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 bmr17357_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.17 _LACS_plot.Line_1_terminator_val_y_1 -3.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 9.01 _LACS_plot.Line_2_terminator_val_y_2 6.79 _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 125 LYS 3.90 -0.40 0 69 LYS 5.00 0.42 0 100 GLU 3.24 5.90 0 13 LEU 0.35 0.10 1 14 SER 0.20 0.05 1 17 LEU 0.13 -0.07 1 20 THR -0.08 -0.07 1 21 GLU 0.14 0.19 1 22 ASN 0.09 0.09 1 23 SER 0.38 0.23 1 24 ASP 0.71 0.42 1 25 GLN 0.47 0.40 1 26 ALA 0.51 0.18 1 27 ARG 0.10 0.04 1 28 ASP 0.15 0.11 1 30 THR 0.30 0.36 1 31 LEU -0.26 -0.20 1 33 TYR 0.30 -0.12 1 34 THR -0.61 -0.51 1 35 LYS 1.09 0.61 1 37 ARG 4.56 4.02 1 38 PHE 4.54 4.02 1 39 TYR -2.17 -0.14 1 41 GLN -0.69 -0.37 1 43 LEU -4.17 -1.40 1 46 THR 6.69 4.82 1 47 GLU 2.37 2.78 1 48 ALA 3.78 2.74 1 49 ALA 3.91 2.67 1 50 GLN 4.20 2.65 1 56 ALA 4.11 2.86 1 57 SER 4.75 3.70 1 59 ILE 6.59 4.36 1 60 LEU 4.70 2.74 1 61 ASN 1.55 0.89 1 62 VAL 2.16 1.05 1 63 LYS 4.18 2.61 1 64 GLN 4.60 2.46 1 65 PHE 1.79 1.32 1 66 ILE 5.60 4.37 1 68 ARG -0.51 -0.48 1 70 ALA -1.91 -3.62 1 71 TRP 5.89 4.60 1 80 LEU 3.13 3.07 1 81 ARG 3.13 1.83 1 82 ALA 3.39 3.15 1 83 SER 4.57 3.53 1 85 LEU 4.63 3.80 1 86 ARG 5.29 4.34 1 87 TYR -1.33 -1.59 1 88 ASP 2.56 3.72 1 89 LEU 2.41 3.21 1 90 LYS 6.24 3.19 1 91 THR -0.20 0.08 1 94 SER 3.98 3.14 1 95 ALA -1.68 -1.06 1 96 LYS -1.90 -2.93 1 101 LYS 4.84 4.63 1 102 LYS 4.30 3.42 1 103 SER 4.29 3.06 1 104 LEU 3.25 2.68 1 105 GLN 4.87 3.80 1 106 GLU 3.78 3.02 1 107 LEU 2.44 2.56 1 108 THR 7.25 5.54 1 111 LEU 4.12 2.73 1 112 PHE 7.28 4.98 1 113 SER 3.66 3.81 1 118 LEU 4.16 2.85 1 119 ASP 2.80 3.79 1 120 HIS 5.33 5.15 1 121 ALA 3.17 2.02 1 122 ALA 1.00 1.17 1 123 LYS 4.27 3.36 1 124 ILE 1.65 -0.04 1 126 SER -3.92 -3.30 1 128 THR 5.38 3.35 1 129 GLU 2.28 2.06 1 130 ALA 3.58 2.77 1 131 GLU 3.96 3.51 1 132 LYS 4.07 3.15 1 133 TYR 6.44 4.67 1 134 TYR 5.85 5.19 1 136 GLN 3.88 3.39 1 137 THR 9.01 6.87 1 141 ILE 6.41 3.96 1 142 ASN 4.84 3.42 1 143 GLU 2.98 3.04 1 144 VAL 6.13 4.80 1 145 LEU 4.59 3.06 1 146 ALA 2.94 1.85 1 147 LYS -0.25 -0.73 1 148 LEU 0.81 0.74 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17357_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.17 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 9.01 _LACS_plot.Line_2_terminator_val_y_2 -2.22 _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 125 LYS 3.90 -4.30 0 69 LYS 5.00 -4.58 0 100 GLU 3.24 2.66 0 13 LEU 0.35 -0.25 1 14 SER 0.20 -0.15 1 17 LEU 0.13 -0.20 1 20 THR -0.08 0.01 1 21 GLU 0.14 0.05 1 22 ASN 0.09 0.00 1 23 SER 0.38 -0.15 1 24 ASP 0.71 -0.29 1 25 GLN 0.47 -0.07 1 26 ALA 0.51 -0.33 1 27 ARG 0.10 -0.06 1 28 ASP 0.15 -0.04 