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 bmr27099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.79 _LACS_plot.Line_1_terminator_val_y_1 -3.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.77 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 4.87 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 TYR 1.59 -4.18 0 11 GLN 3.69 2.14 1 12 ASP 0.70 0.75 1 13 VAL 1.59 -0.73 1 14 LYS -2.75 -1.61 1 15 TYR 0.78 -0.79 1 16 LEU -4.41 -3.14 1 17 PHE -6.26 -1.43 1 18 GLN -4.55 0.66 1 19 SER -0.30 -0.91 1 21 ASP 0.09 -0.42 1 22 ALA 1.39 0.12 1 23 ALA -0.62 -0.92 1 24 THR 3.52 1.45 1 26 SER 2.01 1.56 1 27 ALA 0.45 -0.52 1 29 LEU -3.30 -2.14 1 30 PHE -5.11 -4.97 1 32 ALA -1.45 -0.38 1 34 GLN 2.22 1.81 1 38 SER -2.40 -0.52 1 39 VAL -3.67 -0.80 1 40 SER -1.70 -1.39 1 42 GLU -4.66 -1.84 1 47 ASP -1.33 -1.68 1 48 GLU -7.35 -3.65 1 49 GLN 0.11 -0.28 1 51 LYS 5.63 2.67 1 52 ASN 0.21 1.28 1 54 ARG 0.37 0.35 1 55 ILE -0.71 -1.29 1 56 LEU -2.47 -2.54 1 63 ASP -3.17 -0.57 1 64 SER -3.18 -1.25 1 66 GLU -5.26 -1.65 1 67 VAL -3.41 -1.04 1 68 THR -2.12 -0.71 1 69 TYR -5.43 -4.74 1 70 TYR -2.03 -3.81 1 72 LYS -2.30 -0.72 1 73 ARG 4.50 1.99 1 75 ASP -1.68 1.13 1 76 ALA 3.92 2.87 1 78 GLN 7.72 4.15 1 79 LYS 4.87 2.98 1 80 ALA 3.97 2.23 1 81 ILE 5.74 4.14 1 82 GLU 3.60 1.91 1 83 ASP 2.30 2.86 1 84 ALA 4.96 2.99 1 85 TYR 5.73 3.86 1 86 GLN 4.15 2.96 1 87 ASN -0.30 0.21 1 89 LYS -3.74 -1.99 1 90 GLN -0.64 -0.41 1 91 ILE -4.37 -0.69 1 92 LYS 0.14 -0.65 1 93 PHE -6.14 -2.87 1 94 TRP -6.33 -1.74 1 95 ARG -0.86 -1.18 1 96 VAL -2.94 -1.60 1 97 ASP -0.05 -1.19 1 99 VAL 3.28 0.31 1 100 LYS 1.99 1.43 1 101 ASN -1.66 -2.13 1 102 GLU 3.24 1.74 1 103 ASN -0.48 -1.10 1 104 ASP 3.61 1.53 1 105 LYS -4.43 -1.82 1 106 TYR -1.62 -2.16 1 107 ASP 2.21 2.26 1 108 ALA -6.83 -1.82 1 109 GLN -1.78 -0.21 1 110 PHE -8.79 -2.87 1 112 PHE -2.22 -0.77 1 113 ALA -6.65 -1.97 1 114 TYR -2.72 0.09 1 116 GLU -0.69 0.17 1 117 SER -2.30 -1.19 1 118 ARG 3.23 -0.51 1 119 GLU -5.91 -2.41 1 120 TYR -1.59 -0.66 1 121 SER -0.65 -1.23 1 122 ASP -2.05 -1.45 1 124 VAL 3.53 1.83 1 125 GLU 0.96 0.27 1 127 ALA -0.57 -0.87 1 128 VAL 1.25 1.38 