 3.54 1.55 0 93 ILE 5.69 -4.39 0 42 LYS -5.33 4.91 0 111 MET -5.36 4.96 0 11 ALA -0.21 0.28 1 14 VAL 1.52 -1.00 1 16 LYS 8.78 -3.74 1 18 ALA 2.36 -0.43 1 19 LEU 2.88 0.94 1 21 ILE 6.23 -2.46 1 22 GLN 2.99 0.35 1 23 LEU 4.88 -1.83 1 24 ILE 2.85 -1.75 1 25 GLN -1.33 0.94 1 26 ASN 3.32 -1.91 1 27 HIS -4.08 3.72 1 28 PHE -2.87 0.26 1 29 VAL -1.81 -0.41 1 30 ASP 0.16 0.27 1 31 GLU -1.70 0.72 1 32 TYR -0.15 1.03 1 33 ASP -0.28 0.63 1 35 THR 0.03 0.30 1 37 GLU -4.75 2.71 1 38 ASP -4.09 2.42 1 39 SER -4.44 2.01 1 40 TYR -5.34 4.32 1 41 ARG -4.86 3.13 1 44 VAL -5.85 3.12 1 45 VAL 0.21 -0.62 1 46 ILE -1.99 1.11 1 47 ASP 3.15 -2.06 1 49 GLU -3.85 1.92 1 50 THR 3.27 -1.35 1 52 LEU -3.53 1.95 1 53 LEU -1.18 -0.34 1 54 ASP -2.07 0.88 1 57 ASP -1.49 0.43 1 58 THR -2.05 1.94 1 59 ALA -2.52 1.64 1 61 GLN 0.58 -0.13 1 62 GLU 1.66 -0.43 1 63 GLU -0.12 0.17 1 64 TYR 0.74 -0.40 1 65 SER -1.29 0.04 1 66 ALA 3.23 -0.97 1 67 MET 2.79 -0.37 1 68 ARG 4.24 -1.09 1 69 ASP 2.39 1.13 1 70 GLN 5.45 -1.66 1 72 MET 4.80 -1.71 1 73 ARG 4.01 -0.35 1 74 THR 0.49 0.07 1 76 GLU -2.23 2.39 1 78 PHE -4.43 3.45 1 81 VAL -1.29 0.40 1 82 PHE -3.14 0.85 1 83 ALA -5.39 2.60 1 84 ILE 3.20 -0.71 1 85 ASN 0.03 -0.91 1 87 THR 6.24 -1.21 1 88 LYS 5.14 -1.83 1 89 SER 3.69 -0.20 1 90 PHE 1.68 0.54 1 91 GLU 3.41 -0.84 1 92 ASP 1.86 0.07 1 95 GLN 4.15 -1.52 1 96 TYR 6.12 -1.15 1 97 ARG 6.01 -1.99 1 98 GLU 3.15 -0.83 1 99 GLN 4.86 -1.42 1 100 ILE 3.31 -0.94 1 101 LYS 4.39 -0.93 1 102 ARG 4.04 -1.22 1 103 VAL 4.31 -1.15 1 104 LYS 0.87 -2.02 1 105 ASP 1.72 -1.36 1 106 SER -2.66 1.24 1 107 ASP -0.19 0.37 1 108 ASP -1.05 -0.12 1 109 VAL -2.82 2.14 1 112 VAL -6.08 4.33 1 113 LEU -2.62 1.35 1 114 VAL -4.26 2.16 1 116 ASN -3.71 2.13 1 117 LYS 4.33 -3.25 1 119 ASP -0.05 0.14 1 120 LEU 0.11 -0.45 1 121 ALA 0.48 0.03 1 122 ALA 0.12 -1.40 1 123 ARG -2.22 1.86 1 124 THR 0.74 -0.77 1 125 VAL -0.98 0.19 1 126 GLU -0.52 0.15 1 127 SER 5.67 -1.17 1 128 ARG 4.03 -1.23 1 129 GLN -3.02 -0.59 1 130 ALA 2.99 -0.60 1 131 GLN 4.07 -0.85 1 132 ASP 4.45 -1.37 1 133 LEU 3.70 -0.92 1 134 ALA 4.46 -1.00 1 135 ARG 4.79 -1.29 1 136 SER 4.48 -1.31 1 137 TYR -2.99 -0.17 1 139 ILE 0.04 -0.16 1 141 TYR -5.25 2.30 1 142 ILE -5.02 3.39 1 143 GLU -0.52 -0.32 1 144 THR -5.86 3.63 1 145 SER -1.48 0.46 1 146 ALA 2.72 -0.56 1 147 LYS 1.29 0.76 1 148 THR -0.04 -0.20 1 149 ARG 4.18 -0.43 1 150 GLN 2.78 -0.96 1 152 VAL 7.71 -1.56 1 153 GLU 4.99 -1.21 1 154 ASP 4.44 -1.26 1 155 ALA 5.38 -1.59 1 156 PHE 5.24 -0.02 1 159 LEU 5.16 -2.23 1 160 VAL 7.33 -2.18 1 161 ARG 6.43 -1.48 1 162 GLU 1.69 0.55 1 163 ILE 5.36 -0.60 1 164 ARG 2.74 0.24 1 165 GLN 0.41 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18479_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 -2.