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 bmr18624_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.62 _LACS_plot.Line_1_terminator_val_y_1 -3.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 7.21 _LACS_plot.Line_2_terminator_val_y_2 5.38 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 HIS 3.69 5.53 0 10 GLU -1.06 -0.14 1 11 THR 3.53 3.08 1 12 GLU -0.25 0.28 1 13 LEU -1.54 -0.39 1 14 LEU -3.04 -1.50 1 16 ILE 1.22 1.24 1 17 THR 1.58 0.52 1 18 GLU -0.43 -1.75 1 19 ALA 2.76 2.30 1 20 ASP 3.22 2.12 1 21 SER -0.04 0.35 1 22 ILE 0.77 0.42 1 24 SER -0.42 -2.00 1 25 ALA -5.78 -2.12 1 26 SER -2.64 -1.26 1 28 VAL -6.60 -4.55 1 29 TYR -4.24 -1.61 1 30 ALA -6.93 -2.71 1 31 VAL -1.30 -0.26 1 32 TYR -4.04 -1.47 1 33 ASP -1.64 -1.10 1 34 LYS 4.20 2.53 1 35 SER -0.35 -0.52 1 36 ASP 4.98 2.12 1 37 GLU -1.63 -1.24 1 38 LEU 3.10 1.37 1 39 GLN -1.03 0.60 1 40 PHE -3.67 -0.99 1 41 VAL -1.43 -1.70 1 43 ILE -4.47 -1.37 1 44 SER -2.82 -1.77 1 45 ARG 1.11 -0.04 1 46 ASN 1.15 -0.32 1 47 ILE 6.01 5.58 1 48 ALA 4.78 3.50 1 49 ALA 3.33 1.96 1 50 SER 6.38 4.37 1 51 VAL 7.22 5.21 1 52 SER 5.50 4.29 1 53 ALA 3.69 2.29 1 54 HIS 3.59 3.20 1 55 LEU 3.51 3.10 1 56 LYS 1.78 1.63 1 57 SER 1.25 2.23 1 58 VAL -1.19 -1.53 1 60 GLU 3.70 1.96 1 61 LEU -1.69 -0.72 1 64 SER -2.17 0.46 1 65 VAL -7.62 -3.41 1 66 LYS -4.25 0.05 1 67 VAL -3.40 -1.08 1 69 ILE 1.66 0.69 1 70 VAL -2.23 -1.41 1 71 GLU 0.91 1.40 1 72 GLU -0.37 0.28 1 74 ASP -1.52 -0.30 1 75 LYS 4.51 3.79 1 76 ALA 3.71 2.79 1 77 VAL 4.68 3.59 1 78 LEU 4.00 3.29 1 79 THR 6.76 5.57 1 80 GLN 4.44 3.35 1 81 ALA 3.76 2.51 1 82 TRP 5.56 4.71 1 83 LYS 3.33 3.15 1 84 LEU 3.73 3.09 1 85 TRP 3.00 3.29 1 86 ILE 5.97 4.05 1 87 GLU 4.51 3.37 1 88 GLU 3.21 3.06 1 90 ILE 4.63 4.21 1 91 LYS 4.40 3.57 1 92 VAL 3.46 3.13 1 93 THR -0.95 0.94 1 95 LYS -3.68 -1.21 1 96 VAL -0.41 -0.00 1 100 ASN -0.45 1.70 1 101 LYS 0.36 0.63 1 104 ASN -0.75 -0.39 1 105 ASN -0.63 -0.30 1 106 THR 4.85 4.34 1 107 PHE 2.41 1.34 1 108 VAL -0.25 0.12 1 109 LYS 0.87 0.51 1 110 VAL 0.30 0.04 1 111 THR 0.01 0.03 1 112 LEU 0.30 0.16 1 113 GLU -0.39 0.06 1 114 HIS -0.58 1.29 1 115 HIS -0.62 1.21 1 119 HIS 0.94 2.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18624_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.62 _LACS_plot.Line_1_terminator_val_y_1 4.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.83 _LACS_plot.Line_2_terminator_val_x_2 7.21 _LACS_plot.Line_2_terminator_val_y_2 -1.83 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 HIS 3.69 1.84 0 10 GLU -1.06 0.92 1 11 THR 3.53 -0.45 1 12 GLU -0.25 0.53 1 13 LEU -1.54 1.15 1 14 LEU -3.04 1.54 1 16 ILE 1.22 0.02 1 17 THR 1.58 -1.06 1 18 GLU -0.43 -1.32 1 19 ALA 2.76 -0.46 1 20 ASP 3.22 -1.10 1 21 SER -0.04 0.39 1 22 ILE 0.77 -0.35 1 24 SER -0.42 -1.58 1 25 ALA -5.78 3.66 1 26 SER -2.64 1.38 1 28 VAL -6.60 2.05 1 29 TYR -4.24 2.63 1 30 