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 bmr16248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.83 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 5.01 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 ASP -6.07 0.96 0 103 HIS -2.56 3.09 0 10 ASN -1.83 -1.81 1 12 ASP 0.24 0.31 1 13 ILE 0.36 0.31 1 14 GLU -0.30 -0.25 1 15 LYS 0.34 0.13 1 16 ASP 0.11 0.18 1 17 GLN -0.14 -0.19 1 18 THR 0.13 -0.10 1 19 SER -0.12 -0.26 1 20 ASP -0.17 -0.38 1 21 GLU -0.55 -0.25 1 22 VAL -0.61 -0.50 1 23 THR 0.13 -0.10 1 24 VAL -0.61 -0.50 1 26 THR 1.55 0.98 1 28 SER -2.12 -0.79 1 29 VAL 1.77 1.17 1 30 PHE -2.86 -0.19 1 31 ARG 6.22 2.09 1 32 ALA 0.60 -0.27 1 33 ASP -0.79 -1.38 1 34 PHE 1.83 0.98 1 35 LEU 0.19 0.06 1 36 SER 1.40 0.97 1 37 GLU -0.90 -0.26 1 38 LEU 0.19 0.06 1 39 ASP 0.38 -0.21 1 40 ALA -0.16 -0.03 1 42 ALA 0.60 0.32 1 43 GLN 0.08 0.05 1 44 ALA 0.02 0.32 1 46 THR -0.21 -0.19 1 47 GLU -0.31 -0.26 1 48 SER 0.22 0.38 1 49 ALA 0.02 0.32 1 50 VAL 0.60 0.00 1 51 SER 1.40 0.38 1 53 VAL 0.60 0.00 1 54 GLU 1.44 0.91 1 56 LEU -0.26 -0.28 1 60 SER -3.29 -0.79 1 61 ALA -5.84 -0.85 1 62 LEU -6.83 -1.69 1 63 LEU -5.66 -2.28 1 64 VAL -4.10 -2.35 1 65 VAL 2.95 1.76 1 66 LYS -0.83 0.72 1 67 ARG -4.38 -1.28 1 70 ASN 1.04 -0.87 1 71 ALA 2.95 1.49 1 73 SER 1.98 2.14 1 74 ARG -5.17 -2.01 1 75 PHE -2.27 -0.78 1 76 LEU -1.56 -0.52 1 77 LEU -1.56 -2.28 1 78 ASP -0.20 -0.79 1 79 GLN -4.02 -2.29 1 80 ALA 4.12 3.25 1 81 ILE -1.77 0.03 1 82 THR -1.38 -0.77 1 83 SER -1.54 -0.21 1 84 ALA -5.26 -2.61 1 86 ARG -4.00 -0.84 1 87 HIS 1.49 3.62 1 89 ASP 0.39 -0.79 1 90 SER 0.22 1.55 1 91 ASP 3.90 4.48 1 92 ILE 0.56 -0.66 1 93 PHE -1.10 -1.95 1 94 LEU -1.56 -2.87 1 95 ASP -0.20 -1.38 1 97 VAL 4.12 2.93 1 98 THR 1.55 2.16 1 99 VAL -0.58 -0.59 1 100 SER 2.57 2.73 1 101 ARG 7.15 5.03 1 102 ARG -1.65 -2.01 1 104 ALA -5.85 -2.03 1 105 GLU -6.77 -2.02 1 106 PHE -2.85 -1.36 1 108 LEU -1.56 -1.11 1 109 GLU -3.25 -0.85 1 110 ASN 3.39 1.48 1 111 ASN 2.22 1.48 1 112 GLU -5.01 -2.02 1 113 PHE -1.10 0.98 1 114 ASN -5.41 -2.04 1 115 VAL -4.68 -3.52 1 116 VAL -5.27 -2.35 1 117 ASP -1.96 0.38 1 118 VAL 1.77 -1.76 1 120 SER 2.56 -0.21 1 121 LEU 3.13 2.41 1 122 ASN -0.72 0.89 1 124 THR 2.14 2.16 1 125 TYR -4.44 -2.15 1 126 VAL -1.16 -1.17 1 127 ASN 3.39 1.48 1 128 ARG 5.94 2.09 1 129 GLU -3.31 -1.38 1 131 VAL -5.85 -3.52 1 132 ASP 1.56 1.55 1 133 SER -3.29 -1.96 1 134 ALA -3.50 -0.27 1 135 VAL 1.18 0.58 1 136 LEU -1.56 -1.11 1 137 ALA -6.43 -3.20 1 138 ASN 2.22 3.24 1 140 ASP 0.38 1.55 1 141 GLU -4.42 -2.02 1 142 VAL -3.51 -1.76 1 143 GLN -1.67 -1.12 1 144 ILE -2.95 -0.66 1 146 LYS 1.52 1.31 1 147 PHE 0.66 0.98 1 148 ARG -3.41 -1.42 1 149 LEU -3.90 -1.69 1 150 VAL -3.51 -1.76 1 151 PHE -2.27 -0.78 1 152 LEU -5.66 -2.28 1 153 THR -1.97 -1.36 1 157 GLN -0.18 0.05 1 159 GLU -0.55 -0.25 1 160 ASP 0.27 -0.79 1 161 ASP -0.45 -0.38 1 163 SER 0.44 0.30 1 164 THR 0.13 -0.10 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.83 _LACS_plot.Line_1_terminator_val_y_1 4.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.51 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 -2.14 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 ASP -6.07 7.03 0 103 HIS -2.56 5.65 0 10 ASN -1.83 0.02 1 12 ASP 0.24 0.07 1 13 ILE 0.36 -0.05 1 14 GLU -0.30 0.05 1 15 LYS 0.34 -0.21 1 16 ASP 0.11 0.07 1 17 GLN -0.14 -0.05 1 18 THR 0.13 -0.23 1 19 SER -0.12 -0.14 1 20 ASP -0.17 -0.21 1 21 GLU -0.55 0.30 1 22 VAL -0.61 0.11 1 23 THR 0.13 -0.23 1 24 VAL -0.61 0.11 1 26 THR 1.55 -0.57 1 28 SER -2.12 1.33 1 29 VAL 1.77 -0.60 1 30 PHE -2.86 2.67 1 31 ARG 6.22 -4.13 1 32 ALA 0.60 -0.87 1 33 ASP -0.79 -0.59 1 34 PHE 1.83 -0.85 1 35 LEU 0.19 -0.13 1 36 SER 1.40 -0.43 1 37 GLU -0.90 0.64 1 38 LEU 0.19 -0.13 1 39 ASP 0.38 -0.59 1 40 ALA -0.16 0.13 1 42 ALA 0.60 -0.28 1 43 GLN 0.08 -0.03 1 44 ALA 0.02 0.30 1 46 THR -0.21 0.02 1 47 GLU -0.31 0.05 1 48 SER 0.22 0.16 1 49 ALA 0.02 0.30 1 50 VAL 0.60 -0.60 1 51 SER 1.40 -1.02 1 53 VAL 0.60 -0.60 1 54 GLU 1.44 -0.53 1 56 LEU -0.26 -0.02 1 60 SER -3.29 2.50 1 61 ALA -5.84 4.99 1 62 LEU -6.83 5.14 1 63 LEU -5.66 3.38 1 64 VAL -4.10 1.75 1 65 VAL 2.95 -1.19 1 66 LYS -0.83 1.55 1 67 ARG -4.38 3.10 1 70 ASN 1.04 -1.91 1 71 ALA 2.95 -1.46 1 73 SER 1.98 0.16 1 74 ARG -5.17 3.16 1 75 PHE -2.27 1.49 1 76 LEU -1.56 1.04 1 77 LEU -1.56 -0.72 1 78 ASP -0.20 -0.59 1 79 GLN -4.02 1.73 1 80 ALA 4.12 -0.87 1 81 ILE -1.77 1.80 1 82 THR -1.38 0.61 1 83 SER -1.54 1.33 1 84 ALA -5.26 2.65 1 86 ARG -4.00 3.16 1 87 HIS 1.49 2.13 1 89 ASP 0.39 -1.18 1 90 SER 0.22 1.33 1 91 ASP 3.90 0.58 1 92 ILE 0.56 -1.22 1 93 PHE -1.10 -0.85 1 94 LEU -1.56 -1.31 