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 bmr27275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.70 _LACS_plot.Line_1_terminator_val_y_1 -1.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.14 _LACS_plot.Line_2_terminator_val_x_2 8.14 _LACS_plot.Line_2_terminator_val_y_2 6.09 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 PHE 1.69 5.64 0 10 GLU 2.14 2.33 1 11 ARG 5.49 4.18 1 12 LEU 3.91 3.02 1 13 LYS 6.99 3.89 1 15 GLU 4.86 2.62 1 17 ASN 4.50 2.63 1 18 GLU 3.65 2.55 1 19 GLN 4.36 1.52 1 20 MET 4.36 2.15 1 21 LYS 3.93 3.36 1 22 VAL 0.77 -1.66 1 23 GLU 5.29 0.63 1 24 ASN -0.11 -2.74 1 25 PHE 4.14 2.83 1 26 GLU 4.63 3.84 1 27 ALA 2.84 2.01 1 28 ALA 4.79 3.99 1 29 VAL 7.19 6.16 1 30 HIS 4.61 4.32 1 32 TYR 2.46 1.12 1 34 LYS 3.21 2.04 1 35 ALA 6.03 3.37 1 36 ILE 3.32 3.62 1 37 GLU 2.30 2.37 1 38 LEU -0.37 1.32 1 39 ASN -0.32 -0.38 1 41 ALA -1.52 -1.87 1 42 ASN -1.26 -0.77 1 43 ALA 2.73 3.23 1 44 VAL 4.87 3.33 1 45 TYR 2.32 0.04 1 46 PHE 4.76 5.14 1 48 ASN 5.82 2.10 1 49 ARG 7.12 5.56 1 50 ALA 2.53 3.34 1 51 ALA 4.09 2.76 1 52 ALA 3.53 3.47 1 53 TYR 3.04 0.98 1 54 SER 5.08 4.79 1 55 LYS 4.02 0.99 1 56 LEU -0.78 0.07 1 58 ASN -0.38 -3.48 1 59 TYR 4.47 3.01 1 60 ALA 4.14 2.79 1 62 ALA 3.89 3.58 1 63 VAL 5.76 4.68 1 64 GLN 3.63 3.37 1 65 ASP 3.90 3.44 1 67 GLU 3.68 3.10 1 68 ARG 4.78 2.40 1 69 ALA 3.34 3.26 1 70 ILE 3.62 3.37 1 72 ILE 2.92 3.44 1 73 ASP -2.70 -1.53 1 75 ALA -0.65 -0.98 1 76 TYR 0.95 -1.59 1 78 LYS 2.94 2.74 1 79 ALA 2.57 2.83 1 80 TYR 5.68 4.27 1 82 ARG 5.42 2.77 1 83 MET 3.72 3.23 1 85 LEU 2.77 3.11 1 86 ALA 4.10 3.26 1 87 LEU 4.12 2.73 1 88 SER 6.25 5.04 1 89 SER 5.14 4.14 1 90 LEU -0.96 -0.51 1 91 ASN 3.69 1.40 1 92 LYS 1.05 -2.12 1 93 HIS 3.35 5.50 1 94 VAL 5.68 4.45 1 95 GLU 3.95 3.52 1 96 ALA 3.27 3.46 1 97 VAL 6.97 5.93 1 98 ALA 3.92 2.83 1 99 TYR 8.14 6.49 1 100 TYR 3.05 3.24 1 101 LYS 5.18 4.37 1 102 LYS 3.89 1.56 1 103 ALA 5.33 3.40 1 104 LEU 0.90 1.38 1 105 GLU 2.61 2.61 1 106 LEU -0.91 0.69 1 107 ASP -0.54 -0.50 1 109 ASP -0.23 -0.53 1 110 ASN 1.32 1.30 1 111 GLU 2.85 2.55 1 112 THR 6.52 4.76 1 113 TYR 2.94 -0.29 1 114 