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 bmr30185_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -0.17 _LACS_plot.Line_1_terminator_val_y_1 -0.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.57 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 4.76 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 46 HIS 3.46 5.45 0 11 ASP 3.93 2.90 1 12 GLU 3.36 2.92 1 13 LEU 3.43 3.16 1 14 VAL 6.00 4.70 1 15 GLN 4.36 3.00 1 16 ALA 3.48 2.51 1 17 PHE 5.42 4.58 1 18 GLN 5.10 3.22 1 19 ARG 4.52 3.41 1 20 LEU 4.27 3.05 1 21 ARG 5.17 3.46 1 22 GLU 3.14 2.59 1 23 ILE 4.35 3.62 1 24 PHE 4.07 3.42 1 25 ASP 2.93 2.46 1 26 LYS 0.55 0.46 1 29 ASP 2.83 2.26 1 30 ASP 2.90 2.14 1 31 SER 1.93 1.39 1 32 LEU 3.21 3.23 1 33 GLU 4.32 3.50 1 34 GLN 4.31 3.22 1 35 VAL 4.85 3.05 1 36 LEU 4.28 3.21 1 37 GLU 3.40 2.70 1 38 GLU 3.13 2.75 1 39 ILE 5.87 4.95 1 40 GLU 4.25 3.64 1 41 GLU 3.18 2.48 1 42 LEU 2.20 2.83 1 43 ILE 5.36 3.26 1 44 GLN 4.79 2.95 1 45 LYS 3.50 2.99 1 47 ARG 3.91 2.81 1 48 GLN 3.38 2.34 1 49 LEU 1.15 1.38 1 50 PHE 1.27 1.27 1 51 ASP 1.29 0.77 1 52 ASN 0.57 0.23 1 53 ARG 1.12 0.35 1 54 GLN 0.95 0.37 1 55 GLU 0.17 0.02 1 56 ALA 0.15 0.07 1 57 ALA 0.25 0.01 1 58 ASP 0.20 -0.16 1 59 THR 1.22 1.00 1 60 GLU 1.92 1.27 1 61 ALA 1.71 1.20 1 62 ALA 1.65 1.10 1 63 LYS 2.12 1.35 1 64 GLN 2.09 1.30 1 67 GLN 4.00 2.45 1 68 TRP 2.61 2.06 1 69 VAL 5.57 4.47 1 70 GLN 4.01 2.67 1 71 LEU 3.81 3.16 1 72 PHE 6.22 4.79 1 73 GLN 5.18 3.48 1 74 ARG 4.10 3.61 1 75 PHE 4.46 4.77 1 76 ARG 5.79 4.44 1 77 GLU 2.93 2.47 1 78 ALA 4.11 2.66 1 79 ILE 4.82 4.02 1 80 ASP 3.38 3.18 1 81 LYS -0.17 -0.10 1 84 LYS 3.60 2.95 1 85 ASP 4.18 3.12 1 86 SER 4.40 2.85 1 87 LEU 3.75 3.28 1 88 GLU 3.89 3.49 1 89 GLN 3.93 2.79 1 90 LEU 3.52 2.45 1 91 LEU 4.54 3.61 1 92 GLU 3.33 2.66 1 93 GLU 3.56 3.11 1 94 LEU 3.67 2.99 1 95 GLU 4.58 3.68 1 96 GLN 3.92 2.79 1 97 ALA 3.45 2.52 1 98 LEU 3.09 1.95 1 99 GLN 4.84 2.95 1 100 LYS 3.86 2.56 1 101 ILE 4.35 3.11 1 102 ARG 4.07 3.37 1 103 GLU 2.60 2.10 1 104 LEU 2.14 1.78 1 105 ALA 0.93 1.05 1 106 GLU -0.05 0.01 1 107 LYS 1.02 0.47 1 108 LYS -0.05 -0.32 1 109 ASN 0.21 1.56 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30185_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -0.17 _LACS_plot.Line_1_terminator_val_y_1 -0.