ALA -6.93 4.22 1 31 VAL -1.30 1.04 1 32 TYR -4.04 2.57 1 33 ASP -1.64 0.54 1 34 LYS 4.20 -1.67 1 35 SER -0.35 -0.17 1 36 ASP 4.98 -2.86 1 37 GLU -1.63 0.39 1 38 LEU 3.10 -1.73 1 39 GLN -1.03 1.63 1 40 PHE -3.67 2.68 1 41 VAL -1.43 -0.27 1 43 ILE -4.47 3.10 1 44 SER -2.82 1.05 1 45 ARG 1.11 -1.15 1 46 ASN 1.15 -1.47 1 47 ILE 6.01 -0.43 1 48 ALA 4.78 -1.28 1 49 ALA 3.33 -1.37 1 50 SER 6.38 -2.01 1 51 VAL 7.22 -2.01 1 52 SER 5.50 -1.21 1 53 ALA 3.69 -1.40 1 54 HIS 3.59 -0.39 1 55 LEU 3.51 -0.41 1 56 LYS 1.78 -0.15 1 57 SER 1.25 0.98 1 58 VAL -1.19 -0.34 1 60 GLU 3.70 -1.74 1 61 LEU -1.69 0.97 1 64 SER -2.17 2.63 1 65 VAL -7.62 4.21 1 66 LYS -4.25 4.30 1 67 VAL -3.40 2.32 1 69 ILE 1.66 -0.97 1 70 VAL -2.23 0.82 1 71 GLU 0.91 0.49 1 72 GLU -0.37 0.65 1 74 ASP -1.52 1.22 1 75 LYS 4.51 -0.72 1 76 ALA 3.71 -0.92 1 77 VAL 4.68 -1.09 1 78 LEU 4.00 -0.71 1 79 THR 6.76 -1.19 1 80 GLN 4.44 -1.09 1 81 ALA 3.76 -1.25 1 82 TRP 5.56 -0.85 1 83 LYS 3.33 -0.18 1 84 LEU 3.73 -0.64 1 85 TRP 3.00 0.29 1 86 ILE 5.97 -1.92 1 87 GLU 4.51 -1.14 1 88 GLU 3.21 -0.15 1 90 ILE 4.63 -0.42 1 91 LYS 4.40 -0.83 1 92 VAL 3.46 -0.33 1 93 THR -0.95 1.89 1 95 LYS -3.68 2.47 1 96 VAL -0.41 0.41 1 100 ASN -0.45 2.15 1 101 LYS 0.36 0.27 1 104 ASN -0.75 0.36 1 105 ASN -0.63 0.33 1 106 THR 4.85 -0.51 1 107 PHE 2.41 -1.07 1 108 VAL -0.25 0.37 1 109 LYS 0.87 -0.36 1 110 VAL 0.30 -0.26 1 111 THR 0.01 0.02 1 112 LEU 0.30 -0.14 1 113 GLU -0.39 0.45 1 114 HIS -0.58 1.87 1 115 HIS -0.62 1.83 1 119 HIS 0.94 1.76 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18624_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.62 _LACS_plot.Line_1_terminator_val_y_1 0.97 _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 0.24 _LACS_plot.Line_2_terminator_val_x_2 7.21 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _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 65 VAL -7.62 2.00 0 10 GLU -1.06 -0.14 1 11 THR 3.53 -0.27 1 12 GLU -0.25 -0.28 1 13 LEU -1.54 -0.16 1 14 LEU -3.04 0.31 1 16 ILE 1.22 -0.19 1 17 THR 1.58 -0.14 1 18 GLU -0.43 0.26 1 19 ALA 2.76 -0.36 1 20 ASP 3.22 -0.16 1 21 SER -0.04 0.02 1 22 ILE 0.77 -0.23 1 24 SER -0.42 0.30 1 25 ALA -5.78 0.36 1 26 SER -2.64 0.40 1 28 VAL -6.60 1.15 1 29 TYR -4.24 1.40 1 30 ALA -6.93 1.26 1 31 VAL -1.30 0.65 1 32 TYR -4.04 0.52 1 33 ASP -1.64 0.16 1 34 LYS 4.20 -0.08 1 35 SER -0.35 0.20 1 36 ASP 4.98 -0.46 1 37 GLU -1.63 0.35 1 38 LEU 3.10 -1.15 1 39 GLN -1.03 -0.19 1 40 PHE -3.67 -0.21 1 41 VAL -1.43 0.41 1 43 ILE -4.47 0.86 1 44 SER -2.82 0.29 1 45 ARG 1.11 0.18 1 46 ASN 1.15 -0.49 1 47 ILE 6.01 -1.03 1 48 ALA 4.78 -0.65 1 49 ALA 3.33 -0.29 1 50 SER 6.38 -0.50 1 51 VAL 7.22 -0.65 1 52 SER 5.50 -0.55 1 53 ALA 3.69 -0.19 1 54 HIS 3.59 -0.13 1 55 LEU 3.51 -0.32 1 56 LYS 1.78 -0.16 1 57 SER 1.25 0.03 1 58 VAL -1.19 0.37 1 60 GLU 3.70 -0.16 1 61 LEU -1.69 0.29 1 64 SER -2.17 0.66 1 66 LYS -4.25 0.84 