1 129 GLU -3.87 -1.96 1 130 ILE 0.37 -1.17 1 131 SER -3.28 -2.42 1 132 ILE -5.09 -3.19 1 133 SER -1.91 -1.94 1 134 LEU -3.16 -1.67 1 135 GLN -1.30 -1.47 1 136 VAL 2.45 0.77 1 137 ILE 1.21 0.35 1 139 GLU -3.60 -2.04 1 140 LEU -0.12 -0.19 1 141 LYS -4.80 -3.98 1 142 ASN -1.63 -0.28 1 144 GLU -6.46 -3.10 1 145 ILE -0.72 -0.86 1 146 ASP 3.97 3.77 1 147 THR -1.81 -1.39 1 148 LEU -5.69 -2.04 1 150 GLU 3.72 2.76 1 151 GLU 3.87 1.81 1 152 ILE 2.92 1.73 1 153 VAL 2.32 0.94 1 155 VAL -3.45 -0.58 1 156 SER -1.13 -0.96 1 160 TYR -4.31 -3.04 1 161 ASP -5.63 -2.30 1 162 PHE 5.35 4.50 1 164 GLN 0.93 -0.84 1 167 GLN 2.31 3.13 1 169 THR -2.17 -1.56 1 171 GLU 0.14 -0.20 1 172 ALA 3.04 0.50 1 175 THR -2.29 -1.23 1 176 VAL -1.98 -2.96 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.79 _LACS_plot.Line_1_terminator_val_y_1 5.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.93 _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 7.72 _LACS_plot.Line_2_terminator_val_y_2 -2.85 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 TYR 1.59 -5.77 0 11 GLN 3.69 -1.55 1 12 ASP 0.70 0.05 1 13 VAL 1.59 -2.32 1 14 LYS -2.75 1.14 1 15 TYR 0.78 -1.57 1 16 LEU -4.41 1.27 1 17 PHE -6.26 4.83 1 18 GLN -4.55 5.21 1 19 SER -0.30 -0.61 1 21 ASP 0.09 -0.51 1 22 ALA 1.39 -1.27 1 23 ALA -0.62 -0.30 1 24 THR 3.52 -2.07 1 26 SER 2.01 -0.45 1 27 ALA 0.45 -0.97 1 29 LEU -3.30 1.16 1 30 PHE -5.11 0.14 1 32 ALA -1.45 1.07 1 34 GLN 2.22 -0.41 1 38 SER -2.40 1.88 1 39 VAL -3.67 2.87 1 40 SER -1.70 0.31 1 42 GLU -4.66 2.82 1 47 ASP -1.33 -0.35 1 48 GLU -7.35 3.70 1 49 GLN 0.11 -0.39 1 51 LYS 5.63 -2.96 1 52 ASN 0.21 1.07 1 54 ARG 0.37 -0.02 1 55 ILE -0.71 -0.58 1 56 LEU -2.47 -0.07 1 63 ASP -3.17 2.60 1 64 SER -3.18 1.93 1 66 GLU -5.26 3.61 1 67 VAL -3.41 2.37 1 68 THR -2.12 1.41 1 69 TYR -5.43 0.69 1 70 TYR -2.03 -1.78 1 72 LYS -2.30 1.58 1 73 ARG 4.50 -2.51 1 75 ASP -1.68 2.81 1 76 ALA 3.92 -1.05 1 78 GLN 7.72 -3.57 1 79 LYS 4.87 -1.89 1 80 ALA 3.97 -1.74 1 81 ILE 5.74 -1.60 1 82 GLU 3.60 -1.69 1 83 ASP 2.30 0.56 1 84 ALA 4.96 -1.97 1 85 TYR 5.73 -1.87 1 86 GLN 4.15 -1.19 1 87 ASN -0.30 0.51 1 89 LYS -3.74 1.75 1 90 GLN -0.64 