1 95 ASP -0.20 -1.18 1 97 VAL 4.12 -1.19 1 98 THR 1.55 0.61 1 99 VAL -0.58 -0.01 1 100 SER 2.57 0.16 1 101 ARG 7.15 -2.12 1 102 ARG -1.65 -0.36 1 104 ALA -5.85 3.82 1 105 GLU -6.77 4.75 1 106 PHE -2.85 1.49 1 108 LEU -1.56 0.45 1 109 GLU -3.25 2.40 1 110 ASN 3.39 -1.91 1 111 ASN 2.22 -0.74 1 112 GLU -5.01 2.99 1 113 PHE -1.10 2.08 1 114 ASN -5.41 3.37 1 115 VAL -4.68 1.16 1 116 VAL -5.27 2.92 1 117 ASP -1.96 2.34 1 118 VAL 1.77 -3.53 1 120 SER 2.56 -2.77 1 121 LEU 3.13 -0.72 1 122 ASN -0.72 1.61 1 124 THR 2.14 0.02 1 125 TYR -4.44 2.29 1 126 VAL -1.16 -0.01 1 127 ASN 3.39 -1.91 1 128 ARG 5.94 -3.85 1 129 GLU -3.31 1.93 1 131 VAL -5.85 2.33 1 132 ASP 1.56 -0.01 1 133 SER -3.29 1.33 1 134 ALA -3.50 3.23 1 135 VAL 1.18 -0.60 1 136 LEU -1.56 0.45 1 137 ALA -6.43 3.23 1 138 ASN 2.22 1.02 1 140 ASP 0.38 1.17 1 141 GLU -4.42 2.40 1 142 VAL -3.51 1.75 1 143 GLN -1.67 0.55 1 144 ILE -2.95 2.29 1 146 LYS 1.52 -0.21 1 147 PHE 0.66 0.32 1 148 ARG -3.41 1.99 1 149 LEU -3.90 2.21 1 150 VAL -3.51 1.75 1 151 PHE -2.27 1.49 1 152 LEU -5.66 3.38 1 153 THR -1.97 0.61 1 157 GLN -0.18 0.23 1 159 GLU -0.55 0.30 1 160 ASP 0.27 -1.06 1 161 ASP -0.45 0.07 1 163 SER 0.44 -0.14 1 164 THR 0.13 -0.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.83 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 -0.96 _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 101 ARG 7.15 -0.61 0 31 ARG 6.22 -1.35 0 128 ARG 5.94 -1.38 0 100 SER 2.57 0.71 0 10 ASN -1.83 0.17 1 12 ASP 0.24 -0.06 1 13 ILE 0.36 -0.07 1 14 GLU -0.30 -0.11 1 16 ASP 0.11 -0.11 1 17 GLN -0.14 0.04 1 18 THR 0.13 0.01 1 19 SER -0.12 -0.04 1 20 ASP -0.17 -0.05 1 21 GLU -0.55 -0.10 1 22 VAL -0.61 0.01 1 23 THR 0.13 -0.03 1 24 VAL -0.61 0.01 1 26 THR 1.55 -0.29 1 28 SER -2.12 0.06 1 29 VAL 1.77 0.07 1 30 PHE -2.86 -0.05 1 32 ALA 0.60 -0.84 1 33 ASP -0.79 -0.27 1 34 PHE 1.83 -0.20 1 35 LEU 0.19 -0.02 1 36 SER 1.40 -0.17 1 37 GLU -0.90 -0.11 1 38 LEU 0.19 -0.16 1 39 ASP 0.38 -0.09 1 40 ALA -0.16 -0.12 1 42 ALA 0.60 -0.03 1 43 GLN 0.08 -0.06 1 44 ALA 0.02 -0.06 1 46 THR -0.21 -0.03 1 47 GLU -0.31 -0.06 1 48 SER 0.22 -0.10 1 49 ALA 0.02 -0.02 1 50 VAL 0.60 -0.14 1 51 SER 1.40 -0.02 1 53 VAL 0.60 -0.03 1 54 GLU 1.44 -0.23 1 56 LEU -0.26 -0.26 1 60 SER -3.29 0.76 1 61 ALA -5.84 0.14 1 62 LEU -6.83 0.63 1 63 LEU -5.66 1.10 1 64 