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 bmr6722_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.27 _LACS_plot.Line_1_terminator_val_y_1 -4.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 8.30 _LACS_plot.Line_2_terminator_val_y_2 4.96 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 SER 7.44 10.22 0 10 THR -4.40 -3.84 1 11 PHE -4.52 -1.91 1 12 VAL -4.29 -2.21 1 16 ASN -0.26 0.71 1 17 ILE 1.35 1.31 1 19 ARG 5.56 2.89 1 22 MET 4.60 4.28 1 23 ALA 5.09 1.94 1 24 GLU 3.02 2.43 1 25 LYS 4.48 0.93 1 26 MET 0.03 1.97 1 27 PHE 2.69 1.88 1 28 ALA 4.38 3.05 1 29 GLN 4.88 3.43 1 30 GLN 5.93 2.88 1 31 LEU 3.60 2.52 1 32 ARG 4.65 1.89 1 33 HIS 1.01 2.51 1 36 LEU -1.64 -1.55 1 38 ASP 0.05 -0.41 1 39 ALA -1.07 -0.06 1 40 VAL -4.35 -2.69 1 41 ARG -2.56 -1.83 1 42 VAL -2.31 -2.10 1 43 THR -5.57 -1.94 1 44 SER -2.57 -0.68 1 45 ALA -2.93 -1.92 1 47 THR 5.03 2.47 1 49 ASN -1.27 -2.00 1 51 HIS -2.59 -1.70 1 52 VAL 5.28 3.07 1 54 SER 0.05 0.52 1 56 ALA 2.61 -0.44 1 57 ASP -4.21 0.21 1 58 GLU 3.63 2.53 1 59 ARG 5.89 1.62 1 60 ALA 2.96 1.70 1 61 ALA 3.77 2.23 1 63 VAL 5.27 3.62 1 64 LEU 4.92 3.34 1 65 ARG 4.17 2.92 1 66 ALA 3.22 1.49 1 67 HIS -0.67 -0.21 1 69 TYR -0.20 0.78 1 71 THR -1.48 -0.92 1 72 ASP 2.15 1.37 1 73 HIS -3.77 1.89 1 74 ARG -2.87 -2.14 1 75 ALA 0.03 -0.85 1 76 ALA -5.97 -2.13 1 77 GLN -2.67 -2.71 1 78 VAL 1.86 0.97 1 80 THR 5.72 4.30 1 81 GLU 3.49 1.95 1 82 HIS 3.75 4.96 1 83 LEU 3.31 1.07 1 84 ALA -1.29 -1.89 1 85 ALA 2.81 0.32 1 86 ASP 1.87 2.97 1 87 LEU -2.72 -0.55 1 88 LEU 0.47 -0.38 1 89 VAL -0.03 -2.72 1 90 ALA -3.34 -2.33 1 92 ASP -3.38 -1.53 1 93 ARG 3.74 2.48 1 94 ASN 4.49 2.51 1 95 HIS 2.35 4.13 1 96 ALA 4.22 2.49 1 97 ARG 4.47 3.03 1 98 LEU 3.91 2.31 1 100 ARG 3.12 2.03 1 101 GLN 4.17 2.43 1 102 LEU 0.43 -0.14 1 104 VAL 2.99 0.97 1 105 GLU 1.41 -0.26 1 106 ALA 4.17 2.63 1 107 ALA 1.58 1.01 1 108 ARG -0.84 -0.01 1 109 VAL -2.05 -2.00 1 110 ARG -8.27 -4.80 1 111 MET 0.82 -1.96 1 112 LEU 6.17 3.90 1 113 ARG 6.49 3.44 1 114 SER 3.14 2.24 1 115 PHE 2.08 1.67 1 116 ASP -2.65 -1.62 1 118 ARG 1.41 -0.14 1 119 SER 1.63 1.11 1 122 HIS -0.94 0.27 1 124 LEU -1.90 -1.24 1 125 ASP -0.24 0.59 1 126 VAL 2.36 -0.31 1 127 GLU 0.63 -0.12 1 128 ASP -1.98 -1.03 1 130 TYR 4.51 4.30 1 131 TYR 2.83 0.02 1 133 ASP -4.63 -2.76 1 134 HIS 5.42 5.99 1 135 SER 0.50 3.37 1 136 ASP 4.11 3.24 1 137 PHE -1.86 -0.19 1 138 GLU 3.75 2.74 1 139 GLU 0.88 0.91 1 141 PHE 5.68 4.54 1 142 ALA 3.53 2.08 1 143 VAL 5.10 3.04 1 144 ILE 6.60 4.53 1 145 GLU 3.49 2.67 1 146 SER 2.62 2.04 1 147 ALA -0.71 0.39 1 148 LEU 8.31 5.45 1 151 LEU 3.48 1.69 1 152 HIS 6.08 6.92 1 153 ASP 4.73 3.10 1 154 TRP 5.08 4.68 1 155 VAL 8.14 4.31 1 156 ASP 4.55 2.83 1 157 GLU 3.37 2.08 1 158 ARG 3.05 0.48 1 159 LEU 2.50 1.17 1 160 ALA 1.70 0.25 1 161 ARG 1.57 0.41 1 162 ASN 0.06 -0.38 1 165 SER 0.62 1.32 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6722_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.27 _LACS_plot.Line_1_terminator_val_y_1 3.