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 bmr27531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.29 _LACS_plot.Line_1_terminator_val_y_1 -3.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.65 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 5.15 _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 129 TYR -2.18 -4.31 0 11 MET 3.31 1.64 1 12 ASN 4.31 2.81 1 13 ASN 4.35 3.09 1 14 TYR 4.82 3.67 1 15 ARG 4.22 3.91 1 16 LYS 4.29 3.74 1 17 ARG 4.60 3.72 1 18 VAL 5.20 3.42 1 20 ARG 4.53 3.44 1 21 LEU 3.81 2.98 1 22 PHE 4.21 3.54 1 23 MET 4.46 0.21 1 24 GLU 3.21 2.80 1 25 GLN 4.48 3.02 1 26 LYS 3.34 -0.35 1 27 ALA 1.89 0.99 1 28 ALA 0.07 -0.61 1 29 GLN 0.44 1.00 1 31 ASP 0.08 -1.39 1 32 ALA -2.82 -1.25 1 33 VAL -0.78 -0.92 1 34 LYS -3.28 -1.83 1 35 LEU 1.41 -0.04 1 37 SER 1.72 0.73 1 39 LEU 0.72 1.68 1 40 VAL -4.79 -2.54 1 41 PHE -6.77 -2.24 1 42 GLN -6.27 -1.61 1 43 ARG 1.93 1.46 1 44 ILE 2.28 2.19 1 45 ALA -4.52 -0.93 1 46 ARG -1.43 -1.01 1 48 SER -0.98 -0.50 1 50 LYS -0.24 0.18 1 51 ARG -5.12 -1.64 1 52 ALA -4.04 -1.08 1 54 ALA -3.12 -1.96 1 55 ILE 1.95 1.71 1 56 ASP -2.47 -2.97 1 57 ASP -4.37 -2.97 1 58 LYS 1.33 1.28 1 60 GLU -2.33 -1.32 1 61 VAL -5.80 -2.34 1 62 HIS -7.88 -1.76 1 63 TYR -6.53 -1.73 1 64 THR -2.01 1.38 1 66 ARG -6.74 -1.91 1 67 LEU -2.15 -1.32 1 68 ARG 4.18 2.19 1 69 ASP -0.41 -1.24 1 71 THR 3.30 2.78 1 72 VAL 0.89 0.33 1 73 PHE -1.69 -0.60 1 74 ASP -1.68 0.79 1 75 SER -2.06 -1.86 1 77 ARG 5.35 3.35 1 78 GLU 2.01 1.53 1 79 ARG 1.15 1.79 1 81 LYS -2.25 -0.77 1 83 THR -1.77 -0.34 1 84 THR -1.40 -1.11 1 94 TRP 0.25 0.61 1 95 THR 6.93 6.04 1 97 ALA 1.72 2.83 1 98 LEU 3.89 3.06 1 99 GLN -0.36 2.01 1 100 LEU -3.07 -1.24 1 101 MET -4.27 -0.09 1 102 ARG -5.17 -3.50 1 103 GLU 3.17 2.99 1 105 ASP 0.14 1.13 1 106 ARG -4.53 -1.30 1 107 TRP -9.29 -3.26 1 108 ARG -6.04 -1.19 1 109 LEU -3.13 -0.29 1 110 PHE 1.09 1.13 1 113 TYR 3.90 3.00 1 114 ASP 3.73 0.73 1 115 LEU -1.96 -1.69 1 116 ALA -1.61 -1.44 1 125 MET -0.20 0.49 1 126 ILE -0.02 -0.49 1 132 LEU -7.03 -1.63 1 133 GLU -5.88 -3.13 1 134 PHE -6.94 -1.81 1 136 VAL -3.54 -1.02 1 137 GLU -6.61 -2.55 1 138 LEU 0.12 -1.03 1 139 ILE 3.05 2.35 1 140 SER -2.63 -0.76 1 141 ILE -3.10 -0.92 1 142 LYS 3.59 2.09 1 143 ASP 3.77 2.35 1 148 ARG -0.78 0.84 1 149 THR -1.64 -0.29 1 150 ALA 3.84 3.13 1 151 GLU 4.81 3.77 1 152 GLU 2.06 2.46 1 153 VAL 6.89 5.35 1 154 ASP 4.97 3.58 1 155 GLU 3.18 2.69 1 156 ILE 4.92 4.41 1 157 LEU 4.48 2.76 1 158 ARG 4.55 3.39 1 159 LYS 4.13 2.92 1 160 ALA 3.24 2.19 1 161 GLU 2.44 2.44 1 162 GLU 1.76 1.60 1 163 ASP 1.27 0.82 1 164 ARG 0.98 0.91 1 165 GLU 0.52 0.60 1 166 ASP 0.67 0.49 1 167 MET 1.55 0.81 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.29 _LACS_plot.Line_1_terminator_val_y_1 6.