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 bmr18605_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.60 _LACS_plot.Line_1_terminator_val_y_1 -1.89 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 6.21 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 ARG 4.80 1.30 0 35 ALA -3.60 -0.94 0 55 THR 0.19 -2.26 0 11 ALA 3.30 2.75 1 12 VAL 5.20 4.07 1 13 ARG 4.51 3.65 1 14 ASN 4.16 3.38 1 15 LYS 3.88 2.06 1 17 ARG 5.59 4.49 1 18 GLU 3.74 3.28 1 19 MET 2.37 3.45 1 20 LEU 3.49 3.41 1 21 THR 8.01 5.93 1 22 ALA 3.62 2.13 1 23 ALA 2.46 2.38 1 24 LEU 3.40 2.34 1 25 GLN 1.40 0.00 1 26 THR 4.32 4.21 1 27 ASP 3.97 2.15 1 28 HIS 3.19 2.74 1 29 ASP 3.71 3.51 1 30 HIS 1.58 3.86 1 31 VAL 4.85 3.20 1 32 ALA 2.57 1.85 1 33 ILE -0.31 0.65 1 36 ASP -1.01 -1.96 1 38 GLU 3.74 2.92 1 39 ARG 3.80 2.81 1 40 LEU 1.77 2.64 1 41 SER 3.19 2.64 1 42 ALA 3.88 2.78 1 43 GLN 3.42 3.24 1 44 ILE 4.76 4.68 1 45 GLU 6.65 5.45 1 46 GLU 3.66 2.66 1 48 ILE 6.32 5.57 1 49 PHE 5.10 4.86 1 50 ARG 3.18 2.10 1 51 ASP 0.58 2.68 1 52 VAL 2.42 2.63 1 54 ASN -1.50 -1.07 1 58 LYS 5.03 3.84 1 59 TYR 3.78 3.57 1 60 LYS 5.02 4.07 1 61 ASN 3.56 2.36 1 63 VAL 7.44 6.08 1 64 ARG 5.04 4.20 1 65 SER 3.50 2.20 1 66 ARG 5.42 6.11 1 67 ILE 6.93 5.78 1 68 SER 4.86 3.41 1 69 ASN 2.01 3.50 1 70 LEU 1.68 1.96 1 71 LYS -0.15 -0.35 1 72 ASP -0.15 0.74 1 73 ALA 1.36 1.33 1 74 LYS 0.92 0.02 1 75 ASN -1.38 -0.93 1 77 ASP 3.88 3.28 1 78 LEU 5.25 3.66 1 79 ARG 5.65 4.15 1 80 ARG 6.24 5.09 1 81 ASN 3.58 2.50 1 82 VAL 4.30 3.00 1 83 LEU 2.15 2.65 1 86 ALA 1.97 1.85 1 87 ILE -3.08 -1.58 1 88 THR 2.34 0.84 1 90 GLN 4.71 3.17 1 91 GLN 2.72 2.76 1 92 ILE 0.57 -0.94 1 93 ALA 0.81 2.71 1 94 VAL -1.98 -1.76 1 95 MET -0.24 1.76 1 96 THR -1.93 -0.80 1 97 SER 4.79 3.43 1 98 GLU 3.64 2.68 1 99 GLU 1.38 1.50 1 100 MET 2.14 2.62 1 101 ALA -0.53 -0.34 1 102 SER 0.00 0.06 1 103 ASP 1.61 1.33 1 104 GLU 1.38 1.25 1 105 LEU 1.31 0.50 1 106 LYS 1.55 1.24 1 107 GLU 0.36 0.23 1 108 ILE 1.40 0.80 1 109 ARG 0.80 0.30 1 110 LYS 0.59 0.32 1 111 ALA -0.09 -0.07 1 112 MET 0.19 0.11 1 113 THR 0.36 1.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18605_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.60 _LACS_plot.Line_1_terminator_val_y_1 1.71 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.77 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 -1.80 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 ARG 4.80 -3.50 0 35 ALA -3.60 2.66 0 55 THR 0.19 -2.45 0 11 ALA 3.30 -0.55 1 12 VAL 5.20 -1.13 1 13 ARG 4.51 -0.86 1 14 ASN 4.16 -0.78 1 15 LYS 3.88 -1.82 1 17 ARG 5.59 -1.10 1 18 GLU 3.74 -0.46 1 19 MET 2.37 1.08 1 20 LEU 3.49 -0.08 1 21 THR 8.01 -2.08 1 22 ALA 3.62 -1.49 1 23 ALA 2.46 -0.08 1 24 LEU 3.40 -1.06 1 25 GLN 1.40 -1.40 1 26 THR 4.32 -0.11 1 27 ASP 3.97 -1.82 1 28 HIS 3.19 -0.45 1 29 ASP 