LYS 4.71 4.49 1 115 SER 4.22 3.28 1 116 ASN 4.01 2.70 1 117 LEU 4.75 3.60 1 118 LYS 4.49 3.15 1 119 ILE 4.58 4.09 1 120 ALA 3.10 2.89 1 121 GLU 3.48 3.47 1 122 LEU 3.62 2.93 1 123 LYS 3.32 1.44 1 124 LEU 2.14 1.69 1 125 ARG 1.28 0.98 1 126 GLU -0.40 -0.08 1 127 ALA 0.17 0.30 1 129 SER -0.30 0.05 1 131 THR 0.25 0.34 1 134 VAL 0.97 0.61 1 136 SER -0.25 0.05 1 140 ALA 2.06 1.44 1 152 ALA -0.17 0.05 1 153 SER 0.35 1.69 1 173 ASN -0.18 0.00 1 174 ASN -0.20 0.17 1 176 LEU 0.45 0.16 1 178 THR 0.00 0.08 1 181 THR -0.64 -0.14 1 182 SER -0.17 0.14 1 184 SER 0.02 0.30 1 185 GLN 0.70 0.59 1 186 ASN 0.49 0.58 1 187 ASP 0.56 0.58 1 188 LEU 1.03 0.70 1 189 ALA 0.64 0.45 1 190 SER 0.29 0.42 1 191 LEU 0.41 0.41 1 192 ILE 0.87 1.93 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.70 _LACS_plot.Line_1_terminator_val_y_1 1.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.86 _LACS_plot.Line_2_terminator_val_x_2 8.14 _LACS_plot.Line_2_terminator_val_y_2 -2.05 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 PHE 1.69 3.95 0 10 GLU 2.14 0.19 1 11 ARG 5.49 -1.31 1 12 LEU 3.91 -0.89 1 13 LYS 6.99 -3.10 1 15 GLU 4.86 -2.24 1 17 ASN 4.50 -1.87 1 18 GLU 3.65 -1.10 1 19 GLN 4.36 -2.84 1 20 MET 4.36 -2.21 1 21 LYS 3.93 -0.57 1 22 VAL 0.77 -2.43 1 23 GLU 5.29 -4.66 1 24 ASN -0.11 -2.63 1 25 PHE 4.14 -1.31 1 26 GLU 4.63 -0.79 1 27 ALA 2.84 -0.83 1 28 ALA 4.79 -0.80 1 29 VAL 7.19 -1.03 1 30 HIS 4.61 -0.29 1 32 TYR 2.46 -1.34 1 34 LYS 3.21 -1.17 1 35 ALA 6.03 -2.66 1 36 ILE 3.32 0.30 1 37 GLU 2.30 0.07 1 38 LEU -0.37 1.69 1 39 ASN -0.32 -0.06 1 41 ALA -1.52 -0.35 1 42 ASN -1.26 0.49 1 43 ALA 2.73 0.50 1 44 VAL 4.87 -1.54 1 45 TYR 2.32 -2.28 1 46 PHE 4.76 0.38 1 48 ASN 5.82 -3.72 1 49 ARG 7.12 -1.56 1 50 ALA 2.53 0.81 1 51 ALA 4.09 -1.33 1 52 ALA 3.53 -0.06 1 53 TYR 3.04 -2.06 1 54 SER 5.08 -0.29 1 55 LYS 4.02 -3.03 1 56 LEU -0.78 0.85 1 58 ASN -0.38 -3.10 1 59 TYR 4.47 -1.46 1 60 ALA 4.14 -1.35 1 62 ALA 3.89 -0.31 1 63 VAL 5.76 -1.08 1 64 GLN 3.63 -0.26 1 65 ASP 3.90 -0.46 1 67 GLU 3.68 -0.58 1 68 ARG 4.78 -2.38 1 69 ALA 3.34 -0.08 1 70 ILE 3.62 -0.25 1 72 ILE 2.92 0.52 1 73 ASP -2.70 