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 bmr18473_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 -2.32 _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 -1.43 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 5.87 _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 61 PHE -0.12 -3.35 0 11 ASN 1.46 0.90 1 12 PHE 2.04 1.78 1 13 GLN -3.01 -2.87 1 14 GLN 4.10 4.44 1 15 ASP 3.88 2.19 1 16 LYS 2.14 0.13 1 17 PHE -2.77 -0.25 1 18 LEU -0.57 -0.52 1 20 ARG 1.25 0.84 1 21 TRP -6.63 -2.09 1 22 TYR -1.63 -0.54 1 23 SER 0.32 -0.36 1 24 ALA -3.48 -0.30 1 26 LEU -7.34 -0.74 1 27 ALA -7.01 -1.78 1 28 SER -3.23 -2.39 1 29 ASN -0.26 -1.38 1 30 SER -1.82 -0.40 1 33 PHE 3.62 3.38 1 34 ARG 4.96 4.04 1 35 GLU 1.33 1.52 1 36 LYS -0.46 -0.94 1 37 LYS 5.37 3.86 1 38 ALA 0.84 0.89 1 39 VAL -0.87 -2.22 1 40 LEU -0.79 -0.17 1 41 TYR -4.65 -1.51 1 42 MET 0.33 2.08 1 44 LYS -1.18 -0.31 1 45 THR -2.14 0.32 1 46 VAL -0.83 -0.63 1 47 VAL 0.05 -0.34 1 48 ALA -3.97 -0.83 1 50 SER -4.41 -2.87 1 51 THR 3.78 2.75 1 52 GLU 0.42 -0.08 1 55 LEU -7.02 -1.81 1 56 ASN -2.83 -0.80 1 57 LEU -1.33 -0.75 1 58 THR 0.69 0.32 1 59 SER -1.97 -0.56 1 60 THR -1.30 -0.18 1 64 LYS 4.06 1.75 1 65 ASN 1.76 1.22 1 66 GLN -2.48 -0.84 1 67 ALA -1.08 -0.54 1 68 GLU -4.13 -1.34 1 69 THR -0.88 -0.23 1 70 LYS -4.42 -1.60 1 71 ILE -2.13 -0.58 1 72 MET -4.92 -1.03 1 73 VAL -0.92 -0.20 1 74 LEU -2.27 -2.20 1 75 GLN -1.06 -0.56 1 77 ALA -2.32 -1.31 1 79 ALA -0.70 -0.18 1 82 HIS -3.01 -0.15 1 83 TYR -6.75 -1.02 1 84 THR -4.32 -1.66 1 85 TYR -4.13 -1.50 1 86 SER -1.58 -2.21 1 87 SER -0.96 -1.05 1 90 SER -2.11 -0.36 1 92 SER -0.75 0.22 1 93 ILE -0.03 -1.02 1 94 HIS -6.86 -2.19 1 95 SER -2.34 -1.32 1 96 VAL -3.96 -1.69 1 97 SER -3.90 -1.99 1 98 VAL 3.71 0.13 1 99 VAL 3.33 3.02 1 100 GLU -6.00 -1.74 1 101 ALA -2.79 -0.26 1 103 TYR -3.93 -1.74 1 104 ASP -1.78 0.29 1 105 GLU -3.35 -0.97 1 107 ALA -4.50 -0.86 1 108 LEU -3.31 -1.29 1 109 LEU -2.88 -0.77 1 110 PHE -5.19 -1.47 1 111 SER -4.52 -2.38 1 112 ARG -5.89 -2.63 1 114 THR -1.75 -0.68 1 115 LYS -0.78 0.21 1 119 GLN 2.30 2.03 1 120 ASP 0.33 0.12 1 121 PHE 1.26 1.51 1 122 ARG -5.43 -1.65 1 123 MET -5.50 -0.30 1 124 ALA -5.96 -2.31 1 125 THR -0.79 