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 bmr30097_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.15 _LACS_plot.Line_1_terminator_val_y_1 -0.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.34 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 4.66 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 HIS 3.95 4.40 0 10 GLU -0.66 -0.11 1 11 ILE 0.74 0.46 1 12 THR 0.15 0.06 1 13 SER -0.31 -0.12 1 14 SER -0.23 0.05 1 16 GLN 0.43 0.54 1 18 LEU 0.82 0.36 1 19 ASP 0.55 0.48 1 20 ASN -0.29 -0.13 1 22 ALA 3.87 2.91 1 23 LEU 2.73 2.21 1 24 LEU 3.42 2.87 1 25 ARG 5.49 3.73 1 26 ASP 4.39 3.25 1 27 MET 4.14 3.79 1 28 LEU 2.45 2.98 1 29 LEU 2.56 1.79 1 30 ALA -0.57 -0.19 1 31 ASN -2.15 -0.98 1 34 GLU 2.72 1.93 1 35 LEU 4.85 3.35 1 36 SER 5.82 4.25 1 37 LEU 3.02 2.50 1 38 LEU 3.19 2.98 1 39 LYS 4.13 3.77 1 40 GLU 0.61 1.43 1 41 ARG 0.86 1.63 1 42 ASN -0.92 -1.19 1 45 LEU 1.81 2.05 1 46 ALA 4.04 3.04 1 47 GLU 3.34 2.84 1 48 ALA 3.35 2.77 1 49 LEU 4.10 3.50 1 50 LEU 2.75 1.55 1 51 SER 1.98 2.43 1 53 ASP -2.14 -1.51 1 54 LEU 3.62 2.82 1 55 GLU 4.15 3.07 1 56 LYS 4.11 3.48 1 57 PHE 3.66 3.70 1 58 SER 4.52 3.76 1 59 ARG 4.42 3.51 1 60 VAL 6.08 4.33 1 61 LEU 3.74 3.45 1 62 VAL 5.29 4.24 1 63 GLU 3.62 3.10 1 64 GLN 5.30 3.48 1 65 GLN 4.40 3.04 1 66 GLN 3.92 2.72 1 67 ASP 2.44 2.80 1 68 ARG 4.30 3.43 1 69 ALA 3.19 2.22 1 70 ARG 3.68 2.87 1 71 ARG 3.36 2.69 1 72 GLU 2.38 1.88 1 73 GLN 2.90 2.15 1 74 GLU 1.61 1.50 1 75 ARG 2.73 2.16 1 76 ILE 2.18 1.70 1 77 ARG 1.73 1.36 1 78 LEU 0.86 0.79 1 79 PHE 0.48 0.29 1 80 SER -0.18 0.04 1 81 ALA -0.57 -0.22 1 82 ASP -0.44 0.09 1 84 PHE 0.87 0.25 1 85 ASP 0.14 0.06 1 86 LEU 1.60 1.37 1 87 GLU 1.10 0.89 1 88 ALA 0.96 0.77 1 89 GLN 0.75 0.54 1 90 ALA 0.50 0.39 1 91 LYS 0.35 0.22 1 92 ILE 0.64 0.42 1 93 GLU -0.30 0.06 1 94 GLU -0.48 0.18 1 95 ASP 0.24 0.22 1 96 ILE 0.48 0.15 1 97 ARG 0.22 0.02 1 98 GLN 0.58 1.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30097_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.15 _LACS_plot.Line_1_terminator_val_y_1 1.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.66 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 -1.42 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 HIS 3.95 0.45 0 10 GLU -0.66 0.55 1 11 ILE 0.74 -0.28 1 12 THR 0.15 -0.09 1 13 SER -0.31 0.19 1 14 SER -0.23 0.28 1 16 GLN 0.43 0.11 1 18 LEU 0.82 -0.46 1 19 ASP 0.55 -0.07 1 20 ASN -0.29 0.16 1 22 ALA 3.87 -0.96 1 23 LEU 2.73 -0.52 1 24 LEU 3.42 -0.55 1 25 ARG 5.49 -1.76 1 26 ASP 4.39 -1.14 1 27 MET 4.14 -0.35 1 28 