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 -1.78 _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 129 TYR -2.18 -2.13 0 11 MET 3.31 -1.67 1 12 ASN 4.31 -1.50 1 13 ASN 4.35 -1.26 1 14 TYR 4.82 -1.15 1 15 ARG 4.22 -0.31 1 16 LYS 4.29 -0.55 1 17 ARG 4.60 -0.88 1 18 VAL 5.20 -1.78 1 20 ARG 4.53 -1.09 1 21 LEU 3.81 -0.83 1 22 PHE 4.21 -0.67 1 23 MET 4.46 -4.25 1 24 GLU 3.21 -0.41 1 25 GLN 4.48 -1.46 1 26 LYS 3.34 -3.69 1 27 ALA 1.89 -0.90 1 28 ALA 0.07 -0.68 1 29 GLN 0.44 0.56 1 31 ASP 0.08 -1.47 1 32 ALA -2.82 1.57 1 33 VAL -0.78 -0.14 1 34 LYS -3.28 1.45 1 35 LEU 1.41 -1.45 1 37 SER 1.72 -0.99 1 39 LEU 0.72 0.96 1 40 VAL -4.79 2.25 1 41 PHE -6.77 4.53 1 42 GLN -6.27 4.66 1 43 ARG 1.93 -0.47 1 44 ILE 2.28 -0.09 1 45 ALA -4.52 3.59 1 46 ARG -1.43 0.42 1 48 SER -0.98 0.48 1 50 LYS -0.24 0.42 1 51 ARG -5.12 3.48 1 52 ALA -4.04 2.96 1 54 ALA -3.12 1.16 1 55 ILE 1.95 -0.24 1 56 ASP -2.47 -0.50 1 57 ASP -4.37 1.40 1 58 LYS 1.33 -0.05 1 60 GLU -2.33 1.01 1 61 VAL -5.80 3.46 1 62 HIS -7.88 6.12 1 63 TYR -6.53 4.80 1 64 THR -2.01 3.39 1 66 ARG -6.74 4.83 1 67 LEU -2.15 0.83 1 68 ARG 4.18 -1.99 1 69 ASP -0.41 -0.83 1 71 THR 3.30 -0.52 1 72 VAL 0.89 -0.56 1 73 PHE -1.69 1.09 1 74 ASP -1.68 2.47 1 75 SER -2.06 0.20 1 77 ARG 5.35 -2.00 1 78 GLU 2.01 -0.48 1 79 ARG 1.15 0.64 1 81 LYS -2.25 1.48 1 83 THR -1.77 1.43 1 84 THR -1.40 0.29 1 94 TRP 0.25 0.36 1 95 THR 6.93 -0.89 1 97 ALA 1.72 1.11 1 98 LEU 3.89 -0.83 1 99 GLN -0.36 2.37 1 100 LEU -3.07 1.83 1 101 MET -4.27 4.18 1 102 ARG -5.17 1.67 1 103 GLU 3.17 -0.18 1 105 ASP 0.14 0.99 1 106 ARG -4.53 3.23 1 107 TRP -9.29 6.03 1 108 ARG -6.04 4.85 1 109 LEU -3.13 2.84 1 110 PHE 1.09 0.04 1 113 TYR 3.90 -0.90 1 114 ASP 3.73 -3.00 1 115 LEU -1.96 0.27 1 116 ALA -1.61 0.17 1 125 MET -0.20 0.69 1 126 ILE -0.02 -0.47 1 132 LEU -7.03 5.40 1 133 GLU -5.88 2.75 1 134 PHE -6.94 5.13 1 136 VAL -3.54 2.52 1 137 GLU -6.61 4.06 1 138 LEU 0.12 -1.15 1 139 ILE 3.05 -0.70 1 140 SER -2.63 1.87 1 141 ILE -3.10 2.18 1 142 LYS 3.59 -1.50 1 143 ASP 3.77 -1.42 1 148 ARG -0.78 1.62 1 149 THR -1.64 1.35 1 150 ALA 3.84 -0.71 1 151 GLU 4.81 -1.04 1 152 GLU 2.06 0.40 1 153 VAL 6.89 -1.54 1 154 ASP 4.97 -1.39 1 155 GLU 3.18 -0.49 1 156 ILE 4.92 -0.51 1 157 LEU 4.48 -1.72 1 158 ARG 4.55 -1.16 1 159 LYS 4.13 -1.21 1 160 ALA 3.24 -1.05 1 161 GLU 2.44 0.00 1 162 GLU 1.76 -0.16 1 163 ASP 1.27 -0.45 1 164 ARG 0.98 -0.07 1 165 GLU 0.52 0.08 1 166 ASP 0.67 -0.18 1 167 MET 1.55 -0.74 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.29 _LACS_plot.Line_1_terminator_val_y_1 -3.