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 bmr17578_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.98 _LACS_plot.Line_1_terminator_val_y_1 -5.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 7.83 _LACS_plot.Line_2_terminator_val_y_2 5.91 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ALA 0.44 -4.58 0 10 LYS 4.39 3.72 1 12 VAL 6.59 5.13 1 13 LYS 4.35 3.80 1 14 LYS 3.32 3.61 1 15 ALA 2.39 2.21 1 16 SER 4.63 3.38 1 17 LYS 3.87 2.73 1 18 ALA -0.97 -0.68 1 19 LYS 5.73 1.02 1 20 ASN -3.30 -1.88 1 21 VAL -3.77 -1.30 1 22 LYS -2.29 -1.72 1 23 ARG -2.74 -0.13 1 25 VAL 6.69 5.84 1 26 LYS 5.02 3.96 1 27 GLU 2.25 2.19 1 28 VAL 7.42 5.90 1 29 VAL 6.93 5.26 1 30 LYS 3.99 3.61 1 31 ALA 2.75 2.55 1 32 LEU 2.72 2.76 1 33 ARG 4.45 3.31 1 34 LYS 0.74 0.35 1 36 GLU 1.27 0.81 1 37 LYS -4.09 -2.41 1 39 LEU -5.37 -0.74 1 40 VAL 0.38 0.07 1 41 VAL -1.75 -1.30 1 42 ILE -2.58 -1.40 1 43 ALA -0.53 -0.13 1 45 ASP 0.47 -1.51 1 46 ILE -2.31 -1.86 1 47 TRP -3.56 -0.31 1 49 ALA 1.38 1.68 1 50 ASP 2.62 1.58 1 51 VAL 3.91 3.13 1 52 ILE -3.23 -1.29 1 53 SER 4.87 3.46 1 54 HIS 0.26 1.79 1 55 ILE 5.00 3.70 1 57 VAL 1.97 2.74 1 58 LEU 3.86 3.16 1 60 GLU 3.55 3.03 1 61 ASP 1.29 2.29 1 62 HIS 2.94 0.54 1 63 SER -3.45 -0.82 1 64 VAL -7.39 -4.40 1 66 TYR -9.98 -5.66 1 67 ILE -1.89 -1.60 1 68 PHE -0.47 -0.87 1 69 ILE -3.83 -2.93 1 71 SER 4.56 2.42 1 72 LYS 3.99 2.92 1 73 GLN 3.44 2.74 1 74 ASP 3.15 1.98 1 75 LEU 1.77 1.15 1 77 ALA 1.20 1.00 1 78 ALA 0.30 0.69 1 81 THR 0.69 1.27 1 86 SER -2.62 -2.79 1 87 VAL -6.31 -3.28 1 88 VAL -7.91 -5.12 1 89 PHE -0.23 0.50 1 90 ILE -1.42 -1.42 1 91 VAL 1.18 4.24 1 95 ASN 6.08 2.55 1 96 LYS 4.62 2.21 1 97 LYS 4.19 2.07 1 98 LYS 0.59 1.39 1 99 ASP 0.97 0.56 1 103 LYS 0.64 0.63 1 104 GLU -1.06 -0.70 1 107 TYR 4.65 3.42 1 108 LYS 4.17 3.27 1 109 GLU 4.53 4.46 1 111 PHE 4.02 2.78 1 112 ASN 2.90 2.78 1 113 GLU 5.95 4.42 1 114 VAL 7.83 5.78 1 115 VAL 4.24 3.49 1 116 LYS 3.57 3.33 1 117 GLU 6.30 5.00 1 118 VAL 4.87 3.95 1 119 GLN 3.72 2.57 1 120 ALA 2.42 2.31 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17578_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.98 _LACS_plot.Line_1_terminator_val_y_1 4.35 _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 0.89 _LACS_plot.Line_2_terminator_val_x_2 7.83 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ALA 0.44 -5.02 0 10 LYS 