1.17 1 75 ALA -0.65 -0.33 1 76 TYR 0.95 -2.54 1 78 LYS 2.94 -0.20 1 79 ALA 2.57 0.26 1 80 TYR 5.68 -1.41 1 82 ARG 5.42 -2.65 1 83 MET 3.72 -0.49 1 85 LEU 2.77 0.34 1 86 ALA 4.10 -0.84 1 87 LEU 4.12 -1.39 1 88 SER 6.25 -1.21 1 89 SER 5.14 -1.00 1 90 LEU -0.96 0.45 1 91 ASN 3.69 -2.29 1 92 LYS 1.05 -3.17 1 93 HIS 3.35 2.15 1 94 VAL 5.68 -1.23 1 95 GLU 3.95 -0.43 1 96 ALA 3.27 0.19 1 97 VAL 6.97 -1.04 1 98 ALA 3.92 -1.09 1 99 TYR 8.14 -1.65 1 100 TYR 3.05 0.19 1 101 LYS 5.18 -0.81 1 102 LYS 3.89 -2.33 1 103 ALA 5.33 -1.93 1 104 LEU 0.90 0.48 1 105 GLU 2.61 0.00 1 106 LEU -0.91 1.60 1 107 ASP -0.54 0.04 1 109 ASP -0.23 -0.30 1 110 ASN 1.32 -0.02 1 111 GLU 2.85 -0.30 1 112 THR 6.52 -1.76 1 113 TYR 2.94 -3.23 1 114 LYS 4.71 -0.22 1 115 SER 4.22 -0.94 1 116 ASN 4.01 -1.31 1 117 LEU 4.75 -1.15 1 118 LYS 4.49 -1.34 1 119 ILE 4.58 -0.49 1 120 ALA 3.10 -0.21 1 121 GLU 3.48 -0.01 1 122 LEU 3.62 -0.69 1 123 LYS 3.32 -1.88 1 124 LEU 2.14 -0.45 1 125 ARG 1.28 -0.30 1 126 GLU -0.40 0.32 1 127 ALA 0.17 0.13 1 129 SER -0.30 0.35 1 131 THR 0.25 0.09 1 134 VAL 0.97 -0.36 1 136 SER -0.25 0.30 1 140 ALA 2.06 -0.62 1 152 ALA -0.17 0.22 1 153 SER 0.35 1.34 1 173 ASN -0.18 0.18 1 174 ASN -0.20 0.37 1 176 LEU 0.45 -0.29 1 178 THR 0.00 0.08 1 181 THR -0.64 0.50 1 182 SER -0.17 0.31 1 184 SER 0.02 0.28 1 185 GLN 0.70 -0.11 1 186 ASN 0.49 0.09 1 187 ASP 0.56 0.02 1 188 LEU 1.03 -0.33 1 189 ALA 0.64 -0.19 1 190 SER 0.29 0.13 1 191 LEU 0.41 0.00 1 192 ILE 0.87 1.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27275_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.70 _LACS_plot.Line_1_terminator_val_y_1 -1.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 8.14 _LACS_plot.Line_2_terminator_val_y_2 3.78 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 GLU 5.29 -2.30 0 10 GLU 2.14 2.84 1 11 ARG 5.49 3.49 1 12 LEU 3.91 1.47 1 13 LYS 6.99 1.55 1 15 GLU 4.86 3.32 1 17 ASN 4.50 3.93 1 18 GLU 3.65 3.01 1 19 GLN 4.36 3.06 1 20 MET 4.36 4.50 1 21 LYS 3.93 1.68 1 22 VAL 0.77 -1.58 1 24 ASN -0.11 0.83 1 25 PHE 4.14 2.16 1 26 GLU 4.63 2.80 1 27 ALA 2.84 2.01 1 28 ALA 4.79 0.20 1 29 VAL 7.19 