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 bmr18977_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 -3.72 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.62 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 6.01 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 ALA 5.21 0.14 0 10 ARG -0.29 -0.09 1 11 SER -1.60 -2.90 1 13 ALA 0.00 -0.05 1 14 TRP -3.23 -2.42 1 15 ALA 0.00 -0.05 1 16 GLN -2.88 -1.12 1 17 ALA 2.59 1.79 1 18 VAL -0.01 1.41 1 19 ASP -3.85 -2.65 1 22 ILE 1.21 -0.29 1 23 ASN -1.54 -0.44 1 24 LEU -0.80 -0.16 1 25 TYR -6.56 -1.69 1 26 ARG -2.28 -0.19 1 27 MET 1.01 2.20 1 28 SER -0.81 -1.65 1 30 THR -1.00 -1.76 1 31 LEU -2.02 0.52 1 32 TYR -5.28 -1.50 1 33 ARG -7.05 -3.69 1 34 SER -2.35 1.52 1 35 ALA -1.90 -1.27 1 36 LEU -2.09 -0.87 1 38 ASN -4.27 -2.48 1 39 ALA 3.40 2.77 1 40 GLN 3.85 2.22 1 41 SER 1.60 0.71 1 42 VAL 7.59 6.02 1 43 ALA 4.28 2.79 1 44 LEU 4.00 2.69 1 45 LEU 5.68 3.45 1 46 GLN 4.41 3.41 1 47 ARG 4.69 3.68 1 48 LEU 0.63 -0.02 1 49 GLN 4.32 0.51 1 50 VAL 3.58 2.47 1 51 LYS -1.81 -0.77 1 52 THR -1.53 -0.19 1 53 VAL -2.75 -1.79 1 54 VAL -2.42 -1.92 1 55 SER -5.39 -4.28 1 59 ASP 2.34 0.72 1 62 ARG 5.14 2.41 1 63 ALA 3.30 2.90 1 68 ALA -0.21 -1.41 1 70 VAL -4.47 -2.19 1 71 ARG -0.27 0.10 1 72 VAL -1.47 -0.97 1 73 VAL -1.45 -0.67 1 74 SER -0.54 -0.92 1 75 LEU -2.64 -3.09 1 77 THR -0.36 -1.63 1 78 HIS -3.55 0.10 1 79 ALA 3.16 3.31 1 80 ASP 2.34 0.44 1 81 ARG -2.00 -1.17 1 82 VAL 3.00 2.12 1 83 ASP -5.45 -3.22 1 84 ASP 3.87 3.34 1 85 ALA 4.00 2.68 1 86 GLU 3.01 3.00 1 87 VAL 7.19 5.97 1 88 LEU 4.55 3.53 1 89 SER 3.76 3.04 1 90 VAL 6.77 5.32 1 91 LEU 5.27 3.85 1 92 ARG 5.36 4.41 1 94 LEU 3.67 3.39 1 95 GLN 3.08 3.98 1 96 ALA 3.78 2.63 1 97 ALA 3.95 2.58 1 98 GLU 0.98 2.87 1 99 ARG 3.49 2.60 1 100 GLU -0.49 -0.25 1 103 VAL -4.98 -2.30 1 104 LEU -6.35 -2.38 1 105 MET -4.93 -2.82 1 109 HIS 3.37 3.06 1 111 ASN -1.16 0.05 1 112 ASN 2.20 1.35 1 113 ARG 7.39 6.56 1 114 THR 4.68 4.75 1 116 LEU 6.60 5.45 1 117 PHE 3.14 3.20 1 118 ALA 2.54 2.44 1 120 MET 5.91 5.10 1 121 TYR 2.30 1.24 1 122 ARG 0.07 2.19 1 123 ILE 4.21 3.39 1 124 VAL 5.48 2.99 1 125 VAL -0.34 0.81 1 126 GLN 0.22 -0.23 1 