4.39 -0.67 1 12 VAL 6.59 -1.46 1 13 LYS 4.35 -0.55 1 14 LYS 3.32 0.29 1 15 ALA 2.39 -0.18 1 16 SER 4.63 -1.25 1 17 LYS 3.87 -1.14 1 18 ALA -0.97 0.29 1 19 LYS 5.73 -4.71 1 20 ASN -3.30 1.42 1 21 VAL -3.77 2.47 1 22 LYS -2.29 0.57 1 23 ARG -2.74 2.61 1 25 VAL 6.69 -0.85 1 26 LYS 5.02 -1.06 1 27 GLU 2.25 -0.06 1 28 VAL 7.42 -1.52 1 29 VAL 6.93 -1.67 1 30 LYS 3.99 -0.38 1 31 ALA 2.75 -0.20 1 32 LEU 2.72 0.04 1 33 ARG 4.45 -1.14 1 34 LYS 0.74 -0.39 1 36 GLU 1.27 -0.46 1 37 LYS -4.09 1.68 1 39 LEU -5.37 4.63 1 40 VAL 0.38 -0.31 1 41 VAL -1.75 0.45 1 42 ILE -2.58 1.18 1 43 ALA -0.53 0.40 1 45 ASP 0.47 -1.98 1 46 ILE -2.31 0.45 1 47 TRP -3.56 3.25 1 49 ALA 1.38 0.30 1 50 ASP 2.62 -1.04 1 51 VAL 3.91 -0.78 1 52 ILE -3.23 1.94 1 53 SER 4.87 -1.41 1 54 HIS 0.26 1.53 1 55 ILE 5.00 -1.30 1 57 VAL 1.97 0.77 1 58 LEU 3.86 -0.70 1 60 GLU 3.55 -0.52 1 61 ASP 1.29 1.00 1 62 HIS 2.94 -2.40 1 63 SER -3.45 2.63 1 64 VAL -7.39 2.99 1 66 TYR -9.98 4.32 1 67 ILE -1.89 0.29 1 68 PHE -0.47 -0.40 1 69 ILE -3.83 0.90 1 71 SER 4.56 -2.14 1 72 LYS 3.99 -1.07 1 73 GLN 3.44 -0.70 1 74 ASP 3.15 -1.17 1 75 LEU 1.77 -0.62 1 77 ALA 1.20 -0.20 1 78 ALA 0.30 0.39 1 81 THR 0.69 0.58 1 86 SER -2.62 -0.17 1 87 VAL -6.31 3.03 1 88 VAL -7.91 2.79 1 89 PHE -0.23 0.73 1 90 ILE -1.42 0.00 1 91 VAL 1.18 3.06 1 95 ASN 6.08 -3.53 1 96 LYS 4.62 -2.41 1 97 LYS 4.19 -2.12 1 98 LYS 0.59 0.80 1 99 ASP 0.97 -0.41 1 103 LYS 0.64 -0.01 1 104 GLU -1.06 0.36 1 107 TYR 4.65 -1.23 1 108 LYS 4.17 -0.90 1 109 GLU 4.53 -0.07 1 111 PHE 4.02 -1.24 1 112 ASN 2.90 -0.12 1 113 GLU 5.95 -1.53 1 114 VAL 7.83 -2.05 1 115 VAL 4.24 -0.75 1 116 LYS 3.57 -0.24 1 117 GLU 6.30 -1.30 1 118 VAL 4.87 -0.92 1 119 GLN 3.72 -1.15 1 120 ALA 2.42 -0.11 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17578_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.98 _LACS_plot.Line_1_terminator_val_y_1 1.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 7.83 _LACS_plot.Line_2_terminator_val_y_2 -0.80 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 TYR -9.98 0.33 0 10 LYS 4.39 -0.29 1 12 VAL 6.59 -0.89 1 13 LYS 4.35 -0.06 1 14 LYS 3.32 -0.35 1 15 ALA 2.39 -0.82 1 16 SER 4.63 0.26 1 17 LYS 3.87 -0.25 1 18 ALA -0.97 -0.03 1 19 LYS 5.73 -0.29 1 20 ASN -3.30 0.36 1 21 VAL -3.77 0.82 1 22 LYS -2.29 0.39 1 23 ARG -2.74 0.50 1 25 VAL 6.69 -0.96 1 26 LYS 5.02 -0.40 1 27 GLU 2.25 -0.39 1 