0.87 1 126 LEU -2.52 -2.27 1 127 TYR -4.84 -3.55 1 128 SER -5.12 -2.95 1 129 ARG 1.07 1.18 1 130 THR -3.69 -2.25 1 131 GLN 2.10 1.68 1 132 THR -1.26 -1.18 1 133 LEU -3.94 -1.80 1 134 LYS -0.82 -0.30 1 135 ASP 5.38 4.27 1 136 GLU 3.81 2.92 1 137 LEU 1.79 1.24 1 138 LYS 5.86 4.33 1 139 GLU 3.52 2.78 1 140 LYS 4.34 3.32 1 141 PHE 3.65 3.89 1 143 THR 6.15 4.98 1 144 PHE 3.65 3.82 1 145 SER 7.61 5.84 1 146 LYS 3.57 2.54 1 147 ALA 3.77 1.74 1 148 GLN 0.01 -2.50 1 150 LEU 0.23 -1.44 1 151 THR -3.28 -1.15 1 152 GLU 4.46 3.93 1 153 GLU 2.38 1.99 1 154 ASP -1.61 0.16 1 155 ILE -1.05 0.59 1 156 VAL -4.90 -1.59 1 157 PHE 2.10 0.78 1 158 LEU 0.38 0.06 1 160 GLN 1.76 2.25 1 162 ASP 0.39 0.70 1 163 LYS 0.28 0.23 1 164 ALA 0.17 0.22 1 165 ILE 0.04 -0.01 1 166 GLN -0.41 0.13 1 167 GLU -0.29 1.31 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18473_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 5.02 _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 0.57 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 -1.74 _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 61 PHE -0.12 -3.23 0 11 ASN 1.46 -0.56 1 12 PHE 2.04 -0.26 1 13 GLN -3.01 0.14 1 14 GLN 4.10 0.34 1 15 ASP 3.88 -1.69 1 16 LYS 2.14 -2.01 1 17 PHE -2.77 2.52 1 18 LEU -0.57 0.05 1 20 ARG 1.25 -0.41 1 21 TRP -6.63 4.54 1 22 TYR -1.63 1.09 1 23 SER 0.32 -0.68 1 24 ALA -3.48 3.18 1 26 LEU -7.34 6.60 1 27 ALA -7.01 5.23 1 28 SER -3.23 0.84 1 29 ASN -0.26 -1.12 1 30 SER -1.82 1.42 1 33 PHE 3.62 -0.24 1 34 ARG 4.96 -0.92 1 35 GLU 1.33 0.19 1 36 LYS -0.46 -0.48 1 37 LYS 5.37 -1.51 1 38 ALA 0.84 0.05 1 39 VAL -0.87 -1.35 1 40 LEU -0.79 0.62 1 41 TYR -4.65 3.14 1 42 MET 0.33 1.75 1 44 LYS -1.18 0.87 1 45 THR -2.14 2.46 1 46 VAL -0.83 0.20 1 47 VAL 0.05 -0.39 1 48 ALA -3.97 3.14 1 50 SER -4.41 1.54 1 51 THR 3.78 -1.03 1 52 GLU 0.42 -0.50 1 55 LEU -7.02 5.21 1 56 ASN -2.83 2.03 1 57 LEU -1.33 0.58 1 58 THR 0.69 -0.37 1 59 SER -1.97 1.41 1 60 THR -1.30 1.12 1 64 LYS 4.06 -2.31 1 65 ASN 1.76 -0.54 1 66 GLN -2.48 1.64 1 67 ALA -1.08 0.54 1 68 GLU -4.13 2.79 1 69 THR -0.88 0.65 1 70 LYS -4.42 2.82 1 71 ILE -2.13 1.55 1 72 MET -4.92 3.89 1 73 VAL -0.92 0.72 1 74 LEU -2.27 0.07 1 75 GLN -1.06 0.50 1 77 ALA -2.32 1.01 1 79 ALA -0.70 0.52 1 82 HIS -3.01 2.86 1 83 TYR -6.75 5.73 1 84 THR -4.32 2.66 1 85 TYR -4.13 2.63 1 86 SER -1.58 -0.63 1 87 SER -0.96 -0.09 1 90 SER -2.11 1.75 1 92 SER -0.75 0.97 1 93 ILE -0.03 -0.99 1 94 HIS -6.86 4.67 1 95 SER -2.34 1.02 1 96 VAL -3.96 2.27 1 97 SER -3.90 1.91 1 98 VAL 3.71 -3.58 1 99 VAL 3.33 -0.31 1 100 GLU -6.00 4.26 1 101 ALA -2.79 2.53 1 103 TYR -3.93 2.19 1 104 ASP -1.78 2.07 1 105 GLU -3.35 2.38 1 107 ALA -4.50 3.64 1 108 LEU -3.31 2.02 1 109 LEU -2.88 2.11 1 110 PHE -5.19 3.72 1 111 SER -4.52 2.14 1 112 ARG -5.89 3.26 1 114 THR -1.75 1.07 1 115 LYS -0.78 0.99 1 119 GLN 2.30 -0.27 1 120 ASP 0.33 -0.21 1 121 PHE 1.26 0.25 1 122 ARG -5.43 3.78 1 123 MET -5.50 5.20 1 124 ALA -5.96 3.65 1 125 THR -0.79 1.66 1 126 LEU -2.52 0.25 1 127 TYR -4.84 1.29 1 128 SER -5.12 2.17 1 129 ARG 1.07 0.11 1 130 THR -3.69 1.44 1 131 GLN 2.10 -0.42 1 132 THR -1.26 0.08 1 133 LEU -3.94 2.14 1 134 LYS -0.82 0.52 1 135 ASP 5.38 -1.11 1 136 GLU 3.81 -0.89 1 137 LEU 1.79 -0.55 1 138 LYS 5.86 -1.53 1 139 GLU 3.52 -0.74 1 140 LYS 4.34 -1.02 1 141 PHE 3.65 0.24 1 143 THR 6.15 -1.17 1 144 PHE 3.65 0.17 1 145 SER 7.61 -1.77 1 146 LYS 3.57 -1.03 1 147 ALA 3.77 -2.03 1 148 GLN 0.01 -2.51 1 150 LEU 0.23 -1.67 1 151 THR -3.28 2.13 1 152 GLU 4.46 -0.53 1 153 GLU 2.38 -0.39 1 154 ASP -1.61 1.77 1 155 ILE -1.05 1.64 1 156 VAL -4.90 3.31 1 157 PHE 2.10 -1.32 1 158 LEU 0.38 -0.32 1 160 GLN 1.76 0.49 1 162 ASP 0.39 0.31 1 163 LYS 0.28 -0.05 1 164 ALA 0.17 0.05 1 165 ILE 0.04 -0.05 1 166 GLN -0.41 0.54 1 167 GLU -0.29 1.60 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18473_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.34 _LACS_plot.Line_1_terminator_val_y_1 0.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 -0.94 _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 21 TRP -6.63 -0.05 0 11 ASN 1.46 -0.25 1 12 PHE 2.04 -0.49 1 13 GLN -3.01 -0.06 1 14 GLN 4.10 -0.84 1 15 ASP 3.88 -0.44 1 16 LYS 2.14 -0.34 1 17 PHE -2.77 0.18 1 18 LEU -0.57 -0.43 1 20 ARG 1.25 0.07 1 22 TYR -1.63 0.78 1 23 SER 0.32 -0.48 1 24 ALA -3.48 0.51 1 26 LEU -7.34 1.07 1 27 ALA -7.01 1.20 1 28 SER -3.23 0.16 1 29 ASN -0.26 0.11 1 30 SER -1.82 0.14 1 33 PHE 3.62 -1.12 1 34 ARG 4.96 -0.72 1 35 GLU 1.33 -0.43 1 36 LYS -0.46 -0.16 1 37 LYS 5.37 -1.03 1 38 ALA 0.84 -0.12 1 39 VAL -0.87 0.39 1 40 LEU -0.79 0.00 1 41 TYR -4.65 0.23 1 42 MET 0.33 -0.23 1 44 LYS -1.18 0.27 1 45 THR -2.14 0.55 1 46 VAL -0.83 0.33 1 47 VAL 0.05 0.56 1 50 SER -4.41 0.42 1 51 THR 3.78 -0.27 1 52 GLU 0.42 0.08 1 55 LEU -7.02 0.80 1 56 ASN -2.83 0.47 1 57 LEU -1.33 0.42 1 58 THR 0.69 0.60 1 59 SER -1.97 1.19 1 60 THR -1.30 0.95 1 64 LYS 4.06 -0.42 1 65 ASN 1.76 -0.30 1 66 GLN -2.48 0.20 1 67 ALA -1.08 0.42 1 68 GLU -4.13 0.19 1 69 THR -0.88 0.71 1 71 ILE -2.13 0.92 1 72 MET -4.92 0.30 1 73 VAL -0.92 0.62 1 74 LEU -2.27 0.76 1 75 GLN -1.06 -0.82 1 77 ALA -2.32 0.35 1 79 ALA -0.70 0.00 1 82 HIS -3.01 0.50 1 83 TYR -6.75 0.90 1 84 THR -4.32 1.17 1 85 TYR -4.13 0.56 1 86 SER -1.58 0.07 1 87 SER -0.96 -0.44 1 90 SER -2.11 0.02 1 92 SER -0.75 -0.02 1 93 ILE -0.03 0.32 1 94 HIS -6.86 0.54 1 95 SER -2.34 0.70 1 96 VAL -3.96 1.10 1 97 SER -3.90 1.16 1 98 VAL 3.71 -0.15 1 99 VAL 3.33 -0.42 1 100 GLU -6.00 0.41 1 101 ALA -2.79 0.04 1 103 TYR -3.93 0.49 1 104 ASP -1.78 0.27 1 107 ALA -4.50 0.41 1 108 LEU -3.31 0.87 1 109 LEU -2.88 1.05 1 110 PHE -5.19 1.06 1 111 SER -4.52 1.25 1 112 ARG -5.89 0.73 1 114 THR -1.75 0.31 1 115 LYS -0.78 0.11 1 119 GLN 2.30 -0.33 1 120 ASP 0.33 0.00 1 121 PHE 1.26 -0.16 1 122 ARG -5.43 0.29 1 123 MET -5.50 0.63 1 124 ALA -5.96 1.46 1 125 THR -0.79 0.55 1 126 LEU -2.52 0.72 1 127 TYR -4.84 1.19 1 128 SER -5.12 1.48 1 129 ARG 1.07 -0.24 1 130 THR -3.69 0.45 1 131 GLN 2.10 -0.60 1 132 THR -1.26 -0.07 1 133 LEU -3.94 0.20 1 134 LYS -0.82 0.02 1 135 ASP 5.38 -0.53 1 136 GLU 3.81 -0.23 1 137 LEU 1.79 -0.26 1 138 LYS 5.86 -0.35 1 139 GLU 3.52 -0.27 1 140 LYS 4.34 -0.25 1 141 PHE 3.65 -0.24 1 143 THR 6.15 -0.61 1 144 PHE 3.65 -0.50 1 145 SER 7.61 -1.19 1 146 LYS 3.57 0.07 1 147 ALA 3.77 -0.28 1 148 GLN 0.01 -0.19 1 150 LEU 0.23 0.21 1 151 THR -3.28 0.19 1 152 GLU 4.46 -0.49 1 153 GLU 2.38 -0.18 1 154 ASP -1.61 0.15 1 155 ILE -1.05 0.15 1 156 VAL -4.90 0.42 1 157 PHE 2.10 0.39 1 158 LEU 0.38 -0.45 1 160 GLN 1.76 -0.06 1 162 ASP 0.39 -0.20 1 163 LYS 0.28 0.02 1 164 ALA 0.17 -0.19 1 165 ILE 0.04 -0.05 1 166 GLN -0.41 0.01 1 stop_ save_