1 30 THR 0.30 0.06 1 31 LEU -0.26 0.06 1 33 TYR 0.30 -0.42 1 34 THR -0.61 0.10 1 35 LYS 1.09 -0.48 1 37 ARG 4.56 -0.54 1 38 PHE 4.54 -0.52 1 39 TYR -2.17 2.03 1 41 GLN -0.69 0.32 1 43 LEU -4.17 2.77 1 46 THR 6.69 -1.87 1 47 GLU 2.37 0.41 1 48 ALA 3.78 -1.04 1 49 ALA 3.91 -1.24 1 50 GLN 4.20 -1.55 1 56 ALA 4.11 -1.25 1 57 SER 4.75 -1.05 1 59 ILE 6.59 -2.23 1 60 LEU 4.70 -1.96 1 61 ASN 1.55 -0.66 1 62 VAL 2.16 -1.11 1 63 LYS 4.18 -1.57 1 64 GLN 4.60 -2.14 1 65 PHE 1.79 -0.47 1 66 ILE 5.60 -1.23 1 68 ARG -0.51 0.03 1 70 ALA -1.91 -1.71 1 71 TRP 5.89 -1.29 1 80 LEU 3.13 -0.06 1 81 ARG 3.13 -1.30 1 82 ALA 3.39 -0.24 1 83 SER 4.57 -1.04 1 85 LEU 4.63 -0.83 1 86 ARG 5.29 -0.95 1 87 TYR -1.33 -0.26 1 88 ASP 2.56 1.16 1 89 LEU 2.41 0.80 1 90 LYS 6.24 -3.05 1 91 THR -0.20 0.28 1 94 SER 3.98 -0.84 1 95 ALA -1.68 0.62 1 96 LYS -1.90 -1.03 1 101 LYS 4.84 -0.21 1 102 LYS 4.30 -0.88 1 103 SER 4.29 -1.23 1 104 LEU 3.25 -0.57 1 105 GLN 4.87 -1.07 1 106 GLU 3.78 -0.76 1 107 LEU 2.44 0.12 1 108 THR 7.25 -1.71 1 111 LEU 4.12 -1.39 1 112 PHE 7.28 -2.30 1 113 SER 3.66 0.15 1 118 LEU 4.16 -1.31 1 119 ASP 2.80 0.99 1 120 HIS 5.33 -0.18 1 121 ALA 3.17 -1.15 1 122 ALA 1.00 0.17 1 123 LYS 4.27 -0.91 1 124 ILE 1.65 -1.69 1 126 SER -3.92 0.62 1 128 THR 5.38 -2.03 1 129 GLU 2.28 -0.22 1 130 ALA 3.58 -0.81 1 131 GLU 3.96 -0.45 1 132 LYS 4.07 -0.92 1 133 TYR 6.44 -1.77 1 134 TYR 5.85 -0.66 1 136 GLN 3.88 -0.49 1 137 THR 9.01 -2.14 1 141 ILE 6.41 -2.45 1 142 ASN 4.84 -1.42 1 143 GLU 2.98 0.06 1 144 VAL 6.13 -1.33 1 145 LEU 4.59 -1.53 1 146 ALA 2.94 -1.09 1 147 LYS -0.25 -0.48 1 148 LEU 0.81 -0.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17357_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.91 _LACS_plot.Line_1_terminator_val_y_1 0.10 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 7.28 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _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 141 ILE 6.41 0.26 0 13 LEU 0.35 -0.02 1 14 SER 0.20 -0.05 1 20 THR -0.08 -0.05 1 21 GLU 0.14 -0.08 1 22 ASN 0.09 -0.01 1 23 SER 0.38 -0.05 1 24 ASP 0.71 -0.09 1 25 GLN 0.47 -0.11 1 26 ALA 0.51 -0.09 1 27 ARG 0.10 -0.05 1 28 ASP 0.15 -0.09 1 30 THR 0.30 -0.13 1 33 TYR 0.30 0.00 1 34 THR -0.61 -0.43 1 37 ARG 4.56 -0.56 1 46 THR 6.69 -0.37 1 47 GLU 2.37 -0.21 1 48 ALA 3.78 -0.33 1 49 ALA 3.91 -0.48 1 56 ALA 4.11 -0.34 1 59 ILE 6.59 -0.40 1 60 LEU 4.70 -0.16 1 61 ASN 1.55 0.14 1 62 VAL 2.16 0.33 1 63 LYS 4.18 -0.14 1 64 GLN 4.60 -0.27 1 65 PHE 1.79 -0.30 1 68 ARG -0.51 -0.07 1 69 LYS 5.00 -0.23 1 70 ALA -1.91 0.25 1 80 LEU 3.13 -0.44 1 81 ARG 3.13 -0.44 1 82 ALA 3.39 -0.15 1 85 LEU 4.63 -0.56 1 86 ARG 5.29 -0.55 1 87 TYR -1.33 -0.21 1 88 ASP 2.56 -0.20 1 89 LEU 2.41 -0.36 1 94 SER 3.98 -0.39 1 95 