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.98 _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 8.30 _LACS_plot.Line_2_terminator_val_y_2 -3.34 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 SER 7.44 2.78 0 10 THR -4.40 0.56 1 11 PHE -4.52 2.61 1 12 VAL -4.29 2.08 1 16 ASN -0.26 0.97 1 17 ILE 1.35 -0.04 1 19 ARG 5.56 -2.67 1 22 MET 4.60 -0.32 1 23 ALA 5.09 -3.15 1 24 GLU 3.02 -0.59 1 25 LYS 4.48 -3.55 1 26 MET 0.03 1.94 1 27 PHE 2.69 -0.81 1 28 ALA 4.38 -1.33 1 29 GLN 4.88 -1.45 1 30 GLN 5.93 -3.05 1 31 LEU 3.60 -1.08 1 32 ARG 4.65 -2.76 1 33 HIS 1.01 1.50 1 36 LEU -1.64 0.09 1 38 ASP 0.05 -0.46 1 39 ALA -1.07 1.01 1 40 VAL -4.35 1.66 1 41 ARG -2.56 0.73 1 42 VAL -2.31 0.21 1 43 THR -5.57 3.63 1 44 SER -2.57 1.89 1 45 ALA -2.93 1.01 1 47 THR 5.03 -2.56 1 49 ASN -1.27 -0.73 1 51 HIS -2.59 0.89 1 52 VAL 5.28 -2.21 1 54 SER 0.05 0.47 1 56 ALA 2.61 -3.05 1 57 ASP -4.21 4.42 1 58 GLU 3.63 -1.10 1 59 ARG 5.89 -4.27 1 60 ALA 2.96 -1.26 1 61 ALA 3.77 -1.54 1 63 VAL 5.27 -1.65 1 64 LEU 4.92 -1.58 1 65 ARG 4.17 -1.25 1 66 ALA 3.22 -1.73 1 67 HIS -0.67 0.46 1 69 TYR -0.20 0.98 1 71 THR -1.48 0.56 1 72 ASP 2.15 -0.78 1 73 HIS -3.77 5.66 1 74 ARG -2.87 0.73 1 75 ALA 0.03 -0.88 1 76 ALA -5.97 3.84 1 77 GLN -2.67 -0.04 1 78 VAL 1.86 -0.89 1 80 THR 5.72 -1.42 1 81 GLU 3.49 -1.54 1 82 HIS 3.75 1.21 1 83 LEU 3.31 -2.24 1 84 ALA -1.29 -0.60 1 85 ALA 2.81 -2.49 1 86 ASP 1.87 1.10 1 87 LEU -2.72 2.17 1 88 LEU 0.47 -0.85 1 89 VAL -0.03 -2.69 1 90 ALA -3.34 1.01 1 92 ASP -3.38 1.85 1 93 ARG 3.74 -1.26 1 94 ASN 4.49 -1.98 1 95 HIS 2.35 1.78 1 96 ALA 4.22 -1.73 1 97 ARG 4.47 -1.44 1 98 LEU 3.91 -1.60 1 100 ARG 3.12 -1.09 1 101 GLN 4.17 -1.74 1 102 LEU 0.43 -0.57 1 104 VAL 2.99 -2.02 1 105 GLU 1.41 -1.67 1 106 ALA 4.17 -1.54 1 107 ALA 1.58 -0.57 1 108 ARG -0.84 0.83 1 109 VAL -2.05 0.05 1 110 ARG -8.27 3.47 1 111 MET 0.82 -2.78 1 112 LEU 6.17 -2.27 1 113 ARG 6.49 -3.05 1 114 SER 3.14 -0.90 1 115 PHE 2.08 -0.41 1 116 ASP -2.65 1.03 1 118 ARG 1.41 -1.55 1 119 SER 1.63 -0.52 1 122 HIS -0.94 1.21 1 124 LEU -1.90 0.66 1 125 ASP -0.24 0.83 1 126 VAL 2.36 -2.67 1 127 GLU 0.63 -0.75 1 128 ASP -1.98 0.95 1 130 TYR 4.51 -0.21 1 131 TYR 2.83 -2.81 1 133 ASP -4.63 1.87 1 134 HIS 5.42 0.57 1 135 SER 0.50 2.87 1 136 ASP 4.11 -0.87 1 137 PHE -1.86 1.67 1 138 GLU 3.75 -1.01 1 139 GLU 0.88 0.03 1 141 PHE 5.68 -1.14 1 142 ALA 3.53 -1.45 1 143 VAL 5.10 -2.06 1 144 ILE 6.60 -2.07 1 145 GLU 3.49 -0.82 1 146 SER 2.62 -0.58 1 147 ALA -0.71 1.10 1 148 LEU 8.31 -2.86 1 151 LEU 3.48 -1.79 1 152 HIS 6.08 0.84 1 153 ASP 4.73 -1.63 1 154 TRP 5.08 -0.40 1 155 VAL 8.14 -3.83 1 156 ASP 4.55 -1.72 1 157 GLU 3.37 -1.29 1 158 ARG 3.05 -2.57 1 159 LEU 2.50 -1.33 1 160 ALA 1.70 -1.45 1 161 ARG 1.57 -1.16 1 162 ASN 0.06 -0.44 1 165 SER 0.62 0.70 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6722_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.27 _LACS_plot.Line_1_terminator_val_y_1 -3.