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 bmr4940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.41 _LACS_plot.Line_1_terminator_val_y_1 -5.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.71 _LACS_plot.Line_2_terminator_val_x_2 8.06 _LACS_plot.Line_2_terminator_val_y_2 5.48 _LACS_plot.Y_axis_chem_shift_offset -0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 LEU -8.41 -5.24 0 100 LYS 4.78 -0.03 0 10 PHE 0.87 0.55 1 11 ASP 3.37 2.41 1 12 LEU 2.77 2.92 1 13 VAL -0.59 -0.59 1 14 ALA 4.43 4.25 1 15 GLU 4.51 3.51 1 16 ASP 3.69 3.72 1 17 LYS 3.96 3.84 1 18 ALA 4.23 2.84 1 19 ARG 4.78 3.80 1 21 MET 3.24 4.44 1 22 SER 4.02 2.99 1 23 GLU 2.13 2.06 1 24 HIS 0.20 1.03 1 26 THR 0.89 1.43 1 27 THR -3.85 -2.79 1 28 GLN 4.27 1.94 1 29 ALA 4.05 2.64 1 30 GLN 2.07 3.50 1 31 ILE 5.34 4.41 1 32 ASP 4.08 3.08 1 34 VAL 5.76 3.69 1 35 ASP 1.26 0.34 1 36 LYS -4.59 -2.35 1 40 VAL 2.14 -1.41 1 41 ASN -4.85 -2.12 1 42 GLU 4.61 3.09 1 44 SER -4.32 -2.40 1 45 ILE 8.07 4.06 1 46 THR 6.00 4.58 1 48 TYR 3.75 5.02 1 49 MET 5.50 4.58 1 50 TYR 2.56 2.50 1 52 LEU 2.78 2.85 1 53 LEU 5.01 2.69 1 54 GLU 3.79 1.78 1 55 ALA 0.78 0.60 1 56 PHE 4.46 1.39 1 57 SER 0.96 1.77 1 59 VAL -2.85 -2.21 1 60 ASP 3.22 1.44 1 61 ASP -0.95 -1.33 1 62 GLU 2.97 1.03 1 63 ALA 0.48 0.00 1 64 ASN -0.99 -0.27 1 65 VAL 0.46 -1.92 1 66 ASP 4.42 3.26 1 67 GLU 4.79 3.15 1 68 ASP 3.92 2.14 1 69 ILE 4.27 4.19 1 70 MET 4.77 2.94 1 71 LEU -0.56 0.05 1 73 LEU -1.11 -0.99 1 74 LEU 4.34 3.66 1 76 ASP 4.26 2.40 1 77 GLN -2.75 -1.32 1 78 LEU 6.29 4.73 1 79 GLN 4.84 3.54 1 80 GLU 3.03 2.92 1 82 ALA 5.10 4.02 1 83 GLN 4.31 2.99 1 84 SER 5.52 4.12 1 85 VAL 5.13 3.37 1 86 MET 0.67 1.20 1 88 LYS -2.41 -1.04 1 92 THR -2.69 -1.03 1 93 SER 1.91 1.84 1 95 SER -1.76 -1.25 1 96 ASP 5.68 3.07 1 97 ASN 1.33 3.96 1 99 ASN 3.41 3.75 1 101 ILE 5.86 4.49 1 102 TYR 3.87 2.79 1 103 ASN 2.80 2.51 1 104 LEU 3.26 2.68 1 105 ALA 3.88 2.31 1 106 LYS 5.65 4.76 1 108 VAL 2.70 1.62 1 110 GLU 1.45 2.26 1 111 SER -0.97 0.06 1 112 ALA 2.28 0.58 1 114 ASP -2.38 -0.20 1 117 PHE 4.57 3.45 1 118 VAL -0.72 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.41 _LACS_plot.Line_1_terminator_val_y_1 3.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.29 _LACS_plot.Line_2_terminator_val_x_2 8.06 _LACS_plot.Line_2_terminator_val_y_2 -2.58 _LACS_plot.Y_axis_chem_shift_offset -0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 LEU -8.41 3.17 0 100 LYS 4.78 -4.81 0 10 PHE 0.87 -0.32 1 11 ASP 3.37 -0.96 1 12 LEU 2.77 0.15 1 13 VAL -0.59 0.00 1 14 ALA 4.43 -0.18 1 15 GLU 4.51 -1.00 1 16 ASP 3.69 0.03 1 17 LYS 3.96 -0.12 1 18 ALA 4.23 -1.39 1 19 ARG 4.78 -0.98 1 21 MET 3.24 1.20 1 22 SER 4.02 -1.03 1 23 GLU 2.13 -0.07 1 24 HIS 0.20 0.83 1 26 THR 0.89 0.54 1 27 