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _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 2.98 _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 83 ALA -5.39 1.48 0 129 GLN -3.02 2.98 0 144 THR -5.86 1.42 0 11 ALA -0.21 -0.44 1 14 VAL 1.52 -1.94 1 16 LYS 8.78 3.05 1 18 ALA 2.36 4.23 1 19 LEU 2.88 -0.01 1 21 ILE 6.23 2.51 1 22 GLN 2.99 3.25 1 23 LEU 4.88 0.59 1 24 ILE 2.85 1.15 1 25 GLN -1.33 0.22 1 26 ASN 3.32 -1.23 1 27 HIS -4.08 -1.48 1 28 PHE -2.87 -1.28 1 29 VAL -1.81 -2.88 1 30 ASP 0.16 -0.15 1 31 GLU -1.70 -2.33 1 32 TYR -0.15 -0.69 1 35 THR 0.03 -0.05 1 37 GLU -4.75 -2.44 1 38 ASP -4.09 -3.04 1 39 SER -4.44 -1.19 1 40 TYR -5.34 -1.66 1 41 ARG -4.86 0.13 1 42 LYS -5.33 -2.86 1 44 VAL -5.85 -3.16 1 45 VAL 0.21 -0.90 1 46 ILE -1.99 -0.06 1 47 ASP 3.15 -0.09 1 49 GLU -3.85 -0.98 1 50 THR 3.27 -1.22 1 52 LEU -3.53 -2.63 1 53 LEU -1.18 -3.36 1 54 ASP -2.07 -1.38 1 57 ASP -1.49 -0.86 1 58 THR -2.05 -1.08 1 59 ALA -2.52 0.26 1 61 GLN 0.58 0.35 1 62 GLU 1.66 0.19 1 63 GLU -0.12 -0.72 1 64 TYR 0.74 -0.26 1 65 SER -1.29 -0.24 1 66 ALA 3.23 2.31 1 67 MET 2.79 1.22 1 68 ARG 4.24 1.60 1 69 ASP 2.39 1.65 1 72 MET 4.80 0.64 1 73 ARG 4.01 2.69 1 74 THR 0.49 0.79 1 76 GLU -2.23 -0.20 1 78 PHE -4.43 -2.14 1 81 VAL -1.29 -1.36 1 82 PHE -3.14 -4.71 1 84 ILE 3.20 -2.22 1 85 ASN 0.03 -0.63 1 87 THR 6.24 1.26 1 88 LYS 5.14 1.39 1 89 SER 3.69 1.15 1 90 PHE 1.68 1.47 1 91 GLU 3.41 3.02 1 92 ASP 1.86 1.19 1 93 ILE 5.69 0.90 1 94 HIS 3.54 3.26 1 95 GLN 4.15 3.12 1 96 TYR 6.12 1.88 1 97 ARG 6.01 1.46 1 98 GLU 3.15 2.26 1 99 GLN 4.86 1.87 1 100 ILE 3.31 0.69 1 101 LYS 4.39 2.85 1 102 ARG 4.04 3.06 1 103 VAL 4.31 1.45 1 104 LYS 0.87 -0.60 1 105 ASP 1.72 -1.79 1 106 SER -2.66 -1.64 1 107 ASP -0.19 -0.29 1 108 ASP -1.05 -1.91 1 109 VAL -2.82 -0.93 1 111 MET -5.36 -2.45 1 112 VAL -6.08 -2.20 1 113 LEU -2.62 -4.19 1 114 VAL -4.26 -2.66 1 116 ASN -3.71 -0.51 1 117 LYS 4.33 0.70 1 119 ASP -0.05 -0.83 1 120 LEU 0.11 -1.22 1 121 ALA 0.48 0.80 1 122 ALA 0.12 -2.58 1 123 ARG -2.22 -0.18 1 124 THR 0.74 -0.62 1 125 VAL -0.98 -0.59 1 126 GLU -0.52 1.36 1 127 SER 5.67 1.98 1 128 ARG 4.03 1.39 1 130 ALA 2.99 0.32 1 131 GLN 4.07 3.37 1 132 ASP 4.45 2.56 1 133 LEU 3.70 1.33 1 134 ALA 4.46 2.05 1 135 ARG 4.79 3.69 1 136 SER 4.48 1.49 1 137 TYR -2.99 0.32 1 139 ILE 0.04 -2.19 1 141 TYR -5.25 -1.42 1 142 ILE -5.02 -3.56 1 143 GLU -0.52 -0.55 1 145 SER -1.48 1.10 1 146 ALA 2.72 -2.07 1 147 LYS 1.29 0.45 1 148 THR -0.04 1.23 1 149 ARG 4.18 -0.80 1 150 GLN 2.78 0.96 1 152 VAL 7.71 0.70 1 153 GLU 4.99 0.57 1 154 ASP 4.44 3.00 1 155 ALA 5.38 -0.20 1 156 PHE 5.24 2.15 1 157 TYR 4.54 3.14 1 159 LEU 5.16 -0.17 1 160 VAL 7.33 1.14 1 161 ARG 6.43 2.70 1 162 GLU 1.69 3.11 1 163 ILE 5.36 2.44 1 164 ARG 2.74 1.20 1 165 GLN 0.41 -0.87 1 stop_ save_