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.38 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 8.14 _LACS_plot.Line_2_terminator_val_y_2 2.66 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 110 ARG -8.27 -1.16 0 10 THR -4.40 -3.46 1 11 PHE -4.52 -1.71 1 16 ASN -0.26 3.08 1 17 ILE 1.35 1.90 1 19 ARG 5.56 1.77 1 22 MET 4.60 -1.14 1 23 ALA 5.09 -1.61 1 24 GLU 3.02 0.54 1 25 LYS 4.48 3.93 1 26 MET 0.03 3.54 1 27 PHE 2.69 1.42 1 28 ALA 4.38 2.18 1 29 GLN 4.88 1.06 1 30 GLN 5.93 3.96 1 31 LEU 3.60 0.95 1 33 HIS 1.01 2.20 1 36 LEU -1.64 -0.56 1 38 ASP 0.05 -0.46 1 39 ALA -1.07 -2.11 1 40 VAL -4.35 -3.10 1 41 ARG -2.56 -2.99 1 42 VAL -2.31 -0.74 1 43 THR -5.57 -1.73 1 44 SER -2.57 -3.42 1 45 ALA -2.93 -3.80 1 47 THR 5.03 1.73 1 51 HIS -2.59 0.43 1 52 VAL 5.28 0.46 1 54 SER 0.05 -1.31 1 56 ALA 2.61 -1.63 1 57 ASP -4.21 0.55 1 58 GLU 3.63 1.95 1 59 ARG 5.89 1.94 1 60 ALA 2.96 0.04 1 61 ALA 3.77 0.75 1 63 VAL 5.27 1.05 1 64 LEU 4.92 1.54 1 65 ARG 4.17 4.04 1 66 ALA 3.22 0.52 1 67 HIS -0.67 -0.88 1 71 THR -1.48 -0.36 1 72 ASP 2.15 -0.49 1 73 HIS -3.77 -1.93 1 74 ARG -2.87 -2.21 1 75 ALA 0.03 -0.49 1 76 ALA -5.97 -2.43 1 77 GLN -2.67 -1.98 1 78 VAL 1.86 -1.33 1 80 THR 5.72 1.66 1 81 GLU 3.49 1.00 1 82 HIS 3.75 2.70 1 83 LEU 3.31 -1.43 1 84 ALA -1.29 -1.48 1 85 ALA 2.81 -3.38 1 86 ASP 1.87 -1.56 1 87 LEU -2.72 -5.68 1 88 LEU 0.47 -4.50 1 89 VAL -0.03 -1.56 1 90 ALA -3.34 -1.42 1 92 ASP -3.38 -0.70 1 93 ARG 3.74 2.40 1 94 ASN 4.49 2.30 1 95 HIS 2.35 2.72 1 96 ALA 4.22 -0.18 1 97 ARG 4.47 2.32 1 100 ARG 3.12 4.70 1 101 GLN 4.17 1.50 1 102 LEU 0.43 -1.05 1 104 VAL 2.99 -1.58 1 105 GLU 1.41 -0.53 1 106 ALA 4.17 1.53 1 107 ALA 1.58 0.23 1 108 ARG -0.84 -4.00 1 109 VAL -2.05 -1.39 1 111 MET 0.82 2.80 1 112 LEU 6.17 -0.21 1 113 ARG 6.49 0.78 1 114 SER 3.14 -0.45 1 115 PHE 2.08 -1.14 1 118 ARG 1.41 0.48 1 122 HIS -0.94 0.20 1 124 LEU -1.90 -1.83 1 125 ASP -0.24 0.40 1 126 VAL 2.36 -1.71 1 127 GLU 0.63 -1.16 1 130 TYR 4.51 0.67 1 131 TYR 2.83 -0.95 1 134 HIS 5.42 3.23 1 135 SER 0.50 2.12 1 136 ASP 4.11 2.78 1 137 PHE -1.86 3.24 1 138 GLU 3.75 3.97 1 141 PHE 5.68 -0.62 1 142 ALA 3.53 2.94 1 143 VAL 5.10 1.45 1 144 ILE 6.60 1.14 1 145 GLU 3.49 2.12 1 146 SER 2.62 -0.47 1 147 ALA -0.71 -1.52 1 151 LEU 3.48 1.25 1 152 HIS 6.08 3.36 1 153 ASP 4.73 1.35 1 154 TRP 5.08 2.14 1 155 VAL 8.14 0.19 1 156 ASP 4.55 2.71 1 157 GLU 3.37 1.43 1 158 ARG 3.05 2.65 1 159 LEU 2.50 0.40 1 160 ALA 1.70 -0.11 1 161 ARG 1.57 -0.68 1 162 ASN 0.06 -0.57 1 stop_ save_