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 6.88 _LACS_plot.Line_2_terminator_val_y_2 2.89 _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 62 HIS -7.88 2.80 0 11 MET 3.31 2.50 1 12 ASN 4.31 2.00 1 13 ASN 4.35 2.80 1 14 TYR 4.82 0.80 1 15 ARG 4.22 3.90 1 16 LYS 4.29 2.30 1 17 ARG 4.60 2.70 1 18 VAL 5.20 3.20 1 20 ARG 4.53 2.50 1 21 LEU 3.81 1.30 1 22 PHE 4.21 0.90 1 23 MET 4.46 4.20 1 24 GLU 3.21 3.00 1 25 GLN 4.48 3.80 1 26 LYS 3.34 2.70 1 27 ALA 1.89 -1.00 1 28 ALA 0.07 0.20 1 29 GLN 0.44 1.30 1 31 ASP 0.08 -1.20 1 32 ALA -2.82 -0.90 1 33 VAL -0.78 -3.30 1 34 LYS -3.28 -0.60 1 35 LEU 1.41 1.40 1 37 SER 1.72 0.90 1 39 LEU 0.72 -3.40 1 40 VAL -4.79 -1.80 1 41 PHE -6.77 -2.40 1 42 GLN -6.27 -0.60 1 43 ARG 1.93 -0.40 1 44 ILE 2.28 -0.40 1 45 ALA -4.52 -1.40 1 46 ARG -1.43 0.40 1 48 SER -0.98 1.10 1 50 LYS -0.24 0.40 1 51 ARG -5.12 -3.40 1 52 ALA -4.04 -0.40 1 54 ALA -3.12 0.70 1 55 ILE 1.95 -3.80 1 56 ASP -2.47 0.50 1 57 ASP -4.37 -1.10 1 58 LYS 1.33 -1.60 1 60 GLU -2.33 -1.00 1 61 VAL -5.80 -1.20 1 63 TYR -6.53 -2.10 1 64 THR -2.01 -1.90 1 66 ARG -6.74 -0.30 1 67 LEU -2.15 2.30 1 68 ARG 4.18 -0.80 1 69 ASP -0.41 0.70 1 71 THR 3.30 -0.30 1 72 VAL 0.89 0.00 1 73 PHE -1.69 -1.10 1 74 ASP -1.68 -1.70 1 77 ARG 5.35 3.20 1 78 GLU 2.01 1.10 1 79 ARG 1.15 1.40 1 81 LYS -2.25 -2.40 1 83 THR -1.77 -2.10 1 84 THR -1.40 -0.70 1 94 TRP 0.25 1.30 1 97 ALA 1.72 1.50 1 98 LEU 3.89 0.10 1 99 GLN -0.36 -0.10 1 100 LEU -3.07 -5.20 1 101 MET -4.27 -4.40 1 102 ARG -5.17 -0.10 1 103 GLU 3.17 0.30 1 105 ASP 0.14 -1.00 1 106 ARG -4.53 -1.30 1 107 TRP -9.29 -2.20 1 108 ARG -6.04 -1.90 1 109 LEU -3.13 -2.70 1 110 PHE 1.09 -0.60 1 113 TYR 3.90 1.40 1 114 ASP 3.73 0.50 1 115 LEU -1.96 -3.40 1 116 ALA -1.61 -1.60 1 125 MET -0.20 -1.70 1 126 ILE -0.02 -1.00 1 129 TYR -2.18 -1.20 1 132 LEU -7.03 -2.70 1 133 GLU -5.88 -1.20 1 134 PHE -6.94 -1.40 1 136 VAL -3.54 -4.10 1 137 GLU -6.61 -1.80 1 138 LEU 0.12 -3.50 1 139 ILE 3.05 0.30 1 140 SER -2.63 -2.80 1 141 ILE -3.10 0.30 1 142 LYS 3.59 1.10 1 143 ASP 3.77 -0.70 1 148 ARG -0.78 0.20 1 149 THR -1.64 0.80 1 150 ALA 3.84 0.10 1 151 GLU 4.81 3.10 1 152 GLU 2.06 3.60 1 153 VAL 6.89 1.40 1 154 ASP 4.97 2.90 1 155 GLU 3.18 1.90 1 156 ILE 4.92 3.10 1 157 LEU 4.48 1.50 1 158 ARG 4.55 2.90 1 159 LYS 4.13 2.00 1 160 ALA 3.24 2.50 1 161 GLU 2.44 2.00 1 162 GLU 1.76 1.00 1 163 ASP 1.27 0.40 1 164 ARG 0.98 0.80 1 165 GLU 0.52 0.20 1 166 ASP 0.67 0.60 1 167 MET 1.55 0.40 1 stop_ save_