0.23 1 91 ILE -4.37 3.68 1 92 LYS 0.14 -0.79 1 93 PHE -6.14 3.27 1 94 TRP -6.33 4.59 1 95 ARG -0.86 -0.32 1 96 VAL -2.94 1.34 1 97 ASP -0.05 -1.14 1 99 VAL 3.28 -2.97 1 100 LYS 1.99 -0.56 1 101 ASN -1.66 -0.47 1 102 GLU 3.24 -1.50 1 103 ASN -0.48 -0.62 1 104 ASP 3.61 -2.08 1 105 LYS -4.43 2.61 1 106 TYR -1.62 -0.54 1 107 ASP 2.21 0.05 1 108 ALA -6.83 5.01 1 109 GLN -1.78 1.57 1 110 PHE -8.79 5.92 1 112 PHE -2.22 1.45 1 113 ALA -6.65 4.68 1 114 TYR -2.72 2.81 1 116 GLU -0.69 0.86 1 117 SER -2.30 1.11 1 118 ARG 3.23 -3.74 1 119 GLU -5.91 3.50 1 120 TYR -1.59 0.93 1 121 SER -0.65 -0.58 1 122 ASP -2.05 0.60 1 124 VAL 3.53 -1.70 1 125 GLU 0.96 -0.69 1 127 ALA -0.57 -0.30 1 128 VAL 1.25 0.13 1 129 GLU -3.87 1.91 1 130 ILE 0.37 -1.54 1 131 SER -3.28 0.86 1 132 ILE -5.09 1.90 1 133 SER -1.91 -0.03 1 134 LEU -3.16 1.49 1 135 GLN -1.30 -0.17 1 136 VAL 2.45 -1.68 1 137 ILE 1.21 -0.86 1 139 GLU -3.60 1.56 1 140 LEU -0.12 -0.07 1 141 LYS -4.80 0.82 1 142 ASN -1.63 1.35 1 144 GLU -6.46 3.36 1 145 ILE -0.72 -0.14 1 146 ASP 3.97 -0.20 1 147 THR -1.81 0.42 1 148 LEU -5.69 3.65 1 150 GLU 3.72 -0.96 1 151 GLU 3.87 -2.06 1 152 ILE 2.92 -1.19 1 153 VAL 2.32 -1.38 1 155 VAL -3.45 2.87 1 156 SER -1.13 0.17 1 160 TYR -4.31 1.27 1 161 ASP -5.63 3.33 1 162 PHE 5.35 -0.85 1 164 GLN 0.93 -1.77 1 167 GLN 2.31 0.82 1 169 THR -2.17 0.61 1 171 GLU 0.14 -0.34 1 172 ALA 3.04 -2.54 1 175 THR -2.29 1.06 1 176 VAL -1.98 -0.98 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.79 _LACS_plot.Line_1_terminator_val_y_1 -2.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.99 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 1.86 _LACS_plot.Y_axis_chem_shift_offset 0.41 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 PHE -6.14 -5.10 0 51 LYS 5.63 -1.61 0 101 ASN -1.66 3.19 0 78 GLN 7.72 3.92 0 19 SER -0.30 3.80 0 11 GLN 3.69 -0.75 1 12 ASP 0.70 0.36 1 13 VAL 1.59 -1.77 1 14 LYS -2.75 -2.45 1 15 TYR 0.78 -0.66 1 16 LEU -4.41 -1.76 1 17 PHE -6.26 -0.70 1 18 GLN -4.55 -2.46 1 21 ASP 0.09 0.47 1 22 ALA 1.39 0.84 1 23 ALA -0.62 2.23 1 24 THR 3.52 1.41 1 26 SER 2.01 -1.18 1 27 ALA 0.45 0.00 1 29 LEU -3.30 -1.05 1 30 PHE -5.11 -1.68 1 32 ALA -1.45 -3.22 1 33 TYR 1.59 0.41 1 34 GLN 2.22 2.15 1 38 SER -2.40 -0.65 1 39 VAL -3.67 -1.67 1 40 SER -1.70 -1.99 1 42 GLU -4.66 -1.26 1 47 ASP -1.33 -0.78 1 48 GLU -7.35 -0.78 1 49 GLN 0.11 -0.35 1 52 ASN 0.21 -1.20 1 54 ARG 0.37 -0.11 1 55 ILE -0.71 -3.32 1 56 LEU -2.47 -0.27 1 63 ASP -3.17 -0.36 1 64 SER -3.18 -2.16 1 66 GLU -5.26 -2.09 1 67 VAL -3.41 -2.83 1 68 THR -2.12 -1.63 1 69 TYR -5.43 -0.06 1 70 TYR -2.03 1.96 1 72 LYS -2.30 -0.67 1 73 ARG 4.50 1.99 1 75 ASP -1.68 0.47 1 76 ALA 3.92 3.12 1 79 LYS 4.87 1.63 1 80 ALA 3.97 3.51 1 81 ILE 5.74 0.24 1 82 GLU 3.60 1.95 1 83 ASP 2.30 2.20 1 84 ALA 4.96 2.32 1 85 TYR 5.73 3.53 1 86 GLN 4.15 1.64 1 87 ASN -0.30 -0.11 1 89 LYS -3.74 0.06 1 90 GLN -0.64 -1.60 1 91 ILE -4.37 -3.90 1 92 LYS 0.14 -1.17 1 94 TRP -6.33 -1.42 1 95 ARG -0.86 -0.70 1 96 VAL -2.94 -2.92 1 97 ASP -0.05 0.66 1 99 VAL 3.28 -0.79 1 100 LYS 1.99 0.26 1 102 GLU 3.24 0.18 1 103 ASN -0.48 -0.74 1 104 ASP 3.61 -2.39 1 105 LYS -4.43 -3.67 1 106 TYR -1.62 0.81 1 107 ASP 2.21 -0.25 1 108 ALA -6.83 -1.71 1 109 GLN -1.78 -1.09 1 110 PHE -8.79 -2.02 1 112 PHE -2.22 -0.03 1 113 ALA -6.65 -1.94 1 114 TYR -2.72 -0.09 1 116 GLU -0.69 -1.97 1 117 SER -2.30 -2.85 1 118 ARG 3.23 -1.04 1 119 GLU -5.91 -2.32 1 120 TYR -1.59 -0.58 1 121 SER -0.65 -0.82 1 122 ASP -2.05 0.80 1 124 VAL 3.53 -0.43 1 125 GLU 0.96 0.13 1 127 ALA -0.57 0.88 1 128 VAL 1.25 0.39 1 129 GLU -3.87 -1.11 1 130 ILE 0.37 -2.22 1 131 SER -3.28 0.21 1 132 ILE -5.09 -1.34 1 133 SER -1.91 -0.80 1 134 LEU -3.16 -1.63 1 135 GLN -1.30 -1.38 1 136 VAL 2.45 -0.38 1 137 ILE 1.21 -0.35 1 139 GLU -3.60 -2.23 1 140 LEU -0.12 0.89 1 141 LYS -4.80 0.15 1 142 ASN -1.63 0.24 1 144 GLU -6.46 -0.65 1 145 ILE -0.72 0.20 1 146 ASP 3.97 0.04 1 147 THR -1.81 -3.77 1 148 LEU -5.69 -1.95 1 150 GLU 3.72 1.07 1 151 GLU 3.87 0.48 1 152 ILE 2.92 -0.92 1 153 VAL 2.32 -0.67 1 155 VAL -3.45 -1.70 1 156 SER -1.13 -2.18 1 160 TYR -4.31 -4.78 1 161 ASP -5.63 -1.56 1 162 PHE 5.35 -1.07 1 164 GLN 0.93 1.07 1 167 GLN 2.31 0.01 1 169 THR -2.17 -0.66 1 171 GLU 0.14 -1.24 1 172 ALA 3.04 0.08 1 175 THR -2.29 -1.50 1 176 VAL -1.98 -1.98 1 stop_ save_