LEU 2.45 0.53 1 29 LEU 2.56 -0.77 1 30 ALA -0.57 0.38 1 31 ASN -2.15 1.17 1 34 GLU 2.72 -0.79 1 35 LEU 4.85 -1.50 1 36 SER 5.82 -1.57 1 37 LEU 3.02 -0.52 1 38 LEU 3.19 -0.21 1 39 LYS 4.13 -0.36 1 40 GLU 0.61 0.82 1 41 ARG 0.86 0.77 1 42 ASN -0.92 -0.27 1 45 LEU 1.81 0.24 1 46 ALA 4.04 -1.00 1 47 GLU 3.34 -0.50 1 48 ALA 3.35 -0.58 1 49 LEU 4.10 -0.60 1 50 LEU 2.75 -1.20 1 51 SER 1.98 0.45 1 53 ASP -2.14 0.63 1 54 LEU 3.62 -0.80 1 55 GLU 4.15 -1.08 1 56 LYS 4.11 -0.63 1 57 PHE 3.66 0.04 1 58 SER 4.52 -0.76 1 59 ARG 4.42 -0.91 1 60 VAL 6.08 -1.75 1 61 LEU 3.74 -0.29 1 62 VAL 5.29 -1.05 1 63 GLU 3.62 -0.52 1 64 GLN 5.30 -1.82 1 65 GLN 4.40 -1.36 1 66 GLN 3.92 -1.20 1 67 ASP 2.44 0.36 1 68 ARG 4.30 -0.87 1 69 ALA 3.19 -0.97 1 70 ARG 3.68 -0.81 1 71 ARG 3.36 -0.67 1 72 GLU 2.38 -0.50 1 73 GLN 2.90 -0.75 1 74 GLU 1.61 -0.11 1 75 ARG 2.73 -0.57 1 76 ILE 2.18 -0.48 1 77 ARG 1.73 -0.37 1 78 LEU 0.86 -0.07 1 79 PHE 0.48 -0.19 1 80 SER -0.18 0.22 1 81 ALA -0.57 0.35 1 82 ASP -0.44 0.53 1 84 PHE 0.87 -0.62 1 85 ASP 0.14 -0.08 1 86 LEU 1.60 -0.23 1 87 GLU 1.10 -0.21 1 88 ALA 0.96 -0.19 1 89 GLN 0.75 -0.21 1 90 ALA 0.50 -0.11 1 91 LYS 0.35 -0.13 1 92 ILE 0.64 -0.22 1 93 GLU -0.30 0.36 1 94 GLU -0.48 0.66 1 95 ASP 0.24 -0.02 1 96 ILE 0.48 -0.33 1 97 ARG 0.22 -0.20 1 98 GLN 0.58 1.12 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30097_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.15 _LACS_plot.Line_1_terminator_val_y_1 0.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _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 25 ARG 5.49 -0.94 0 10 GLU -0.66 -0.04 1 11 ILE 0.74 0.04 1 12 THR 0.15 0.03 1 13 SER -0.31 0.04 1 14 SER -0.23 -0.27 1 16 GLN 0.43 -0.03 1 18 LEU 0.82 -0.12 1 19 ASP 0.55 -0.13 1 20 ASN -0.29 -0.10 1 22 ALA 3.87 -0.36 1 23 LEU 2.73 -0.15 1 24 LEU 3.42 -0.18 1 26 ASP 4.39 -0.38 1 27 MET 4.14 -0.38 1 28 LEU 2.45 -0.32 1 29 LEU 2.56 -0.32 1 30 ALA -0.57 0.08 1 31 ASN -2.15 0.23 1 33 HIS 3.95 -0.25 1 34 GLU 2.72 -0.33 1 35 LEU 4.85 -0.31 1 36 SER 5.82 -0.47 1 37 LEU 3.02 -0.23 1 38 LEU 3.19 -0.34 1 39 LYS 4.13 -0.75 1 40 GLU 0.61 -0.15 1 41 ARG 0.86 -0.03 1 42 ASN -0.92 -0.21 1 45 LEU 1.81 -0.12 1 46 ALA 4.04 -0.39 1 47 GLU 3.34 -0.39 1 48 ALA 3.35 -0.20 1 49 LEU 4.10 -0.64 1 50 LEU 2.75 -0.32 1 51 SER 1.98 -0.21 1 53 ASP -2.14 0.18 1 54 LEU 3.62 -0.26 1 55 GLU 4.15 -0.25 1 56 LYS 4.11 -0.34 1 57 PHE 3.66 -0.57 1 58 SER 4.52 -0.66 1 59 ARG 4.42 -0.35 1 60 VAL 6.08 -0.44 1 61 LEU 3.74 -0.60 1 62 VAL 5.29 -0.44 1 63 GLU 3.62 -0.35 1 64 GLN 5.30 -0.18 1 65 GLN 4.40 -0.24 