128 TRP -1.77 -0.75 1 129 ASP 4.70 4.19 1 130 LYS 5.25 3.33 1 131 GLN 2.64 2.41 1 132 ALA 2.56 2.68 1 133 ALA 3.03 2.93 1 134 LEU 3.97 3.33 1 135 GLU 3.16 2.41 1 136 GLU 0.65 4.19 1 137 MET 0.94 1.95 1 138 GLN -0.37 -0.63 1 139 ARG -0.81 -0.75 1 142 PHE -2.75 -1.09 1 144 ASP 4.11 3.76 1 145 GLU 3.03 2.39 1 146 ASP 0.94 1.39 1 147 ASP -1.56 -1.52 1 148 MET 4.72 3.71 1 149 ARG 3.25 3.20 1 151 ALA 3.96 2.77 1 153 ALA 5.13 4.09 1 154 TYR 5.11 4.13 1 155 VAL 5.36 4.66 1 156 ARG 1.14 0.57 1 158 ALA 0.35 -1.73 1 159 ASP 6.09 4.61 1 160 VAL 4.58 3.48 1 161 ASP 2.02 3.06 1 163 LEU 3.50 2.88 1 165 LEU 2.48 2.08 1 166 ALA 2.73 1.22 1 167 MET 1.92 1.41 1 168 ALA 0.39 0.46 1 169 ASN -0.71 -0.14 1 171 GLU -5.67 -4.61 1 173 SER 0.25 0.16 1 175 SER -0.18 -0.36 1 177 PHE -0.51 -0.16 1 178 ALA 0.42 0.14 1 179 LEU 0.74 0.43 1 182 VAL 0.88 0.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18977_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 3.33 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.38 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 ALA 5.21 -5.07 0 10 ARG -0.29 0.20 1 11 SER -1.60 -1.30 1 13 ALA 0.00 -0.05 1 14 TRP -3.23 0.81 1 15 ALA 0.00 -0.05 1 16 GLN -2.88 1.76 1 17 ALA 2.59 -0.80 1 18 VAL -0.01 1.42 1 19 ASP -3.85 1.20 1 22 ILE 1.21 -1.50 1 23 ASN -1.54 1.10 1 24 LEU -0.80 0.64 1 25 TYR -6.56 4.87 1 26 ARG -2.28 2.09 1 27 MET 1.01 1.19 1 28 SER -0.81 -0.84 1 30 THR -1.00 -0.76 1 31 LEU -2.02 2.54 1 32 TYR -5.28 3.78 1 33 ARG -7.05 3.36 1 34 SER -2.35 3.87 1 35 ALA -1.90 0.63 1 36 LEU -2.09 1.22 1 38 ASN -4.27 1.79 1 39 ALA 3.40 -0.63 1 40 GLN 3.85 -1.63 1 41 SER 1.60 -0.89 1 42 VAL 7.59 -1.57 1 43 ALA 4.28 -1.49 1 44 LEU 4.00 -1.31 1 45 LEU 5.68 -2.23 1 46 GLN 4.41 -1.00 1 47 ARG 4.69 -1.01 1 48 LEU 0.63 -0.65 1 49 GLN 4.32 -3.81 1 50 VAL 3.58 -1.11 1 51 LYS -1.81 1.04 1 52 THR -1.53 1.34 1 53 VAL -2.75 0.96 1 54 VAL -2.42 0.50 1 55 SER -5.39 1.11 1 59 ASP 2.34 -1.62 1 62 ARG 5.14 -2.73 1 63 ALA 3.30 -0.40 1 68 ALA -0.21 -1.20 1 70 VAL -4.47 2.28 1 71 ARG -0.27 0.37 1 72 VAL -1.47 0.50 1 73 VAL -1.45 0.78 1 74 SER -0.54 -0.38 1 75 LEU -2.64 -0.45 1 77 THR -0.36 -1.27 1 78 HIS -3.55 3.65 1 79 ALA 