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 bmr34325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.42 _LACS_plot.Line_1_terminator_val_y_1 -2.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 8.34 _LACS_plot.Line_2_terminator_val_y_2 6.55 _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 84 HIS 3.69 -0.30 0 10 ILE 6.62 5.99 1 11 GLN 5.12 4.11 1 12 SER 3.88 4.07 1 13 GLU 1.16 2.18 1 14 HIS 6.93 6.60 1 15 ARG 5.16 3.84 1 16 GLU 3.49 3.10 1 17 LEU 2.29 2.91 1 18 VAL 7.17 5.19 1 19 SER 4.45 3.30 1 20 ALA 2.70 2.84 1 21 ILE 5.99 5.07 1 22 GLN 5.72 4.00 1 23 SER 4.44 3.72 1 24 TYR 4.47 3.98 1 25 ILE 5.78 4.86 1 27 ALA -0.82 -0.61 1 28 GLN -0.27 -0.79 1 29 ASP 2.66 2.33 1 30 ASP -2.29 -1.72 1 32 THR 1.31 0.99 1 33 ASN -0.77 0.03 1 35 SER 0.15 0.41 1 36 GLU -0.11 0.35 1 37 ILE 3.39 2.12 1 38 THR -5.93 -3.58 1 39 LEU 4.40 3.47 1 40 ALA 3.62 2.77 1 41 LYS 2.02 1.95 1 42 LEU 0.67 -0.19 1 43 ALA 8.34 6.73 1 45 TYR 0.39 0.32 1 46 MET -1.18 -0.63 1 47 SER 1.14 0.98 1 48 LYS 1.24 0.47 1 49 ASN 0.47 0.51 1 50 ALA 0.09 0.30 1 51 LYS 0.40 0.19 1 52 ASN -0.13 -0.02 1 53 GLU 1.66 1.48 1 54 ASP 0.76 0.78 1 56 ILE 2.32 1.62 1 57 VAL 6.09 4.39 1 58 ASN 2.33 1.67 1 59 SER 0.43 0.83 1 60 LEU -3.83 -1.73 1 61 ALA -0.82 0.44 1 62 LYS -3.33 -1.43 1 64 LYS 3.92 2.65 1 65 SER 3.38 2.52 1 67 ASN 5.22 3.43 1 68 SER 0.29 -0.08 1 69 SER -0.76 -0.57 1 70 THR 1.74 1.14 1 71 SER 1.07 1.19 1 72 ALA -0.60 0.33 1 75 SER 0.16 1.12 1 76 ALA 0.73 1.57 1 77 HIS -4.61 -1.14 1 78 GLN -4.42 -2.76 1 79 ILE -0.91 -1.12 1 80 ASP -2.47 -2.38 1 81 THR 4.90 4.09 1 82 THR 5.25 4.09 1 83 ASN -0.34 -0.72 1 85 LYS -6.42 -1.99 1 86 LEU -3.20 -0.89 1 87 ILE -2.46 -0.42 1 88 SER 0.86 -0.50 1 89 THR 0.19 1.56 1 90 PHE -4.31 -1.73 1 91 THR 1.49 -0.31 1 93 SER 3.32 2.67 1 94 ASN 0.58 -0.37 1 97 GLN 0.65 0.76 1 98 ALA -0.96 -0.26 1 99 THR 0.40 1.84 1 100 VAL -1.51 -0.25 1 101 LEU -0.95 -1.45 1 102 THR -1.78 -0.41 1 103 TYR -4.61 -1.02 1 104 ASP -3.81 -2.66 1 105 TRP 2.15 0.44 1 106 SER 0.72 1.05 1 107 ALA 0.51 0.37 1 108 ASN 0.37 0.55 1 110 VAL 0.46 0.31 1 111 ASN -0.33 0.13 1 112 SER 0.01 0.20 1 113 ASN 0.22 1.81 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.42 _LACS_plot.Line_1_terminator_val_y_1 3.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 8.34 _LACS_plot.Line_2_terminator_val_y_2 -1.79 _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 84 HIS 3.69 -3.99 0 10 ILE 6.62 -0.63 1 11 GLN 5.12 -1.01 1 12 SER 3.88 0.19 1 13 GLU 1.16 1.02 1 14 HIS 6.93 -0.33 1 15 ARG 5.16 -1.32 1 16 GLU 3.49 -0.39 1 17 LEU 2.29 0.62 1 18 VAL 7.17 -1.98 1 19 SER 4.45 -1.15 1 20 ALA 2.70 0.14 1 21 ILE 5.99 -0.92 1 22 GLN 5.72 -1.72 1 23 SER 4.44 -0.72 1 24 TYR 4.47 -0.49 1 25 ILE 5.78 -0.92 1 27 ALA -0.82 0.21 1 28 GLN -0.27 -0.52 1 29 ASP 2.66 -0.33 1 30 ASP -2.29 0.57 1 32 THR 1.31 -0.32 1 33 ASN -0.77 0.80 1 35 SER 0.15 0.26 1 36 GLU -0.11 0.46 1 37 ILE 3.39 -1.27 1 38 THR -5.93 2.35 1 39 LEU 4.40 -0.93 1 40 ALA 3.62 -0.85 1 41 LYS 2.02 -0.07 1 42 LEU 0.67 -0.86 1 43 ALA 8.34 -1.61 1 45 TYR 0.39 -0.07 1 46 MET -1.18 0.55 1 47 SER 1.14 -0.16 1 48 LYS 1.24 -0.77 1 49 ASN 0.47 0.04 1 50 ALA 0.09 0.21 1 51 LYS 0.40 -0.21 1 52 ASN -0.13 0.11 1 53 GLU 1.66 -0.18 1 54 ASP 0.76 0.02 1 56 ILE 2.32 -0.70 1 57 VAL 6.09 -1.70 1 58 ASN 2.33 -0.66 1 59 SER 0.43 0.40 1 60 LEU -3.83 2.10 1 61 ALA -0.82 1.26 1 62 LYS -3.33 1.90 1 64 LYS 3.92 -1.27 1 65 SER 3.38 -0.86 1 67 ASN 5.22 -1.79 1 68 SER 0.29 -0.37 1 69 SER -0.76 0.19 1 70 THR 1.74 -0.60 1 71 SER 1.07 0.12 1 72 ALA -0.60 0.93 1 75 SER 0.16 0.96 1 76 ALA 0.73 0.84 1 77 HIS -4.61 3.47 1 78 GLN -4.42 1.66 1 79 ILE -0.91 -0.21 1 80 ASP -2.47 0.09 1 81 THR 4.90 -0.81 1 82 THR 5.25 -1.16 1 83 ASN -0.34 -0.38 1 85 LYS -6.42 4.43 1 86 LEU -3.20 2.31 1 87 ILE -2.46 2.04 1 88 SER 0.86 -1.36 1 89 THR 0.19 1.37 1 90 PHE -4.31 2.58 1 91 THR 1.49 -1.80 1 93 SER 3.32 -0.65 1 94 ASN 0.58 -0.95 1 97 GLN 0.65 0.11 1 98 ALA -0.96 0.70 1 99 THR 0.40 1.44 1 100 VAL -1.51 1.26 1 101 LEU -0.95 -0.50 1 102 THR -1.78 1.37 1 103 TYR -4.61 3.59 1 104 ASP -3.81 1.15 1 105 TRP 2.15 -1.71 1 106 SER 0.72 0.33 1 107 ALA 0.51 -0.14 1 108 ASN 0.37 0.18 1 110 VAL 0.46 -0.15 1 111 ASN -0.33 0.46 1 112 SER 0.01 0.19 1 113 ASN 0.22 1.59 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.42 _LACS_plot.Line_1_terminator_val_y_1 0.70 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 8.34 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _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 102 THR -1.78 1.21 0 10 ILE 6.62 -0.49 1 11 GLN 5.12 -0.39 1 12 SER 3.88 -0.39 1 13 GLU 1.16 -0.37 1 14 HIS 6.93 -0.81 1 15 ARG 5.16 -0.54 1 16 GLU 3.49 -0.31 1 17 LEU 2.29 -0.43 1 18 VAL 7.17 -1.21 1 19 SER 4.45 -0.36 1 20 ALA 2.70 -0.30 1 21 ILE 5.99 -0.95 1 22 GLN 5.72 -0.44 1 23 SER 4.44 -0.37 1 24 TYR 4.47 -1.25 1 25 ILE 5.78 -0.82 1 27 ALA -0.82 0.10 1 28 GLN -0.27 -0.31 1 29 ASP 2.66 -0.31 1 30 ASP -2.29 0.13 1 32 THR 1.31 -0.04 1 33 ASN -0.77 0.05 1 35 SER 0.15 -0.03 1 36 GLU -0.11 -0.07 1 37 ILE 3.39 -0.76 1 38 THR -5.93 0.20 1 39 LEU 4.40 -0.54 1 40 ALA 3.62 -0.31 1 41 LYS 2.02 -0.26 1 42 LEU 0.67 -0.05 1 43 ALA 8.34 -0.60 1 45 TYR 0.39 -0.12 1 46 MET -1.18 0.14 1 47 SER 1.14 -0.17 1 48 LYS 1.24 -0.04 1 49 ASN 0.47 -0.10 1 50 ALA 0.09 -0.04 1 51 LYS 0.40 0.00 1 52 ASN -0.13 -0.05 1 53 GLU 1.66 -0.18 1 54 ASP 0.76 -0.02 1 56 ILE 2.32 -0.09 1 57 VAL 6.09 -0.48 1 58 ASN 2.33 -0.06 1 59 SER 0.43 0.05 1 60 LEU -3.83 0.75 1 61 ALA -0.82 -0.21 1 62 LYS -3.33 0.56 1 64 LYS 3.92 -0.24 1 65 SER 3.38 -0.35 1 67 ASN 5.22 -0.31 1 68 SER 0.29 0.12 1 69 SER -0.76 -0.04 1 70 THR 