ALA -1.68 0.22 1 100 GLU 3.24 0.16 1 101 LYS 4.84 -0.56 1 102 LYS 4.30 -0.30 1 103 SER 4.29 -0.19 1 104 LEU 3.25 -0.12 1 106 GLU 3.78 -0.23 1 107 LEU 2.44 -0.22 1 111 LEU 4.12 -0.25 1 112 PHE 7.28 -0.34 1 118 LEU 4.16 -0.11 1 119 ASP 2.80 -0.54 1 120 HIS 5.33 -0.61 1 121 ALA 3.17 -0.25 1 122 ALA 1.00 -0.13 1 123 LYS 4.27 -0.54 1 124 ILE 1.65 -0.07 1 128 THR 5.38 -0.21 1 129 GLU 2.28 0.11 1 130 ALA 3.58 -0.27 1 131 GLU 3.96 -0.30 1 132 LYS 4.07 -0.34 1 133 TYR 6.44 -0.10 1 134 TYR 5.85 -0.40 1 136 GLN 3.88 -0.24 1 142 ASN 4.84 -0.31 1 143 GLU 2.98 -0.23 1 144 VAL 6.13 -0.65 1 145 LEU 4.59 -0.47 1 146 ALA 2.94 -0.13 1 147 LYS -0.25 0.03 1 148 LEU 0.81 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17357_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.17 _LACS_plot.Line_1_terminator_val_y_1 -1.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.95 _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 7.28 _LACS_plot.Line_2_terminator_val_y_2 2.54 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 LYS 5.00 -2.46 0 13 LEU 0.35 0.07 1 14 SER 0.20 0.41 1 17 LEU 0.13 -0.23 1 20 THR -0.08 0.21 1 21 GLU 0.14 -0.30 1 22 ASN 0.09 0.21 1 23 SER 0.38 0.00 1 24 ASP 0.71 0.20 1 25 GLN 0.47 0.01 1 26 ALA 0.51 0.20 1 27 ARG 0.10 -0.04 1 28 ASP 0.15 0.57 1 30 THR 0.30 -0.15 1 31 LEU -0.26 -0.35 1 33 TYR 0.30 0.01 1 34 THR -0.61 -0.34 1 37 ARG 4.56 1.71 1 38 PHE 4.54 2.58 1 41 GLN -0.69 -0.57 1 43 LEU -4.17 -1.03 1 46 THR 6.69 1.97 1 47 GLU 2.37 2.69 1 48 ALA 3.78 1.37 1 49 ALA 3.91 0.99 1 56 ALA 4.11 1.06 1 59 ILE 6.59 1.16 1 60 LEU 4.70 2.97 1 61 ASN 1.55 1.30 1 62 VAL 2.16 0.70 1 63 LYS 4.18 0.62 1 64 GLN 4.60 1.28 1 65 PHE 1.79 2.13 1 66 ILE 5.60 -1.59 1 68 ARG -0.51 -1.61 1 70 ALA -1.91 -0.37 1 71 TRP 5.89 0.29 1 80 LEU 3.13 1.03 1 81 ARG 3.13 3.11 1 82 ALA 3.39 1.61 1 85 LEU 4.63 -0.26 1 86 ARG 5.29 1.76 1 87 TYR -1.33 1.70 1 88 ASP 2.56 1.96 1 89 LEU 2.41 0.47 1 90 LYS 6.24 3.07 1 91 THR -0.20 -0.84 1 94 SER 3.98 -0.34 1 95 ALA -1.68 -0.01 1 96 LYS -1.90 -2.52 1 100 GLU 3.24 0.68 1 101 LYS 4.84 1.65 1 102 LYS 4.30 2.43 1 103 SER 4.29 3.07 1 104 LEU 3.25 2.28 1 105 GLN 4.87 2.83 1 106 GLU 3.78 3.09 1 107 LEU 2.44 2.06 1 111 LEU 4.12 0.32 1 112 PHE 7.28 2.17 1 118 LEU 4.16 -0.79 1 119 ASP 2.80 2.01 1 120 HIS 5.33 2.47 1 121 ALA 3.17 0.44 1 122 ALA 1.00 1.94 1 123 LYS 4.27 2.23 1 124 ILE 1.65 -1.56 1 125 LYS 3.90 -1.79 1 126 SER -3.92 0.38 1 128 THR 5.38 4.06 1 129 GLU 2.28 1.52 1 130 ALA 3.58 1.35 1 131 GLU 3.96 3.11 1 132 LYS 4.07 3.45 1 133 TYR 6.44 3.27 1 134 TYR 5.85 0.48 1 136 GLN 3.88 1.68 1 141 ILE 6.41 0.84 1 142 ASN 4.84 3.56 1 143 GLU 2.98 2.44 1 144 VAL 6.13 1.61 1 145 LEU 4.59 2.50 1 146 ALA 2.94 1.68 1 147 LYS -0.25 1.00 1 148 LEU 0.81 -0.60 1 stop_ save_