THR -3.85 1.06 1 28 GLN 4.27 -2.33 1 29 ALA 4.05 -1.41 1 30 GLN 2.07 1.43 1 31 ILE 5.34 -0.93 1 32 ASP 4.08 -1.00 1 34 VAL 5.76 -2.07 1 35 ASP 1.26 -0.92 1 36 LYS -4.59 2.24 1 40 VAL 2.14 -3.55 1 41 ASN -4.85 2.73 1 42 GLU 4.61 -1.52 1 44 SER -4.32 1.92 1 45 ILE 8.07 -4.01 1 46 THR 6.00 -1.42 1 48 TYR 3.75 1.27 1 49 MET 5.50 -0.92 1 50 TYR 2.56 -0.06 1 52 LEU 2.78 0.07 1 53 LEU 5.01 -2.32 1 54 GLU 3.79 -2.01 1 55 ALA 0.78 -0.18 1 56 PHE 4.46 -3.07 1 57 SER 0.96 0.81 1 59 VAL -2.85 0.64 1 60 ASP 3.22 -1.78 1 61 ASP -0.95 -0.38 1 62 GLU 2.97 -1.94 1 63 ALA 0.48 -0.48 1 64 ASN -0.99 0.72 1 65 VAL 0.46 -2.38 1 66 ASP 4.42 -1.16 1 67 GLU 4.79 -1.64 1 68 ASP 3.92 -1.78 1 69 ILE 4.27 -0.08 1 70 MET 4.77 -1.83 1 71 LEU -0.56 0.61 1 73 LEU -1.11 0.12 1 74 LEU 4.34 -0.68 1 76 ASP 4.26 -1.86 1 77 GLN -2.75 1.43 1 78 LEU 6.29 -1.56 1 79 GLN 4.84 -1.30 1 80 GLU 3.03 -0.11 1 82 ALA 5.10 -1.08 1 83 GLN 4.31 -1.32 1 84 SER 5.52 -1.40 1 85 VAL 5.13 -1.76 1 86 MET 0.67 0.53 1 88 LYS -2.41 1.37 1 92 THR -2.69 1.66 1 93 SER 1.91 -0.07 1 95 SER -1.76 0.51 1 96 ASP 5.68 -2.61 1 97 ASN 1.33 2.63 1 99 ASN 3.41 0.34 1 101 ILE 5.86 -1.37 1 102 TYR 3.87 -1.08 1 103 ASN 2.80 -0.29 1 104 LEU 3.26 -0.58 1 105 ALA 3.88 -1.57 1 106 LYS 5.65 -0.89 1 108 VAL 2.70 -1.08 1 110 GLU 1.45 0.81 1 111 SER -0.97 1.03 1 112 ALA 2.28 -1.70 1 114 ASP -2.38 2.18 1 117 PHE 4.57 -1.12 1 118 VAL -0.72 2.02 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.41 _LACS_plot.Line_1_terminator_val_y_1 0.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 8.06 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _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 58 LEU -8.41 1.12 0 10 PHE 0.87 -0.26 1 11 ASP 3.37 -0.03 1 12 LEU 2.77 -0.10 1 13 VAL -0.59 0.46 1 14 ALA 4.43 -0.30 1 15 GLU 4.51 -0.17 1 16 ASP 3.69 -0.14 1 17 LYS 3.96 -0.27 1 18 ALA 4.23 -0.14 1 19 ARG 4.78 -0.19 1 21 MET 3.24 -0.17 1 22 SER 4.02 -0.20 1 23 GLU 2.13 -0.35 1 24 HIS 0.20 0.07 1 26 THR 0.89 -0.14 1 27 THR -3.85 0.34 1 28 GLN 4.27 -0.66 1 29 ALA 4.05 -0.17 1 30 GLN 2.07 -0.20 1 31 ILE 5.34 -0.74 1 32 ASP 4.08 -0.30 1 34 VAL 5.76 -0.55 1 35 ASP 1.26 0.07 1 36 LYS -4.59 0.40 1 40 VAL 2.14 -0.68 1 41 ASN -4.85 0.29 1 42 GLU 4.61 -0.06 1 44 SER -4.32 1.02 1 45 ILE 8.07 -0.18 1 46 THR 6.00 -0.65 1 48 TYR 3.75 -0.90 1 49 MET 5.50 -0.64 1 50 TYR 2.56 -0.47 1 52 LEU 2.78 -0.39 1 53 LEU 5.01 -0.59 1 54 GLU 3.79 -0.46 1 55 ALA 0.78 -0.07 1 56 PHE 4.46 -0.32 1 57 SER 0.96 -0.19 1 59 VAL -2.85 0.27 1 60 ASP 3.22 -0.01 1 61 ASP -0.95 0.41 1 62 GLU 2.97 -0.67 1 63 ALA 0.48 0.20 1 64 ASN -0.99 0.29 1 65 VAL 0.46 0.10 1 66 ASP 4.42 -0.74 1 67 GLU 4.79 -0.29 1 68 ASP 3.92 -0.36 1 69 ILE 4.27 -0.60 1 70 MET 4.77 -0.45 1 71 LEU -0.56 0.01 1 73 LEU -1.11 -0.25 1 74 LEU 