1.74 0.11 1 71 SER 1.07 0.08 1 72 ALA -0.60 0.09 1 75 SER 0.16 0.00 1 76 ALA 0.73 -0.29 1 77 HIS -4.61 0.54 1 78 GLN -4.42 0.36 1 79 ILE -0.91 0.63 1 80 ASP -2.47 0.35 1 81 THR 4.90 -0.18 1 82 THR 5.25 -0.43 1 83 ASN -0.34 -0.28 1 85 LYS -6.42 1.00 1 86 LEU -3.20 0.87 1 87 ILE -2.46 0.98 1 89 THR 0.19 -0.30 1 90 PHE -4.31 0.06 1 91 THR 1.49 -0.41 1 93 SER 3.32 -0.31 1 94 ASN 0.58 0.00 1 97 GLN 0.65 -0.18 1 98 ALA -0.96 0.43 1 99 THR 0.40 0.16 1 100 VAL -1.51 0.51 1 101 LEU -0.95 0.32 1 103 TYR -4.61 0.55 1 104 ASP -3.81 0.54 1 105 TRP 2.15 -0.10 1 106 SER 0.72 -0.15 1 107 ALA 0.51 0.00 1 108 ASN 0.37 -0.02 1 110 VAL 0.46 0.02 1 111 ASN -0.33 0.10 1 112 SER 0.01 0.03 1 113 ASN 0.22 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.42 _LACS_plot.Line_1_terminator_val_y_1 -2.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.79 _LACS_plot.Line_2_terminator_val_x_2 8.34 _LACS_plot.Line_2_terminator_val_y_2 2.36 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 ALA 8.34 -0.02 0 84 HIS 3.69 -3.14 0 113 ASN 0.22 4.30 0 10 ILE 6.62 1.47 1 11 GLN 5.12 2.13 1 12 SER 3.88 3.57 1 13 GLU 1.16 1.73 1 14 HIS 6.93 1.72 1 15 ARG 5.16 2.94 1 16 GLU 3.49 2.96 1 17 LEU 2.29 0.79 1 18 VAL 7.17 1.67 1 19 SER 4.45 2.27 1 20 ALA 2.70 0.77 1 22 GLN 5.72 4.30 1 23 SER 4.44 0.54 1 24 TYR 4.47 2.69 1 25 ILE 5.78 2.34 1 27 ALA -0.82 0.09 1 28 GLN -0.27 -0.26 1 29 ASP 2.66 -0.02 1 30 ASP -2.29 -0.26 1 32 THR 1.31 -0.21 1 33 ASN -0.77 -1.76 1 35 SER 0.15 -0.49 1 36 GLU -0.11 -0.94 1 37 ILE 3.39 -2.19 1 38 THR -5.93 -0.63 1 39 LEU 4.40 0.99 1 40 ALA 3.62 3.25 1 41 LYS 2.02 0.47 1 42 LEU 0.67 0.43 1 45 TYR 0.39 -0.36 1 46 MET -1.18 -0.22 1 47 SER 1.14 0.44 1 48 LYS 1.24 -0.08 1 49 ASN 0.47 -0.38 1 50 ALA 0.09 -0.51 1 51 LYS 0.40 -0.44 1 52 ASN -0.13 0.56 1 53 GLU 1.66 -0.08 1 54 ASP 0.76 0.46 1 56 ILE 2.32 0.87 1 57 VAL 6.09 1.13 1 58 ASN 2.33 0.58 1 59 SER 0.43 -1.33 1 60 LEU -3.83 -0.41 1 61 ALA -0.82 -0.77 1 62 LYS -3.33 -0.18 1 64 LYS 3.92 1.41 1 65 SER 3.38 1.62 1 67 ASN 5.22 0.72 1 68 SER 0.29 -0.63 1 69 SER -0.76 1.80 1 70 THR 1.74 1.16 1 72 ALA -0.60 -2.17 1 75 SER 0.16 2.16 1 76 ALA 0.73 -3.65 1 77 HIS -4.61 -0.27 1 78 GLN -4.42 -1.43 1 79 ILE -0.91 -0.96 1 80 ASP -2.47 0.26 1 81 THR 4.90 2.20 1 82 THR 5.25 0.02 1 83 ASN -0.34 -2.76 1 85 LYS -6.42 -1.54 1 86 LEU -3.20 -2.91 1 87 ILE -2.46 0.77 1 88 SER 0.86 -1.41 1 89 THR 0.19 -4.05 1 90 PHE -4.31 -3.56 1 91 THR 1.49 -0.78 1 93 SER 3.32 0.38 1 94 ASN 0.58 0.52 1 97 GLN 0.65 0.08 1 98 ALA -0.96 0.43 1 99 THR 0.40 -1.59 1 100 VAL -1.51 -1.10 1 101 LEU -0.95 -2.42 1 102 THR -1.78 -0.83 1 103 TYR -4.61 -3.32 1 104 ASP -3.81 -0.04 1 105 TRP 2.15 0.36 1 106 SER 0.72 -0.23 1 107 ALA 0.51 -0.31 1 108 ASN 0.37 0.38 1 110 VAL 0.46 -0.34 1 111 ASN -0.33 -0.30 1 112 SER 0.01 -1.25 1 stop_ save_