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 bmr27780_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 -2.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.30 _LACS_plot.Line_2_terminator_val_x_2 6.03 _LACS_plot.Line_2_terminator_val_y_2 4.76 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 THR -6.12 -2.63 0 10 LYS 0.93 0.70 1 11 ASP 0.48 0.59 1 12 THR 0.46 0.47 1 13 VAL 0.40 0.31 1 14 ILE -0.06 -0.30 1 15 ILE -0.17 -0.47 1 16 VAL -0.08 -0.07 1 17 SER -0.37 -0.17 1 18 GLU -0.35 0.24 1 20 SER -0.43 -0.10 1 21 GLU -0.16 0.29 1 22 ASP 0.05 0.26 1 23 GLU 0.21 0.74 1 24 GLU 0.41 0.66 1 25 SER 0.59 0.54 1 26 GLN 0.50 0.50 1 28 LEU 0.13 0.14 1 30 THR 0.50 0.45 1 31 MET -0.06 0.03 1 32 ALA -0.25 0.02 1 33 ARG -0.22 -0.05 1 34 ARG -0.09 0.21 1 35 ASN 0.32 0.38 1 36 ASP 0.48 0.43 1 37 ASP 0.28 0.39 1 38 ILE 0.33 0.28 1 39 SER 0.42 0.52 1 40 GLU -0.21 0.15 1 41 LEU 0.30 0.35 1 42 GLU -0.49 0.27 1 43 ASP -0.05 0.04 1 44 LEU 1.02 0.50 1 45 SER 1.99 1.74 1 46 GLU 0.64 0.77 1 47 LEU 1.46 1.24 1 48 GLU 1.14 1.33 1 49 ASP 1.42 1.25 1 50 LEU 1.85 1.49 1 51 LYS 4.61 3.84 1 52 ASP 2.80 2.79 1 53 ALA 3.31 2.57 1 54 LYS 3.69 3.86 1 55 LEU 4.69 3.34 1 56 GLN 4.89 3.23 1 57 THR 6.03 5.12 1 58 LEU 3.17 3.29 1 59 LYS 3.88 2.81 1 60 GLU 2.16 1.96 1 61 LEU -0.46 1.42 1 62 PHE 0.30 0.18 1 64 GLN 1.69 0.45 1 65 ARG -2.22 -3.03 1 66 SER -1.89 -0.78 1 67 ASP 5.41 3.72 1 68 ASN 4.16 3.64 1 69 ASP 3.55 3.25 1 70 LEU 3.46 2.48 1 71 LEU 3.78 3.14 1 72 LYS 4.08 3.09 1 73 LEU 3.30 2.49 1 74 ILE 4.01 3.52 1 75 GLU 1.66 1.78 1 76 SER -0.03 0.56 1 77 THR -4.02 -1.18 1 78 SER 0.14 1.18 1 80 MET 2.26 2.48 1 81 ASP 4.25 3.38 1 83 ALA 4.82 3.59 1 84 ILE 5.26 5.09 1 85 ALA 3.91 2.86 1 86 ALA 2.85 2.24 1 87 ALA 3.00 2.41 1 88 LEU 3.21 2.78 1 89 LEU 2.41 2.24 1 90 MET 2.19 2.48 1 91 PHE -1.81 -1.84 1 93 ASP -0.85 -0.08 1 94 ALA 0.26 0.40 1 99 ARG 0.33 0.19 1 107 HIS -0.35 1.08 1 108 HIS 0.91 2.43 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27780_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 3.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.70 _LACS_plot.Line_2_terminator_val_x_2 6.03 _LACS_plot.Line_2_terminator_val_y_2 -1.27 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 THR -6.12 3.49 0 10 LYS 0.93 -0.23 1 11 ASP 0.48 0.11 1 12 THR 0.46 0.01 1 13 VAL 0.40 -0.09 1 14 ILE -0.06 -0.24 1 15 ILE -0.17 -0.30 1 16 VAL -0.08 0.01 1 17 SER -0.37 0.20 1 18 GLU -0.35 0.59 1 20 SER -0.43 0.33 1 21 GLU -0.16 0.45 1 22 ASP 0.05 0.21 1 23 GLU 0.21 0.53 1 24 GLU 0.41 0.25 1 25 SER 0.59 -0.05 1 