4.34 -0.43 1 76 ASP 4.26 -0.14 1 77 GLN -2.75 0.17 1 78 LEU 6.29 -0.76 1 79 GLN 4.84 -0.34 1 80 GLU 3.03 -0.44 1 82 ALA 5.10 -0.39 1 83 GLN 4.31 -0.20 1 84 SER 5.52 -0.40 1 85 VAL 5.13 -0.51 1 86 MET 0.67 0.07 1 88 LYS -2.41 0.35 1 92 THR -2.69 0.26 1 93 SER 1.91 -0.27 1 95 SER -1.76 -0.03 1 96 ASP 5.68 -0.78 1 97 ASN 1.33 -0.26 1 99 ASN 3.41 -0.02 1 100 LYS 4.78 -0.10 1 101 ILE 5.86 -0.60 1 102 TYR 3.87 -0.71 1 103 ASN 2.80 0.24 1 104 LEU 3.26 -0.56 1 105 ALA 3.88 -0.81 1 106 LYS 5.65 -0.73 1 108 VAL 2.70 -0.50 1 110 GLU 1.45 -0.04 1 111 SER -0.97 0.19 1 112 ALA 2.28 -0.09 1 114 ASP -2.38 0.03 1 117 PHE 4.57 -0.02 1 118 VAL -0.72 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4940_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.41 _LACS_plot.Line_1_terminator_val_y_1 -1.75 _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 -0.12 _LACS_plot.Line_2_terminator_val_x_2 8.06 _LACS_plot.Line_2_terminator_val_y_2 2.61 _LACS_plot.Y_axis_chem_shift_offset -0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 LEU -8.41 -1.60 0 10 PHE 0.87 0.60 1 11 ASP 3.37 2.26 1 12 LEU 2.77 2.26 1 13 VAL -0.59 -0.19 1 14 ALA 4.43 2.42 1 15 GLU 4.51 3.05 1 16 ASP 3.69 1.27 1 17 LYS 3.96 1.33 1 18 ALA 4.23 3.28 1 19 ARG 4.78 2.70 1 21 MET 3.24 2.62 1 22 SER 4.02 3.23 1 23 GLU 2.13 1.01 1 24 HIS 0.20 0.26 1 26 THR 0.89 0.31 1 27 THR -3.85 0.79 1 28 GLN 4.27 1.25 1 29 ALA 4.05 3.07 1 30 GLN 2.07 3.23 1 31 ILE 5.34 1.00 1 32 ASP 4.08 2.73 1 34 VAL 5.76 0.12 1 35 ASP 1.26 0.46 1 36 LYS -4.59 -1.76 1 40 VAL 2.14 -0.92 1 41 ASN -4.85 -0.24 1 42 GLU 4.61 0.34 1 44 SER -4.32 0.56 1 45 ILE 8.07 3.68 1 46 THR 6.00 -0.32 1 48 TYR 3.75 1.12 1 49 MET 5.50 -1.90 1 50 TYR 2.56 0.62 1 52 LEU 2.78 2.50 1 53 LEU 5.01 3.27 1 54 GLU 3.79 0.48 1 55 ALA 0.78 -1.98 1 56 PHE 4.46 -1.00 1 57 SER 0.96 -0.41 1 59 VAL -2.85 2.45 1 60 ASP 3.22 0.23 1 61 ASP -0.95 -2.16 1 62 GLU 2.97 -2.49 1 63 ALA 0.48 1.45 1 64 ASN -0.99 -0.92 1 65 VAL 0.46 -1.07 1 66 ASP 4.42 0.37 1 67 GLU 4.79 3.35 1 68 ASP 3.92 2.41 1 69 ILE 4.27 1.35 1 70 MET 4.77 2.16 1 71 LEU -0.56 -0.56 1 73 LEU -1.11 -1.28 1 74 LEU 4.34 2.76 1 76 ASP 4.26 0.39 1 77 GLN -2.75 -0.84 1 78 LEU 6.29 1.48 1 79 GLN 4.84 3.19 1 80 GLU 3.03 1.52 1 82 ALA 5.10 3.56 1 83 GLN 4.31 3.09 1 84 SER 5.52 2.19 1 85 VAL 5.13 1.77 1 86 MET 0.67 2.08 1 88 LYS -2.41 0.20 1 92 THR -2.69 -1.84 1 93 SER 1.91 -0.69 1 95 SER -1.76 -0.63 1 96 ASP 5.68 1.94 1 97 ASN 1.33 2.13 1 99 ASN 3.41 3.09 1 100 LYS 4.78 1.11 1 101 ILE 5.86 -0.01 1 102 TYR 3.87 3.31 1 103 ASN 2.80 -0.30 1 104 LEU 3.26 0.22 1 105 ALA 3.88 1.50 1 106 LYS 5.65 0.69 1 108 VAL 2.70 2.52 1 110 GLU 1.45 -0.20 1 111 SER -0.97 -2.54 1 112 ALA 2.28 0.35 1 114 ASP -2.38 3.42 1 117 PHE 4.57 4.74 1 118 VAL -0.72 2.30 1 stop_ save_