VAL -4.10 0.71 1 65 VAL 2.95 0.00 1 66 LYS -0.83 0.12 1 67 ARG -4.38 -0.26 1 70 ASN 1.04 -0.15 1 71 ALA 2.95 -0.67 1 73 SER 1.98 -0.24 1 74 ARG -5.17 0.79 1 75 PHE -2.27 0.80 1 76 LEU -1.56 0.15 1 77 LEU -1.56 0.46 1 78 ASP -0.20 0.17 1 79 GLN -4.02 0.31 1 80 ALA 4.12 -0.13 1 81 ILE -1.77 0.45 1 82 THR -1.38 0.59 1 83 SER -1.54 0.23 1 84 ALA -5.26 1.38 1 86 ARG -4.00 0.31 1 87 HIS 1.49 -0.65 1 89 ASP 0.39 0.03 1 90 SER 0.22 -0.41 1 91 ASP 3.90 -0.26 1 92 ILE 0.56 -0.60 1 93 PHE -1.10 0.39 1 94 LEU -1.56 -0.71 1 95 ASP -0.20 -0.51 1 96 ASP -6.07 0.18 1 97 VAL 4.12 -0.14 1 98 THR 1.55 0.12 1 99 VAL -0.58 0.14 1 102 ARG -1.65 -0.26 1 103 HIS -2.56 -0.31 1 104 ALA -5.85 1.24 1 105 GLU -6.77 0.64 1 106 PHE -2.85 0.11 1 108 LEU -1.56 0.09 1 109 GLU -3.25 0.08 1 110 ASN 3.39 -0.55 1 111 ASN 2.22 -0.75 1 112 GLU -5.01 0.30 1 113 PHE -1.10 0.34 1 114 ASN -5.41 0.82 1 115 VAL -4.68 0.76 1 116 VAL -5.27 0.46 1 117 ASP -1.96 0.18 1 118 VAL 1.77 0.42 1 120 SER 2.56 -0.59 1 121 LEU 3.13 -0.10 1 122 ASN -0.72 0.24 1 124 THR 2.14 0.45 1 125 TYR -4.44 0.79 1 126 VAL -1.16 0.82 1 127 ASN 3.39 -0.36 1 129 GLU -3.31 0.46 1 131 VAL -5.85 0.59 1 132 ASP 1.56 0.14 1 133 SER -3.29 0.96 1 134 ALA -3.50 0.27 1 135 VAL 1.18 -0.02 1 136 LEU -1.56 0.01 1 137 ALA -6.43 0.40 1 138 ASN 2.22 -0.31 1 140 ASP 0.38 0.17 1 141 GLU -4.42 0.92 1 142 VAL -3.51 1.12 1 143 GLN -1.67 1.10 1 144 ILE -2.95 -0.04 1 146 LYS 1.52 -0.67 1 147 PHE 0.66 -0.07 1 148 ARG -3.41 1.14 1 149 LEU -3.90 1.17 1 150 VAL -3.51 0.95 1 151 PHE -2.27 0.42 1 152 LEU -5.66 0.67 1 153 THR -1.97 -0.14 1 157 GLN -0.18 -0.09 1 159 GLU -0.55 -0.07 1 160 ASP 0.27 0.00 1 161 ASP -0.45 -0.10 1 163 SER 0.44 -0.04 1 164 THR 0.13 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.83 _LACS_plot.Line_1_terminator_val_y_1 -1.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 0.79 _LACS_plot.Y_axis_chem_shift_offset 0.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 ARG 6.22 -2.10 0 87 HIS 1.49 3.96 0 10 ASN -1.83 0.84 1 13 ILE 0.36 -0.15 1 14 GLU -0.30 -0.40 1 15 LYS 0.34 -0.32 1 16 ASP 0.11 -0.08 1 17 GLN -0.14 0.28 1 18 THR 0.13 -0.02 1 19 SER -0.12 0.28 1 20 ASP -0.17 -0.12 1 21 GLU -0.55 -0.22 1 22 VAL -0.61 0.02 1 23 THR 0.13 -0.39 1 24 VAL -0.61 -0.57 1 26 THR 1.55 -1.81 1 28 SER -2.12 -0.53 1 29 VAL 1.77 -0.42 1 30 