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 bmr17579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 -4.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 6.36 _LACS_plot.Y_axis_chem_shift_offset -0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ALA 2.39 -2.53 0 10 LYS 4.47 3.95 1 11 THR 7.93 6.44 1 12 VAL 6.83 5.64 1 13 LYS 4.02 3.76 1 14 LYS 3.13 3.75 1 15 ALA 2.28 2.45 1 16 SER 4.79 3.91 1 17 LYS 4.09 3.09 1 18 ALA -0.75 -0.28 1 19 LYS 5.92 1.24 1 20 ASN -3.22 -1.48 1 21 VAL -3.52 -0.89 1 22 LYS -2.39 -1.51 1 23 ARG -2.75 0.10 1 25 VAL 6.09 5.34 1 26 LYS 5.03 4.29 1 27 GLU 2.37 2.52 1 28 VAL 7.27 6.00 1 29 VAL 6.90 5.55 1 30 LYS 4.09 3.79 1 31 ALA 2.68 2.79 1 32 LEU 2.87 3.02 1 33 ARG 4.53 3.58 1 34 LYS 0.68 0.59 1 36 GLU 1.38 1.10 1 37 LYS -3.94 -1.90 1 39 LEU -5.37 -0.41 1 40 VAL 0.35 0.31 1 41 VAL -2.12 -1.18 1 42 ILE -2.72 -1.26 1 43 ALA -0.60 -0.10 1 45 ASP 0.29 -1.40 1 46 ILE -1.56 -1.22 1 47 SER -2.93 -0.96 1 49 ALA 1.91 2.20 1 50 ASP 2.54 2.00 1 51 VAL 3.47 3.04 1 52 ILE -3.19 -0.94 1 53 SER 4.75 3.55 1 54 HIS -2.71 1.55 1 55 ILE -0.19 3.53 1 57 VAL 5.37 4.16 1 58 LEU 1.85 2.84 1 60 GLU 4.10 3.31 1 61 ASP 3.37 3.35 1 62 HIS 1.35 2.42 1 63 SER 3.16 0.96 1 64 VAL -3.41 -0.88 1 66 TYR -7.11 -3.91 1 67 ILE -2.10 -1.18 1 68 PHE -0.31 -0.80 1 69 ILE 1.92 1.81 1 71 SER 4.73 2.58 1 72 LYS 4.08 3.13 1 73 GLN 3.00 1.44 1 75 LEU 1.80 1.43 1 77 ALA 1.12 1.25 1 78 ALA 0.26 0.98 1 81 THR 0.61 1.42 1 86 SER -2.85 -2.38 1 87 VAL -6.44 -2.98 1 88 VAL -7.93 -4.74 1 89 PHE -0.29 0.69 1 90 ILE -1.49 -1.10 1 91 VAL 1.20 4.59 1 95 ASN 6.21 2.86 1 96 LYS 4.87 2.35 1 97 LYS 0.98 1.03 1 98 LYS -0.27 0.20 1 99 ASP 0.79 0.68 1 101 LYS 0.55 0.72 1 102 ASN 0.63 0.44 1 103 LYS 0.77 0.85 1 104 GLU 5.21 7.43 1 106 GLU -1.05 -0.32 1 107 TYR 4.60 3.79 1 108 LYS 4.26 3.60 1 109 GLU 4.20 3.69 1 110 SER 4.54 4.80 1 111 PHE 4.04 3.13 1 112 ASN 2.95 3.11 1 113 GLU 7.07 4.78 1 114 VAL 7.52 6.10 1 115 VAL 4.37 3.75 1 116 LYS 3.53 3.58 1 117 GLU 6.69 5.85 1 118 VAL 5.16 4.02 1 119 GLN 3.41 2.76 1 120 ALA 2.46 2.56 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 3.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.92 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 -1.56 _LACS_plot.Y_axis_chem_shift_offset -0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ALA 2.39 -4.92 0 10 LYS 4.47 -0.52 1 11 THR 7.93 -1.49 1 12 VAL 6.83 -1.19 1 13 LYS 4.02 -0.26 1 14 LYS 3.13 0.62 1 15 ALA 2.28 0.17 1 16 SER 4.79 -0.88 1 17 LYS 4.09 -1.00 1 18 ALA -0.75 0.47 1 19 LYS 5.92 -4.68 1 20 ASN -3.22 1.74 1 21 VAL -3.52 2.63 1 22 LYS -2.39 0.88 1 23 ARG -2.75 2.85 1 25 VAL 6.09 -0.75 1 26 LYS 5.03 -0.74 1 27 GLU 2.37 0.15 1 28 VAL 7.27 -1.27 1 29 VAL 6.90 -1.35 1 30 LYS 4.09 -0.30 1 31 