28 VAL 7.42 -0.62 1 29 VAL 6.93 -0.76 1 30 LYS 3.99 -0.44 1 31 ALA 2.75 -0.25 1 32 LEU 2.72 -0.49 1 33 ARG 4.45 -0.54 1 34 LYS 0.74 -0.07 1 36 GLU 1.27 -0.12 1 37 LYS -4.09 0.58 1 39 LEU -5.37 0.65 1 40 VAL 0.38 0.52 1 41 VAL -1.75 0.54 1 42 ILE -2.58 0.27 1 43 ALA -0.53 0.14 1 45 ASP 0.47 0.28 1 46 ILE -2.31 0.01 1 47 TRP -3.56 -0.40 1 49 ALA 1.38 -0.35 1 50 ASP 2.62 -0.34 1 51 VAL 3.91 -0.28 1 52 ILE -3.23 0.47 1 53 SER 4.87 0.10 1 54 HIS 0.26 -0.16 1 55 ILE 5.00 -0.55 1 57 VAL 1.97 -0.11 1 58 LEU 3.86 -0.14 1 60 GLU 3.55 -0.35 1 61 ASP 1.29 -0.23 1 62 HIS 2.94 0.02 1 63 SER -3.45 0.28 1 64 VAL -7.39 1.37 1 67 ILE -1.89 0.47 1 68 PHE -0.47 0.48 1 69 ILE -3.83 0.76 1 71 SER 4.56 -0.13 1 72 LYS 3.99 -0.33 1 73 GLN 3.44 -0.29 1 74 ASP 3.15 -0.37 1 75 LEU 1.77 -0.14 1 77 ALA 1.20 -0.11 1 78 ALA 0.30 -0.26 1 80 ALA 0.69 -0.19 1 86 SER -2.62 1.08 1 87 VAL -6.31 0.98 1 88 VAL -7.91 1.02 1 89 PHE -0.23 0.10 1 90 ILE -1.42 0.15 1 91 VAL 6.08 -0.30 1 96 LYS 0.97 -0.08 1 103 LYS -1.06 0.47 1 107 TYR 4.65 -0.69 1 108 LYS 4.17 0.39 1 109 GLU 4.53 -0.60 1 111 PHE 4.02 -0.47 1 112 ASN 2.90 -0.33 1 113 GLU 5.95 -0.56 1 114 VAL 7.83 -0.96 1 115 VAL 4.24 -0.29 1 116 LYS 3.57 -0.30 1 117 GLU 6.30 -0.70 1 118 VAL 4.87 -0.36 1 119 GLN 3.72 -0.10 1 120 ALA 2.42 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17578_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.98 _LACS_plot.Line_1_terminator_val_y_1 -4.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 7.83 _LACS_plot.Line_2_terminator_val_y_2 2.31 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 PHE -7.91 -1.11 0 67 ILE -9.98 -4.04 0 13 LYS 4.35 3.21 1 16 SER 4.63 3.96 1 17 LYS 3.87 0.78 1 18 ALA -0.97 -2.74 1 20 ASN -3.30 -2.23 1 21 VAL -3.77 -0.89 1 22 LYS -2.29 -1.21 1 23 ARG -2.74 -0.37 1 25 VAL 6.69 0.26 1 26 LYS 5.02 3.53 1 29 VAL 6.93 1.25 1 31 ALA 2.75 1.80 1 34 LYS 0.74 0.23 1 36 GLU 1.27 -1.20 1 37 LYS -4.09 -0.79 1 39 LEU -5.37 -3.22 1 40 VAL 0.38 -2.63 1 41 VAL -1.75 -2.63 1 42 ILE -2.58 -1.58 1 43 ALA -0.53 -0.22 1 46 ILE -2.31 -3.51 1 50 ASP 2.62 1.13 1 51 VAL 3.91 -0.07 1 52 ILE -3.23 1.63 1 58 LEU 1.97 2.65 1 61 ASP 3.55 1.59 1 62 HIS 1.29 -0.55 1 63 SER 2.94 -0.65 1 68 PHE -1.89 0.37 1 75 LEU 3.15 1.15 1 88 VAL -6.31 -3.31 1 90 ILE -0.23 -2.75 1 95 ASN 1.18 3.22 1 107 TYR -1.06 -0.48 1 111 PHE 4.53 -0.05 1 115 VAL 7.83 0.97 1 stop_ save_