PHE -2.86 -2.80 1 32 ALA 0.60 -1.28 1 33 ASP -0.79 0.30 1 34 PHE 1.83 0.73 1 35 LEU 0.19 0.51 1 36 SER 1.40 0.39 1 37 GLU -0.90 0.02 1 38 LEU 0.19 -0.37 1 39 ASP 0.38 -0.92 1 40 ALA -0.16 -0.57 1 42 ALA 0.60 0.06 1 43 GLN 0.08 -0.18 1 44 ALA 0.02 0.45 1 46 THR -0.21 0.24 1 47 GLU -0.31 0.10 1 48 SER 0.22 -0.20 1 49 ALA 0.02 -0.09 1 50 VAL 0.60 -0.26 1 51 SER 1.40 0.20 1 53 VAL 0.60 -0.36 1 54 GLU 1.44 0.41 1 56 LEU -0.26 -0.85 1 60 SER -3.29 -1.76 1 61 ALA -5.84 -4.04 1 62 LEU -6.83 -2.92 1 63 LEU -5.66 -1.34 1 64 VAL -4.10 0.24 1 65 VAL 2.95 -0.48 1 66 LYS -0.83 -0.43 1 67 ARG -4.38 -2.91 1 70 ASN 1.04 1.30 1 71 ALA 2.95 0.15 1 73 SER 1.98 -3.28 1 74 ARG -5.17 -1.54 1 75 PHE -2.27 -2.06 1 76 LEU -1.56 -1.36 1 77 LEU -1.56 -2.48 1 78 ASP -0.20 -0.76 1 79 GLN -4.02 -0.62 1 80 ALA 4.12 0.74 1 81 ILE -1.77 -1.33 1 82 THR -1.38 -0.10 1 83 SER -1.54 -1.98 1 84 ALA -5.26 -2.04 1 86 ARG -4.00 -0.64 1 89 ASP 0.39 0.99 1 90 SER 0.22 -1.30 1 91 ASP 3.90 1.15 1 92 ILE 0.56 -3.55 1 93 PHE -1.10 -1.86 1 94 LEU -1.56 -3.93 1 95 ASP -0.20 0.25 1 96 ASP -6.07 0.32 1 97 VAL 4.12 -1.61 1 98 THR 1.55 0.51 1 99 VAL -0.58 0.65 1 100 SER 2.57 0.88 1 101 ARG 7.15 0.76 1 102 ARG -1.65 -3.38 1 103 HIS -2.56 -0.55 1 104 ALA -5.85 -1.40 1 105 GLU -6.77 -2.48 1 106 PHE -2.85 0.79 1 108 LEU -1.56 -1.52 1 109 GLU -3.25 -0.75 1 110 ASN 3.39 -0.90 1 111 ASN 2.22 -2.02 1 112 GLU -5.01 -2.22 1 113 PHE -1.10 -1.24 1 114 ASN -5.41 -0.26 1 115 VAL -4.68 -4.63 1 116 VAL -5.27 -0.71 1 117 ASP -1.96 0.97 1 118 VAL 1.77 -1.97 1 120 SER 2.56 1.44 1 121 LEU 3.13 1.78 1 122 ASN -0.72 0.70 1 124 THR 2.14 -2.35 1 125 TYR -4.44 0.04 1 126 VAL -1.16 0.36 1 127 ASN 3.39 -0.73 1 128 ARG 5.94 -1.85 1 129 GLU -3.31 -1.47 1 131 VAL -5.85 -0.62 1 132 ASP 1.56 -0.09 1 133 SER -3.29 -1.16 1 134 ALA -3.50 -2.41 1 135 VAL 1.18 -0.14 1 136 LEU -1.56 -2.45 1 137 ALA -6.43 -1.26 1 138 ASN 2.22 1.28 1 140 ASP 0.38 -1.52 1 141 GLU -4.42 -0.46 1 142 VAL -3.51 -2.03 1 143 GLN -1.67 -0.97 1 144 ILE -2.95 -1.60 1 146 LYS 1.52 -0.90 1 147 PHE 0.66 -1.50 1 148 ARG -3.41 -1.38 1 149 LEU -3.90 -2.32 1 150 VAL -3.51 -2.88 1 151 PHE -2.27 -2.97 1 152 LEU -5.66 -2.35 1 153 THR -1.97 -0.35 1 157 GLN -0.18 0.29 1 159 GLU -0.55 -0.33 1 160 ASP 0.27 -0.24 1 161 ASP -0.45 0.92 1 163 SER 0.44 0.61 1 164 THR 0.13 0.52 1 stop_ save_