1 66 GLN 3.92 -0.21 1 67 ASP 2.44 -0.15 1 68 ARG 4.30 -0.35 1 69 ALA 3.19 -0.11 1 70 ARG 3.68 -0.21 1 71 ARG 3.36 -0.21 1 72 GLU 2.38 -0.14 1 73 GLN 2.90 -0.22 1 74 GLU 1.61 -0.20 1 75 ARG 2.73 -0.19 1 76 ILE 2.18 -0.24 1 77 ARG 1.73 -0.14 1 78 LEU 0.86 -0.14 1 79 PHE 0.48 0.01 1 80 SER -0.18 -0.07 1 81 ALA -0.57 0.01 1 82 ASP -0.44 -0.09 1 84 PHE 0.87 -0.07 1 85 ASP 0.14 -0.05 1 86 LEU 1.60 -0.18 1 87 GLU 1.10 -0.17 1 88 ALA 0.96 -0.12 1 89 GLN 0.75 -0.14 1 90 ALA 0.50 -0.06 1 91 LYS 0.35 -0.02 1 92 ILE 0.64 -0.05 1 93 GLU -0.30 -0.07 1 94 GLU -0.48 -0.12 1 95 ASP 0.24 -0.03 1 96 ILE 0.48 0.00 1 97 ARG 0.22 0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30097_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.15 _LACS_plot.Line_1_terminator_val_y_1 -1.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 -1.15 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 3.07 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 ASN -2.15 6.27 0 10 GLU -0.66 0.18 1 11 ILE 0.74 0.19 1 12 THR 0.15 -0.39 1 13 SER -0.31 -0.56 1 14 SER -0.23 -0.13 1 16 GLN 0.43 0.64 1 18 LEU 0.82 -0.87 1 19 ASP 0.55 -0.43 1 20 ASN -0.29 -0.06 1 22 ALA 3.87 1.67 1 23 LEU 2.73 1.96 1 24 LEU 3.42 0.48 1 25 ARG 5.49 0.93 1 26 ASP 4.39 2.99 1 27 MET 4.14 2.88 1 28 LEU 2.45 1.01 1 29 LEU 2.56 1.02 1 30 ALA -0.57 -1.24 1 33 HIS 3.95 3.70 1 34 GLU 2.72 3.13 1 35 LEU 4.85 0.80 1 36 SER 5.82 2.73 1 37 LEU 3.02 1.68 1 38 LEU 3.19 0.75 1 39 LYS 4.13 1.02 1 40 GLU 0.61 1.51 1 41 ARG 0.86 0.93 1 42 ASN -0.92 4.88 1 45 LEU 1.81 0.84 1 46 ALA 4.04 1.06 1 47 GLU 3.34 2.95 1 48 ALA 3.35 3.11 1 49 LEU 4.10 2.15 1 50 LEU 2.75 0.09 1 51 SER 1.98 1.13 1 53 ASP -2.14 0.69 1 54 LEU 3.62 1.20 1 55 GLU 4.15 2.47 1 56 LYS 4.11 1.58 1 57 PHE 3.66 -0.55 1 58 SER 4.52 0.96 1 59 ARG 4.42 2.45 1 60 VAL 6.08 1.40 1 61 LEU 3.74 2.22 1 62 VAL 5.29 2.38 1 63 GLU 3.62 3.45 1 64 GLN 5.30 3.33 1 65 GLN 4.40 2.71 1 66 GLN 3.92 2.41 1 67 ASP 2.44 1.58 1 68 ARG 4.30 2.16 1 69 ALA 3.19 2.29 1 70 ARG 3.68 2.41 1 71 ARG 3.36 2.50 1 72 GLU 2.38 1.50 1 73 GLN 2.90 1.92 1 74 GLU 1.61 0.88 1 75 ARG 2.73 1.32 1 76 ILE 2.18 0.94 1 77 ARG 1.73 0.72 1 78 LEU 0.86 -0.11 1 79 PHE 0.48 0.04 1 80 SER -0.18 -0.82 1 81 ALA -0.57 -0.84 1 82 ASP -0.44 -0.01 1 84 PHE 0.87 -0.12 1 85 ASP 0.14 0.18 1 86 LEU 1.60 0.98 1 87 GLU 1.10 0.58 1 88 ALA 0.96 0.72 1 89 GLN 0.75 0.18 1 90 ALA 0.50 0.08 1 91 LYS 0.35 0.11 1 92 ILE 0.64 0.07 1 93 GLU -0.30 -0.15 1 94 GLU -0.48 -0.42 1 95 ASP 0.24 -0.16 1 96 ILE 0.48 -0.20 1 97 ARG 0.22 -0.90 1 98 GLN 0.58 -0.60 1 stop_ save_