1 67 VAL -3.40 1.00 1 69 ILE 1.66 -0.06 1 70 VAL -2.23 0.12 1 71 GLU 0.91 -0.23 1 72 GLU -0.37 -0.07 1 74 ASP -1.52 -0.09 1 75 LYS 4.51 -0.40 1 76 ALA 3.71 -0.15 1 77 VAL 4.68 -0.32 1 78 LEU 4.00 -0.38 1 79 THR 6.76 -0.45 1 80 GLN 4.44 -0.22 1 81 ALA 3.76 -0.34 1 82 TRP 5.56 -1.04 1 83 LYS 3.33 -0.83 1 84 LEU 3.73 -0.24 1 85 TRP 3.00 0.02 1 86 ILE 5.97 -0.65 1 87 GLU 4.51 -0.50 1 88 GLU 3.21 -0.28 1 89 HIS 3.69 -0.60 1 90 ILE 4.63 -0.69 1 91 LYS 4.40 -0.38 1 92 VAL 3.46 -0.27 1 93 THR -0.95 0.05 1 95 LYS -3.68 0.29 1 96 VAL -0.41 -0.32 1 100 ASN -0.45 0.49 1 101 LYS 0.36 0.01 1 104 ASN -0.75 0.10 1 105 ASN -0.63 0.43 1 106 THR 4.85 -0.69 1 107 PHE 2.41 -0.58 1 108 VAL -0.25 0.00 1 109 LYS 0.87 0.05 1 110 VAL 0.30 0.06 1 111 THR 0.01 0.02 1 112 LEU 0.30 -0.04 1 113 GLU -0.39 -0.18 1 114 HIS -0.58 -0.21 1 115 HIS -0.62 -0.56 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18624_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.62 _LACS_plot.Line_1_terminator_val_y_1 -2.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.69 _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 7.21 _LACS_plot.Line_2_terminator_val_y_2 2.30 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 HIS 3.69 5.44 0 10 GLU -1.06 -0.40 1 11 THR 3.53 -1.24 1 12 GLU -0.25 -1.48 1 13 LEU -1.54 -1.20 1 16 ILE 1.22 -0.68 1 17 THR 1.58 1.04 1 18 GLU -0.43 0.32 1 19 ALA 2.76 1.23 1 20 ASP 3.22 0.83 1 21 SER -0.04 -0.73 1 24 SER -0.42 -0.54 1 25 ALA -5.78 -2.26 1 26 SER -2.64 -0.43 1 28 VAL -6.60 -3.36 1 29 TYR -4.24 -3.95 1 30 ALA -6.93 -1.64 1 31 VAL -1.30 -1.95 1 32 TYR -4.04 0.60 1 33 ASP -1.64 2.54 1 34 LYS 4.20 0.49 1 35 SER -0.35 -1.50 1 36 ASP 4.98 -1.85 1 37 GLU -1.63 0.82 1 38 LEU 3.10 -1.52 1 39 GLN -1.03 0.08 1 40 PHE -3.67 -3.52 1 41 VAL -1.43 -1.42 1 43 ILE -4.47 0.00 1 44 SER -2.82 -0.74 1 45 ARG 1.11 -0.47 1 46 ASN 1.15 -0.04 1 47 ILE 6.01 0.39 1 48 ALA 4.78 2.35 1 49 ALA 3.33 3.70 1 50 SER 6.38 0.23 1 51 VAL 7.22 1.34 1 52 SER 5.50 2.10 1 53 ALA 3.69 4.06 1 54 HIS 3.59 3.02 1 55 LEU 3.51 0.87 1 56 LYS 1.78 1.30 1 57 SER 1.25 0.47 1 60 GLU 3.70 0.92 1 61 LEU -1.69 -2.94 1 64 SER -2.17 -2.57 1 65 VAL -7.62 -2.10 1 66 LYS -4.25 -0.10 1 67 VAL -3.40 -1.28 1 69 ILE 1.66 0.09 1 70 VAL -2.23 -0.91 1 71 GLU 0.91 -0.21 1 75 LYS 4.51 1.79 1 76 ALA 3.71 2.88 1 77 VAL 4.68 2.88 1 78 LEU 4.00 0.74 1 79 THR 6.76 1.58 1 80 GLN 4.44 2.05 1 81 ALA 3.76 -0.06 1 82 TRP 5.56 0.73 1 83 LYS 3.33 1.74 1 84 LEU 3.73 3.60 1 85 TRP 3.00 1.59 1 86 ILE 5.97 1.24 1 87 GLU 4.51 3.05 1 88 GLU 3.21 1.52 1 90 ILE 4.63 3.04 1 91 LYS 4.40 1.91 1 92 VAL 3.46 1.97 1 93 THR -0.95 1.88 1 95 LYS -3.68 -2.75 1 100 ASN -0.45 -1.03 1 105 ASN -0.63 0.76 1 106 THR 4.85 0.11 1 107 PHE 2.41 0.00 1 108 VAL -0.25 -0.67 1 109 LYS 0.87 0.21 1 110 VAL 0.30 -0.07 1 111 THR 0.01 -0.17 1 112 LEU 0.30 -0.32 1 113 GLU -0.39 -0.35 1 114 HIS -0.58 0.94 1 stop_ save_