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.43 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 -1.46 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 46 HIS 3.46 1.99 0 11 ASP 3.93 -1.03 1 12 GLU 3.36 -0.44 1 13 LEU 3.43 -0.27 1 14 VAL 6.00 -1.30 1 15 GLN 4.36 -1.36 1 16 ALA 3.48 -0.97 1 17 PHE 5.42 -0.84 1 18 GLN 5.10 -1.88 1 19 ARG 4.52 -1.11 1 20 LEU 4.27 -1.22 1 21 ARG 5.17 -1.71 1 22 GLU 3.14 -0.55 1 23 ILE 4.35 -0.73 1 24 PHE 4.07 -0.65 1 25 ASP 2.93 -0.47 1 26 LYS 0.55 -0.09 1 29 ASP 2.83 -0.57 1 30 ASP 2.90 -0.76 1 31 SER 1.93 -0.54 1 32 LEU 3.21 0.02 1 33 GLU 4.32 -0.82 1 34 GLN 4.31 -1.09 1 35 VAL 4.85 -1.80 1 36 LEU 4.28 -1.07 1 37 GLU 3.40 -0.70 1 38 GLU 3.13 -0.38 1 39 ILE 5.87 -0.92 1 40 GLU 4.25 -0.61 1 41 GLU 3.18 -0.70 1 42 LEU 2.20 0.63 1 43 ILE 5.36 -2.10 1 44 GLN 4.79 -1.84 1 45 LYS 3.50 -0.51 1 47 ARG 3.91 -1.10 1 48 GLN 3.38 -1.04 1 49 LEU 1.15 0.23 1 50 PHE 1.27 0.00 1 51 ASP 1.29 -0.52 1 52 ASN 0.57 -0.34 1 53 ARG 1.12 -0.77 1 54 GLN 0.95 -0.58 1 55 GLU 0.17 -0.15 1 56 ALA 0.15 -0.08 1 57 ALA 0.25 -0.24 1 58 ASP 0.20 -0.36 1 59 THR 1.22 -0.22 1 60 GLU 1.92 -0.65 1 61 ALA 1.71 -0.51 1 62 ALA 1.65 -0.55 1 63 LYS 2.12 -0.77 1 64 GLN 2.09 -0.79 1 67 GLN 4.00 -1.55 1 68 TRP 2.61 -0.55 1 69 VAL 5.57 -1.10 1 70 GLN 4.01 -1.34 1 71 LEU 3.81 -0.65 1 72 PHE 6.22 -1.43 1 73 GLN 5.18 -1.70 1 74 ARG 4.10 -0.49 1 75 PHE 4.46 0.31 1 76 ARG 5.79 -1.35 1 77 GLU 2.93 -0.46 1 78 ALA 4.11 -1.45 1 79 ILE 4.82 -0.80 1 80 ASP 3.38 -0.20 1 81 LYS -0.17 0.07 1 84 LYS 3.60 -0.65 1 85 ASP 4.18 -1.06 1 86 SER 4.40 -1.55 1 87 LEU 3.75 -0.47 1 88 GLU 3.89 -0.40 1 89 GLN 3.93 -1.14 1 90 LEU 3.52 -1.07 1 91 LEU 4.54 -0.93 1 92 GLU 3.33 -0.67 1 93 GLU 3.56 -0.45 1 94 LEU 3.67 -0.68 1 95 GLU 4.58 -0.90 1 96 GLN 3.92 -1.13 1 97 ALA 3.45 -0.93 1 98 LEU 3.09 -1.14 1 99 GLN 4.84 -1.89 1 100 LYS 3.86 -1.30 1 101 ILE 4.35 -1.24 1 102 ARG 4.07 -0.70 1 103 GLU 2.60 -0.50 1 104 LEU 2.14 -0.36 1 105 ALA 0.93 0.12 1 106 GLU -0.05 0.06 1 107 LYS 1.02 -0.55 1 108 LYS -0.05 -0.27 1 109 ASN 0.21 1.35 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30185_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -0.17 _LACS_plot.Line_1_terminator_val_y_1 -0.