26 GLN 0.50 0.00 1 28 LEU 0.13 0.01 1 30 THR 0.50 -0.05 1 31 MET -0.06 0.09 1 32 ALA -0.25 0.27 1 33 ARG -0.22 0.17 1 34 ARG -0.09 0.30 1 35 ASN 0.32 0.06 1 36 ASP 0.48 -0.05 1 37 ASP 0.28 0.11 1 38 ILE 0.33 -0.05 1 39 SER 0.42 0.10 1 40 GLU -0.21 0.36 1 41 LEU 0.30 0.05 1 42 GLU -0.49 0.76 1 43 ASP -0.05 0.09 1 44 LEU 1.02 -0.52 1 45 SER 1.99 -0.25 1 46 GLU 0.64 0.13 1 47 LEU 1.46 -0.22 1 48 GLU 1.14 0.19 1 49 ASP 1.42 -0.17 1 50 LEU 1.85 -0.36 1 51 LYS 4.61 -0.77 1 52 ASP 2.80 -0.01 1 53 ALA 3.31 -0.74 1 54 LYS 3.69 0.17 1 55 LEU 4.69 -1.35 1 56 GLN 4.89 -1.66 1 57 THR 6.03 -0.91 1 58 LEU 3.17 0.12 1 59 LYS 3.88 -1.07 1 60 GLU 2.16 -0.20 1 61 LEU -0.46 1.88 1 62 PHE 0.30 -0.12 1 64 GLN 1.69 -1.24 1 65 ARG -2.22 -0.81 1 66 SER -1.89 1.11 1 67 ASP 5.41 -1.69 1 68 ASN 4.16 -0.52 1 69 ASP 3.55 -0.30 1 70 LEU 3.46 -0.98 1 71 LEU 3.78 -0.64 1 72 LYS 4.08 -0.99 1 73 LEU 3.30 -0.81 1 74 ILE 4.01 -0.49 1 75 GLU 1.66 0.12 1 76 SER -0.03 0.59 1 77 THR -4.02 2.84 1 78 SER 0.14 1.04 1 80 MET 2.26 0.22 1 81 ASP 4.25 -0.87 1 83 ALA 4.82 -1.23 1 84 ILE 5.26 -0.17 1 85 ALA 3.91 -1.05 1 86 ALA 2.85 -0.61 1 87 ALA 3.00 -0.59 1 88 LEU 3.21 -0.43 1 89 LEU 2.41 -0.17 1 90 MET 2.19 0.29 1 91 PHE -1.81 -0.03 1 93 ASP -0.85 0.77 1 94 ALA 0.26 0.14 1 99 ARG 0.33 -0.14 1 107 HIS -0.35 1.43 1 108 HIS 0.91 1.52 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27780_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 0.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 6.03 _LACS_plot.Line_2_terminator_val_y_2 -0.47 _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 87 ALA 3.00 -0.97 0 10 LYS 0.93 -0.11 1 11 ASP 0.48 -0.04 1 12 THR 0.46 -0.10 1 13 VAL 0.40 -0.07 1 14 ILE -0.06 -0.05 1 15 ILE -0.17 -0.01 1 16 VAL -0.08 0.01 1 17 SER -0.37 -0.03 1 18 GLU -0.35 -0.05 1 20 SER -0.43 -0.03 1 21 GLU -0.16 -0.07 1 22 ASP 0.05 -0.07 1 23 GLU 0.21 -0.17 1 24 GLU 0.41 -0.13 1 25 SER 0.59 -0.08 1 26 GLN 0.50 -0.04 1 28 LEU 0.13 -0.10 1 30 THR 0.50 -0.12 1 31 MET -0.06 -0.04 1 32 ALA -0.25 -0.07 1 33 ARG -0.22 -0.05 1 34 ARG -0.09 -0.05 1 35 ASN 0.32 -0.08 1 36 ASP 0.48 -0.07 1 37 ASP 0.28 -0.07 1 38 ILE 0.33 0.01 1 39 SER 0.42 -0.07 1 40 GLU -0.21 -0.06 1 41 LEU 0.30 -0.05 1 42 GLU -0.49 -0.15 1 43 ASP -0.05 -0.05 1 44 LEU 1.02 -0.01 1 45 SER 1.99 -0.18 1 46 GLU 0.64 -0.08 1 47 LEU 1.46 -0.12 1 48 GLU 1.14 -0.22 1 49 ASP 1.42 -0.12 1 50 LEU 1.85 -0.07 1 51 LYS 4.61 -0.44 1 52 ASP 2.80 -0.23 1 53 ALA 3.31 -0.18 1 54 LYS 3.69 -0.29 1 55 LEU 4.69 -0.44 1 56 GLN 4.89 -0.46 1 57 THR 6.03 -0.40 1 58 LEU 3.17 -0.17 1 