3.16 0.15 1 80 ASP 2.34 -1.90 1 81 ARG -2.00 0.83 1 82 VAL 3.00 -0.88 1 83 ASP -5.45 2.23 1 84 ASP 3.87 -0.53 1 85 ALA 4.00 -1.32 1 86 GLU 3.01 -0.01 1 87 VAL 7.19 -1.22 1 88 LEU 4.55 -1.02 1 89 SER 3.76 -0.72 1 90 VAL 6.77 -1.45 1 91 LEU 5.27 -1.42 1 92 ARG 5.36 -0.95 1 94 LEU 3.67 -0.28 1 95 GLN 3.08 0.90 1 96 ALA 3.78 -1.15 1 97 ALA 3.95 -1.37 1 98 GLU 0.98 1.89 1 99 ARG 3.49 -0.89 1 100 GLU -0.49 0.24 1 103 VAL -4.98 2.68 1 104 LEU -6.35 3.97 1 105 MET -4.93 2.11 1 109 HIS 3.37 -0.31 1 111 ASN -1.16 1.21 1 112 ASN 2.20 -0.85 1 113 ARG 7.39 -0.83 1 114 THR 4.68 0.07 1 116 LEU 6.60 -1.15 1 117 PHE 3.14 0.06 1 118 ALA 2.54 -0.10 1 120 MET 5.91 -0.81 1 121 TYR 2.30 -1.06 1 122 ARG 0.07 2.12 1 123 ILE 4.21 -0.82 1 124 VAL 5.48 -2.49 1 125 VAL -0.34 1.15 1 126 GLN 0.22 -0.45 1 128 TRP -1.77 1.02 1 129 ASP 4.70 -0.51 1 130 LYS 5.25 -1.92 1 131 GLN 2.64 -0.23 1 132 ALA 2.56 0.12 1 133 ALA 3.03 -0.10 1 134 LEU 3.97 -0.64 1 135 GLU 3.16 -0.75 1 136 GLU 0.65 3.54 1 137 MET 0.94 1.01 1 138 GLN -0.37 -0.26 1 139 ARG -0.81 0.06 1 142 PHE -2.75 1.66 1 144 ASP 4.11 -0.35 1 145 GLU 3.03 -0.64 1 146 ASP 0.94 0.45 1 147 ASP -1.56 0.04 1 148 MET 4.72 -1.01 1 149 ARG 3.25 -0.05 1 151 ALA 3.96 -1.19 1 153 ALA 5.13 -1.04 1 154 TYR 5.11 -0.98 1 155 VAL 5.36 -0.70 1 156 ARG 1.14 -0.57 1 158 ALA 0.35 -2.08 1 159 ASP 6.09 -1.48 1 160 VAL 4.58 -1.10 1 161 ASP 2.02 1.04 1 163 LEU 3.50 -0.62 1 165 LEU 2.48 -0.40 1 166 ALA 2.73 -1.51 1 167 MET 1.92 -0.51 1 168 ALA 0.39 0.07 1 169 ASN -0.71 0.57 1 171 GLU -5.67 1.06 1 173 SER 0.25 -0.09 1 175 SER -0.18 -0.18 1 177 PHE -0.51 0.35 1 178 ALA 0.42 -0.28 1 179 LEU 0.74 -0.31 1 182 VAL 0.88 -0.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18977_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.05 _LACS_plot.Line_1_terminator_val_y_1 0.65 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _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 136 GLU 3.16 -2.64 0 10 ARG -0.29 -0.58 1 13 ALA 0.00 0.02 1 14 TRP -3.23 0.53 1 15 ALA 0.00 0.36 1 16 GLN -2.88 0.39 1 17 ALA 2.59 -1.42 1 18 VAL -0.01 -0.01 1 22 ILE 1.21 0.28 1 23 ASN -1.54 -0.71 1 24 LEU -0.80 1.25 1 25 TYR -6.56 0.67 1 26 ARG -2.28 -0.24 1 27 MET 1.01 -0.15 1 30 THR -1.00 0.40 1 31 LEU -2.02 0.99 1 32 TYR -5.28 0.55 1 33 ARG -7.05 1.65 1 34 SER -2.35 -0.72 1 35 ALA -1.90 -0.39 1 38 ASN -4.27 -0.53 1 39 ALA 3.40 0.23 1 40 GLN 3.85 -0.13 1 41 SER 1.60 -0.07 1 42 VAL 7.59 -0.85 1 43 ALA 4.28 -0.24 1 44 LEU 4.00 -0.32 1 45 LEU 5.68 -0.79 1 46 GLN 4.41 -0.28 1 47 ARG 4.69 -0.83 1 48 LEU 0.63 -0.27 1 49 GLN 4.32 -0.63 1 50 VAL 3.58 -0.79 1 51 LYS -1.81 0.22 1 52 THR -1.53 -0.69 1 53 VAL -2.75 0.81 1 54 VAL -2.42 0.48 1 63 ALA 3.30 0.34 1 70 VAL -4.47 -0.04 1 71 ARG -0.27 -0.08 1 72 VAL -1.47 0.39 1 73 VAL -1.45 -0.09 1 74 SER -0.54 -0.04 1 77 THR -0.36 -0.41 1 78 HIS -3.55 0.16 1 79 ALA 3.16 -0.70 1 80 ASP 2.34 -0.41 1 81 ARG -2.00 0.13 1 82 VAL 3.00 -0.42 1 83 ASP -5.45 0.29 1 84 ASP 3.87 -0.34 1 85 ALA 4.00 -0.36 1 86 GLU 3.01 -0.31 1 87 VAL 7.19 -0.67 1 88 LEU 4.55 -0.49 1 89 SER 3.76 -0.47 1 90 VAL 6.77 -0.80 1 91 LEU 5.27 -0.36 1 94 LEU 3.67 -0.40 1 95 GLN 3.08 -0.02 1 96 ALA 3.78 -0.27 1 97 ALA 3.95 -0.14 1 98 GLU 0.98 0.34 1 99 ARG 3.49 -0.32 1 100 GLU -0.49 -0.04 1 103 VAL -4.98 0.70 1 104 LEU -6.35 0.76 1 109 HIS 3.37 0.13 1 111 ASN -1.16 -0.34 1 112 ASN 2.20 0.49 1 113 ARG 7.39 -0.91 1 116 LEU 4.68 -0.87 1 117 PHE 6.60 -0.88 1 118 ALA 3.14 -0.73 1 119 ALA 2.54 -0.22 1 120 MET 5.21 0.07 1 121 TYR 5.91 -0.89 1 122 ARG 2.30 -1.11 1 123 ILE 0.07 0.17 1 124 VAL 4.21 -0.65 1 125 VAL 5.48 -0.48 1 126 GLN -0.34 0.10 1 128 TRP 0.22 -0.16 1 129 ASP -1.77 -0.01 1 130 LYS 4.70 -0.62 1 131 GLN 5.25 -0.42 1 132 ALA 2.64 -0.03 1 133 ALA 2.56 0.00 1 134 LEU 3.03 -0.44 1 135 GLU 3.97 -0.39 1 137 MET 0.65 -0.81 1 138 GLN 0.94 0.03 1 139 ARG -0.37 0.38 1 142 PHE -0.81 0.01 1 144 ASP -2.75 0.20 1 145 GLU 4.11 -0.50 1 146 ASP 3.03 -0.29 1 147 ASP 0.94 -0.11 1 148 MET -1.56 0.52 1 151 ALA 3.25 -0.57 1 153 ALA 3.96 -0.41 1 154 TYR 5.13 -0.73 1 155 VAL 5.11 -0.94 1 156 ARG 5.36 -0.64 1 158 ALA 1.14 -0.46 1 159 ASP 0.35 0.01 1 160 VAL 6.09 -0.80 1 161 ASP 4.58 -0.32 1 165 LEU 3.50 -0.31 1 166 ALA 2.48 -0.23 1 167 MET 2.73 -0.28 1 168 ALA 1.92 -0.13 1 169 ASN 0.39 -0.08 1 175 SER 0.25 -0.68 1 177 PHE -0.18 -0.05 1 178 ALA -0.51 -0.07 1 179 LEU 0.42 -0.06 1 stop_ save_