3.71 -0.20 1 30 HIS 1.58 2.28 1 31 VAL 4.85 -1.65 1 32 ALA 2.57 -0.72 1 33 ILE -0.31 0.96 1 36 ASP -1.01 -0.95 1 38 GLU 3.74 -0.82 1 39 ARG 3.80 -0.99 1 40 LEU 1.77 0.87 1 41 SER 3.19 -0.55 1 42 ALA 3.88 -1.10 1 43 GLN 3.42 -0.18 1 44 ILE 4.76 -0.08 1 45 GLU 6.65 -1.20 1 46 GLU 3.66 -1.00 1 48 ILE 6.32 -0.75 1 49 PHE 5.10 -0.24 1 50 ARG 3.18 -1.08 1 51 ASP 0.58 2.10 1 52 VAL 2.42 0.21 1 54 ASN -1.50 0.43 1 58 LYS 5.03 -1.19 1 59 TYR 3.78 -0.21 1 60 LYS 5.02 -0.95 1 61 ASN 3.56 -1.20 1 63 VAL 7.44 -1.36 1 64 ARG 5.04 -0.84 1 65 SER 3.50 -1.30 1 66 ARG 5.42 0.69 1 67 ILE 6.93 -1.15 1 68 SER 4.86 -1.45 1 69 ASN 2.01 1.49 1 70 LEU 1.68 0.28 1 71 LYS -0.15 -0.20 1 72 ASP -0.15 0.89 1 73 ALA 1.36 -0.03 1 74 LYS 0.92 -0.90 1 75 ASN -1.38 0.45 1 77 ASP 3.88 -0.60 1 78 LEU 5.25 -1.59 1 79 ARG 5.65 -1.50 1 80 ARG 6.24 -1.15 1 81 ASN 3.58 -1.08 1 82 VAL 4.30 -1.30 1 83 LEU 2.15 0.50 1 86 ALA 1.97 -0.12 1 87 ILE -3.08 1.50 1 88 THR 2.34 -1.50 1 90 GLN 4.71 -1.54 1 91 GLN 2.72 0.04 1 92 ILE 0.57 -1.51 1 93 ALA 0.81 1.90 1 94 VAL -1.98 0.22 1 95 MET -0.24 2.00 1 96 THR -1.93 1.13 1 97 SER 4.79 -1.36 1 98 GLU 3.64 -0.96 1 99 GLU 1.38 0.12 1 100 MET 2.14 0.48 1 101 ALA -0.53 0.19 1 102 SER 0.00 0.06 1 103 ASP 1.61 -0.28 1 104 GLU 1.38 -0.13 1 105 LEU 1.31 -0.81 1 106 LYS 1.55 -0.31 1 107 GLU 0.36 -0.13 1 108 ILE 1.40 -0.60 1 109 ARG 0.80 -0.50 1 110 LYS 0.59 -0.27 1 111 ALA -0.09 0.02 1 112 MET 0.19 -0.08 1 113 THR 0.36 0.84 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18605_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.60 _LACS_plot.Line_1_terminator_val_y_1 0.21 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.11 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 ALA -3.60 0.10 0 93 ALA 0.81 -0.60 0 30 HIS 1.58 -0.68 0 82 VAL 4.30 0.11 0 11 ALA 3.30 -0.18 1 12 VAL 5.20 -0.37 1 13 ARG 4.51 0.00 1 14 ASN 4.16 -0.44 1 15 LYS 3.88 -0.10 1 17 ARG 5.59 -0.50 1 18 GLU 3.74 -0.31 1 19 MET 2.37 -0.30 1 20 LEU 3.49 -0.45 1 21 THR 8.01 -0.89 1 22 ALA 3.62 -0.28 1 23 ALA 2.46 -0.47 1 24 LEU 3.40 -0.49 1 25 GLN 1.40 -0.16 1 26 THR 4.32 -0.59 1 27 ASP 3.97 -0.41 1 28 HIS 3.19 -0.23 1 29 ASP 3.71 -0.26 1 31 VAL 4.85 -0.66 1 32 ALA 2.57 -0.19 1 33 ILE -0.31 -0.18 1 36 ASP -1.01 0.15 1 38 GLU 3.74 -0.22 1 39 ARG 3.80 -0.30 1 40 LEU 1.77 -0.18 1 41 SER 3.19 -0.69 1 42 ALA 3.88 -0.36 1 43 GLN 3.42 -0.21 1 44 ILE 4.76 -0.76 1 45 GLU 6.65 -0.76 1 46 GLU 3.66 -0.37 1 48 ILE 6.32 -0.62 1 49 PHE 5.10 -0.44 1 50 ARG 3.18 -0.57 1 51 ASP 0.58 -0.18 1 52 VAL 2.42 -0.29 1 54 ASN -1.50 -0.07 1 55 THR 0.19 -0.15 1 58 LYS 5.03 -0.20 1 59 TYR 3.78 -0.57 1 60 LYS 5.02 -0.68 1 61 ASN 3.56 -0.24 1 62 ARG 4.80 -0.16 1 63 VAL 7.44 -0.87 1 64 ARG 5.04 -0.46 1 65 SER 3.50 -0.08 1 66 ARG 5.42 -0.34 1 67 ILE 6.93 -0.92 1 68 SER 4.86 -0.47 1 69 ASN 2.01 -0.15 1 70 LEU 1.68 -0.25 1 71 LYS -0.15 0.14 1 72 ASP -0.15 -0.31 1 73 ALA 1.36 -0.14 1 74 LYS 0.92 -0.02 1 75 ASN -1.38 0.29 1 77 ASP 3.88 -0.40 1 78 LEU 5.25 -0.23 1 79 ARG 5.65 -0.63 1 80 ARG 6.24 -0.57 1 81 ASN 3.58 0.09 1 83 LEU 2.15 -0.42 1 86 ALA 1.97 -0.16 1 87 ILE -3.08 0.20 1 88 THR 2.34 -0.21 1 90 GLN 4.71 -0.35 1 91 GLN 2.72 -0.33 1 92 ILE 0.57 0.09 1 94 VAL -1.98 0.25 1 95 MET -0.24 -0.13 1 96 THR -1.93 0.14 1 97 SER 4.79 -0.34 1 98 GLU 3.64 -0.30 1 99 GLU 1.38 -0.31 1 100 MET 2.14 -0.43 1 101 ALA -0.53 0.01 1 102 SER 0.00 -0.13 1 103 ASP 1.61 -0.14 1 104 GLU 1.38 -0.21 1 105 LEU 1.31 -0.10 1 106 LYS 1.55 -0.18 1 107 GLU 0.36 -0.13 1 108 ILE 1.40 -0.13 1 109 ARG 0.80 -0.05 1 110 LYS 0.59 -0.09 1 111 ALA -0.09 0.00 1 112 MET 0.19 0.04 1 113 THR 0.36 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18605_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.60 _LACS_plot.Line_1_terminator_val_y_1 -1.27 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.15 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 2.91 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 THR 8.01 0.88 0 54 ASN -1.50 -2.76 0 35 ALA -3.60 -1.74 0 113 THR 0.36 4.37 0 12 VAL 5.20 2.20 1 13 ARG 4.51 3.17 1 14 ASN 4.16 2.75 1 15 LYS 3.88 2.60 1 17 ARG 5.59 2.68 1 18 GLU 3.74 3.42 1 19 MET 2.37 3.71 1 20 LEU 3.49 0.49 1 22 ALA 3.62 2.94 1 23 ALA 2.46 3.31 1 24 LEU 3.40 -1.39 1 25 GLN 1.40 0.00 1 26 THR 4.32 -0.51 1 27 ASP 3.97 -1.83 1 28 HIS 3.19 4.36 1 29 ASP 3.71 1.37 1 30 HIS 1.58 2.03 1 31 VAL 4.85 2.14 1 32 ALA 2.57 1.46 1 33 ILE -0.31 -0.21 1 36 ASP -1.01 0.44 1 38 GLU 3.74 2.51 1 39 ARG 3.80 2.44 1 40 LEU 1.77 1.31 1 41 SER 3.19 1.43 1 42 ALA 3.88 2.62 1 43 GLN 3.42 3.20 1 44 ILE 4.76 0.94 1 45 GLU 6.65 1.20 1 46 GLU 3.66 2.14 1 48 ILE 6.32 0.48 1 49 PHE 5.10 2.63 1 50 ARG 3.18 1.72 1 51 ASP 0.58 0.63 1 52 VAL 2.42 1.48 1 60 LYS 5.02 3.07 1 61 ASN 3.56 2.82 1 62 ARG 4.80 2.86 1 63 VAL 7.44 1.54 1 64 ARG 5.04 2.34 1 65 SER 3.50 3.33 1 66 ARG 5.42 1.98 1 67 ILE 6.93 0.82 1 68 SER 4.86 2.52 1 69 ASN 2.01 1.98 1 70 LEU 1.68 -1.55 1 71 LYS -0.15 -1.11 1 72 ASP -0.15 1.60 1 73 ALA 1.36 1.21 1 74 LYS 0.92 -0.27 1 77 ASP 3.88 1.09 1 78 LEU 5.25 0.14 1 79 ARG 5.65 2.11 1 80 ARG 6.24 1.86 1 81 ASN 3.58 3.03 1 82 VAL 4.30 3.19 1 83 LEU 2.15 0.19 1 86 ALA 1.97 0.15 1 87 ILE -3.08 -0.59 1 88 THR 2.34 0.29 1 90 GLN 4.71 2.00 1 91 GLN 2.72 3.79 1 92 ILE 0.57 -0.77 1 93 ALA 0.81 -0.17 1 94 VAL -1.98 0.79 1 95 MET -0.24 0.73 1 96 THR -1.93 1.08 1 97 SER 4.79 1.52 1 98 GLU 3.64 2.00 1 99 GLU 1.38 1.77 1 100 MET 2.14 -0.65 1 101 ALA -0.53 -0.25 1 102 SER 0.00 0.77 1 103 ASP 1.61 1.11 1 104 GLU 1.38 0.91 1 105 LEU 1.31 0.33 1 106 LYS 1.55 0.69 1 107 GLU 0.36 0.47 1 108 ILE 1.40 0.24 1 109 ARG 0.80 0.26 1 110 LYS 0.59 -0.26 1 111 ALA -0.09 -0.24 1 112 MET 0.19 -0.67 1 stop_ save_