59 LYS 3.88 -0.54 1 60 GLU 2.16 -0.42 1 61 LEU -0.46 -0.44 1 62 PHE 0.30 0.05 1 64 GLN 1.69 -0.06 1 65 ARG -2.22 0.09 1 66 SER -1.89 -0.16 1 67 ASP 5.41 -0.46 1 68 ASN 4.16 -0.40 1 69 ASP 3.55 -0.28 1 70 LEU 3.46 -0.25 1 71 LEU 3.78 -0.37 1 72 LYS 4.08 -0.27 1 73 LEU 3.30 -0.35 1 74 ILE 4.01 -0.63 1 75 GLU 1.66 -0.21 1 76 SER -0.03 0.07 1 77 THR -4.02 0.37 1 78 SER 0.14 0.17 1 79 THR -6.12 0.49 1 80 MET 2.26 -0.12 1 81 ASP 4.25 -0.27 1 83 ALA 4.82 -0.33 1 84 ILE 5.26 -0.64 1 85 ALA 3.91 -0.25 1 86 ALA 2.85 -0.31 1 88 LEU 3.21 -0.23 1 89 LEU 2.41 -0.26 1 90 MET 2.19 -0.50 1 91 PHE -1.81 0.32 1 93 ASP -0.85 0.00 1 94 ALA 0.26 -0.03 1 99 ARG 0.33 -0.13 1 107 HIS -0.35 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27780_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.02 _LACS_plot.Line_1_terminator_val_y_1 -1.73 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -0.78 _LACS_plot.Line_2_terminator_val_x_2 6.03 _LACS_plot.Line_2_terminator_val_y_2 2.64 _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 77 THR -4.02 -0.75 0 91 PHE -1.81 1.32 0 10 LYS 0.93 -0.34 1 11 ASP 0.48 0.00 1 12 THR 0.46 -0.52 1 13 VAL 0.40 -0.69 1 14 ILE -0.06 -0.60 1 15 ILE -0.17 -0.39 1 16 VAL -0.08 -0.46 1 17 SER -0.37 -0.73 1 20 SER -0.43 0.18 1 21 GLU -0.16 -0.34 1 22 ASP 0.05 0.18 1 23 GLU 0.21 0.53 1 24 GLU 0.41 0.52 1 25 SER 0.59 0.31 1 26 GLN 0.50 0.43 1 30 THR 0.50 -0.02 1 31 MET -0.06 -0.58 1 32 ALA -0.25 0.73 1 33 ARG -0.22 -0.07 1 34 ARG -0.09 -0.14 1 35 ASN 0.32 -0.24 1 36 ASP 0.48 -0.49 1 37 ASP 0.28 0.04 1 38 ILE 0.33 0.04 1 39 SER 0.42 0.08 1 40 GLU -0.21 -0.20 1 41 LEU 0.30 -0.16 1 42 GLU -0.49 -0.61 1 43 ASP -0.05 0.14 1 44 LEU 1.02 0.51 1 45 SER 1.99 0.63 1 46 GLU 0.64 0.64 1 47 LEU 1.46 0.92 1 48 GLU 1.14 0.60 1 49 ASP 1.42 1.30 1 50 LEU 1.85 0.76 1 51 LYS 4.61 1.24 1 52 ASP 2.80 1.76 1 53 ALA 3.31 3.08 1 54 LYS 3.69 1.68 1 55 LEU 4.69 0.43 1 56 GLN 4.89 2.83 1 57 THR 6.03 1.92 1 58 LEU 3.17 0.85 1 59 LYS 3.88 1.94 1 60 GLU 2.16 1.93 1 61 LEU -0.46 -0.89 1 64 GLN 1.69 0.28 1 65 ARG -2.22 -0.75 1 66 SER -1.89 0.21 1 67 ASP 5.41 1.84 1 68 ASN 4.16 2.44 1 69 ASP 3.55 2.28 1 70 LEU 3.46 1.53 1 71 LEU 3.78 1.70 1 72 LYS 4.08 3.24 1 73 LEU 3.30 1.80 1 74 ILE 4.01 1.74 1 75 GLU 1.66 0.90 1 76 SER -0.03 -1.01 1 78 SER 0.14 0.49 1 80 MET 2.26 1.38 1 81 ASP 4.25 3.20 1 83 ALA 4.82 1.07 1 84 ILE 5.26 1.04 1 85 ALA 3.91 3.00 1 86 ALA 2.85 2.07 1 87 ALA 3.00 0.95 1 88 LEU 3.21 2.74 1 89 LEU 2.41 1.02 1 90 MET 2.19 1.46 1 93 ASP -0.85 0.26 1 94 ALA 0.26 0.73 1 107 HIS -0.35 -0.11 1 stop_ save_