2.68 1 30 HIS 4.61 3.90 1 31 PHE 1.69 2.75 1 32 TYR 2.46 2.59 1 34 LYS 3.21 2.28 1 35 ALA 6.03 0.82 1 36 ILE 3.32 0.66 1 37 GLU 2.30 2.37 1 38 LEU -0.37 0.46 1 39 ASN -0.32 -1.81 1 41 ALA -1.52 -2.26 1 42 ASN -1.26 0.04 1 43 ALA 2.73 1.27 1 44 VAL 4.87 2.45 1 45 TYR 2.32 2.49 1 46 PHE 4.76 1.70 1 48 ASN 5.82 2.26 1 49 ARG 7.12 1.32 1 50 ALA 2.53 2.74 1 51 ALA 4.09 2.36 1 52 ALA 3.53 1.45 1 53 TYR 3.04 4.19 1 54 SER 5.08 2.49 1 55 LYS 4.02 1.84 1 56 LEU -0.78 -0.38 1 58 ASN -0.38 0.34 1 59 TYR 4.47 1.83 1 60 ALA 4.14 2.93 1 62 ALA 3.89 1.40 1 63 VAL 5.76 -1.20 1 65 ASP 3.90 3.34 1 67 GLU 3.68 2.62 1 68 ARG 4.78 1.98 1 69 ALA 3.34 0.15 1 70 ILE 3.62 0.84 1 72 ILE 2.92 0.31 1 73 ASP -2.70 -1.78 1 75 ALA -0.65 -1.12 1 76 TYR 0.95 0.40 1 78 LYS 2.94 1.88 1 79 ALA 2.57 1.25 1 80 TYR 5.68 2.28 1 82 ARG 5.42 1.47 1 83 MET 3.72 1.81 1 85 LEU 2.77 2.82 1 86 ALA 4.10 1.21 1 87 LEU 4.12 2.96 1 88 SER 6.25 3.85 1 89 SER 5.14 -0.08 1 90 LEU -0.96 -2.17 1 91 ASN 3.69 -0.78 1 92 LYS 1.05 -0.19 1 93 HIS 3.35 3.77 1 94 VAL 5.68 2.51 1 95 GLU 3.95 2.03 1 96 ALA 3.27 1.46 1 97 VAL 6.97 0.72 1 98 ALA 3.92 3.38 1 99 TYR 8.14 2.48 1 100 TYR 3.05 3.06 1 101 LYS 5.18 2.81 1 102 LYS 3.89 1.46 1 103 ALA 5.33 1.39 1 104 LEU 0.90 1.24 1 105 GLU 2.61 2.41 1 106 LEU -0.91 -0.48 1 107 ASP -0.54 1.14 1 109 ASP -0.23 -0.47 1 110 ASN 1.32 0.50 1 111 GLU 2.85 2.41 1 112 THR 6.52 2.08 1 113 TYR 2.94 2.50 1 114 LYS 4.71 2.79 1 116 ASN 4.01 2.55 1 117 LEU 4.75 -0.65 1 118 LYS 4.49 2.90 1 119 ILE 4.58 1.60 1 120 ALA 3.10 2.12 1 121 GLU 3.48 3.54 1 122 LEU 3.62 2.41 1 123 LYS 3.32 2.58 1 124 LEU 2.14 0.64 1 125 ARG 1.28 0.64 1 126 GLU -0.40 -0.61 1 127 ALA 0.17 -0.62 1 129 SER -0.30 0.38 1 131 THR 0.25 0.67 1 134 VAL 0.97 0.54 1 136 SER -0.25 -0.54 1 140 ALA 2.06 1.24 1 152 ALA -0.17 -0.92 1 173 ASN -0.18 -0.65 1 174 ASN -0.20 0.05 1 176 LEU 0.45 0.35 1 178 THR 0.00 -0.04 1 181 THR -0.64 -0.18 1 182 SER -0.17 -0.26 1 184 SER 0.02 0.27 1 185 GLN 0.70 -0.01 1 186 ASN 0.49 -0.08 1 187 ASP 0.56 0.36 1 188 LEU 1.03 0.13 1 189 ALA 0.64 0.19 1 190 SER 0.29 0.01 1 191 LEU 0.41 -1.19 1 192 ILE 0.87 4.64 1 stop_ save_