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.05 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _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 95 GLU 4.58 -1.15 0 11 ASP 3.93 -0.19 1 12 GLU 3.36 -0.39 1 13 LEU 3.43 -0.40 1 14 VAL 6.00 -0.51 1 15 GLN 4.36 -0.29 1 16 ALA 3.48 -0.24 1 17 PHE 5.42 -0.65 1 18 GLN 5.10 -0.43 1 19 ARG 4.52 -0.27 1 20 LEU 4.27 -0.49 1 21 ARG 5.17 -0.55 1 22 GLU 3.14 -0.25 1 23 ILE 4.35 -0.42 1 24 PHE 4.07 -0.36 1 25 ASP 2.93 -0.35 1 26 LYS 0.55 -0.09 1 29 ASP 2.83 -0.35 1 30 ASP 2.90 -0.17 1 31 SER 1.93 0.03 1 32 LEU 3.21 -0.46 1 33 GLU 4.32 -0.53 1 34 GLN 4.31 -0.29 1 35 VAL 4.85 -0.14 1 36 LEU 4.28 -0.44 1 37 GLU 3.40 -0.36 1 38 GLU 3.13 -0.35 1 39 ILE 5.87 -0.73 1 40 GLU 4.25 -0.98 1 41 GLU 3.18 -0.37 1 42 LEU 2.20 -0.32 1 43 ILE 5.36 -0.69 1 44 GLN 4.79 -0.34 1 45 LYS 3.50 -0.35 1 46 HIS 3.46 -0.69 1 47 ARG 3.91 -0.35 1 48 GLN 3.38 -0.26 1 49 LEU 1.15 -0.26 1 50 PHE 1.27 -0.25 1 51 ASP 1.29 -0.12 1 52 ASN 0.57 -0.09 1 53 ARG 1.12 -0.34 1 54 GLN 0.95 -0.13 1 55 GLU 0.17 -0.13 1 56 ALA 0.15 -0.06 1 57 ALA 0.25 -0.05 1 58 ASP 0.20 0.01 1 59 THR 1.22 -0.11 1 60 GLU 1.92 -0.21 1 61 ALA 1.71 -0.21 1 62 ALA 1.65 -0.17 1 63 LYS 2.12 -0.14 1 64 GLN 2.09 -0.21 1 67 GLN 4.00 -0.34 1 68 TRP 2.61 -0.30 1 69 VAL 5.57 -0.33 1 70 GLN 4.01 -0.24 1 71 LEU 3.81 -0.35 1 72 PHE 6.22 -0.18 1 73 GLN 5.18 -0.25 1 74 ARG 4.10 -0.29 1 75 PHE 4.46 -0.58 1 76 ARG 5.79 -0.52 1 77 GLU 2.93 -0.26 1 78 ALA 4.11 -0.12 1 79 ILE 4.82 -0.54 1 80 ASP 3.38 -0.29 1 81 LYS -0.17 -0.07 1 84 LYS 3.60 -0.32 1 85 ASP 4.18 -0.20 1 86 SER 4.40 -0.24 1 87 LEU 3.75 -0.61 1 88 GLU 3.89 -0.63 1 89 GLN 3.93 -0.27 1 90 LEU 3.52 -0.51 1 91 LEU 4.54 -0.28 1 92 GLU 3.33 -0.18 1 93 GLU 3.56 -0.43 1 94 LEU 3.67 -0.30 1 96 GLN 3.92 -0.37 1 97 ALA 3.45 -0.24 1 98 LEU 3.09 -0.34 1 99 GLN 4.84 -0.43 1 100 LYS 3.86 -0.26 1 101 ILE 4.35 -0.28 1 102 ARG 4.07 -0.37 1 103 GLU 2.60 -0.32 1 104 LEU 2.14 -0.20 1 105 ALA 0.93 -0.19 1 106 GLU -0.05 -0.16 1 107 LYS 1.02 -0.07 1 108 LYS -0.05 -0.02 1 109 ASN 0.21 -0.32 1 stop_ save_