ALA 2.68 0.11 1 32 LEU 2.87 0.15 1 33 ARG 4.53 -0.95 1 34 LYS 0.68 -0.09 1 36 GLU 1.38 -0.28 1 37 LYS -3.94 2.04 1 39 LEU -5.37 4.96 1 40 VAL 0.35 -0.04 1 41 VAL -2.12 0.94 1 42 ILE -2.72 1.46 1 43 ALA -0.60 0.50 1 45 ASP 0.29 -1.69 1 46 ILE -1.56 0.34 1 47 SER -2.93 1.97 1 49 ALA 1.91 0.29 1 50 ASP 2.54 -0.54 1 51 VAL 3.47 -0.43 1 52 ILE -3.19 2.25 1 53 SER 4.75 -1.20 1 54 HIS -2.71 4.26 1 55 ILE -0.19 3.72 1 57 VAL 5.37 -1.21 1 58 LEU 1.85 0.99 1 60 GLU 4.10 -0.79 1 61 ASP 3.37 -0.02 1 62 HIS 1.35 1.07 1 63 SER 3.16 -2.20 1 64 VAL -3.41 2.53 1 66 TYR -7.11 3.20 1 67 ILE -2.10 0.92 1 68 PHE -0.31 -0.49 1 69 ILE 1.92 -0.11 1 71 SER 4.73 -2.15 1 72 LYS 4.08 -0.95 1 73 GLN 3.00 -1.56 1 75 LEU 1.80 -0.37 1 77 ALA 1.12 0.13 1 78 ALA 0.26 0.72 1 81 THR 0.61 0.81 1 86 SER -2.85 0.47 1 87 VAL -6.44 3.46 1 88 VAL -7.93 3.19 1 89 PHE -0.29 0.98 1 90 ILE -1.49 0.39 1 91 VAL 1.20 3.39 1 95 ASN 6.21 -3.35 1 96 LYS 4.87 -2.52 1 97 LYS 0.98 0.05 1 98 LYS -0.27 0.47 1 99 ASP 0.79 -0.11 1 101 LYS 0.55 0.17 1 102 ASN 0.63 -0.19 1 103 LYS 0.77 0.08 1 104 GLU 5.21 2.22 1 106 GLU -1.05 0.73 1 107 TYR 4.60 -0.81 1 108 LYS 4.26 -0.66 1 109 GLU 4.20 -0.51 1 110 SER 4.54 0.26 1 111 PHE 4.04 -0.91 1 112 ASN 2.95 0.16 1 113 GLU 7.07 -2.29 1 114 VAL 7.52 -1.42 1 115 VAL 4.37 -0.62 1 116 LYS 3.53 0.05 1 117 GLU 6.69 -0.84 1 118 VAL 5.16 -1.14 1 119 GLN 3.41 -0.65 1 120 ALA 2.46 0.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 0.94 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _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 68 PHE -0.31 -1.46 0 10 LYS 4.47 -0.31 1 11 THR 7.93 -0.02 1 12 VAL 6.83 -0.89 1 13 LYS 4.02 -0.49 1 14 LYS 3.13 -0.37 1 15 ALA 2.28 -0.85 1 16 SER 4.79 0.23 1 17 LYS 4.09 -0.27 1 18 ALA -0.75 -0.04 1 19 LYS 5.92 -0.29 1 20 ASN -3.22 0.35 1 21 VAL -3.52 0.74 1 22 LYS -2.39 0.36 1 23 ARG -2.75 0.51 1 25 VAL 6.09 0.00 1 26 LYS 5.03 -0.42 1 27 GLU 2.37 -0.41 1 28 VAL 7.27 -0.64 1 29 VAL 6.90 -0.79 1 30 LYS 4.09 -0.47 1 31 ALA 2.68 -0.27 1 32 LEU 2.87 -0.36 1 33 ARG 4.53 -0.55 1 34 LYS 0.68 -0.09 1 36 GLU 1.38 -0.15 1 37 LYS -3.94 0.54 1 39 LEU -5.37 0.65 1 40 VAL 0.35 0.53 1 41 VAL -2.12 0.52 1 42 ILE -2.72 0.29 1 43 ALA -0.60 0.15 1 45 ASP 0.29 0.22 1 46 ILE -1.56 -0.10 1 47 SER -2.93 -0.15 1 49 ALA 1.91 -0.34 1 50 ASP 2.54 -0.30 1 51 VAL 3.47 -0.20 1 52 ILE -3.19 0.40 1 53 SER 4.75 0.07 1 54 HIS -2.71 -0.14 1 55 ILE -0.19 0.13 1 57 VAL 5.37 -0.55 1 58 LEU 1.85 -0.14 1 60 GLU 4.10 -0.84 1 61 ASP 3.37 -0.33 1 62 HIS 1.35 -0.15 1 63 SER 3.16 -0.37 1 64 VAL -3.41 -0.28 1 66 TYR -7.11 1.35 1 67 ILE -2.10 1.33 1 69 ILE 1.92 -0.21 1 71 SER 4.73 -0.13 1 72 LYS 4.08 -0.34 1 73 GLN 3.00 -0.38 1 75 LEU 1.80 -0.21 1 77 ALA 1.12 -0.13 1 78 ALA 0.26 -0.22 1 80 ALA 2.39 0.11 1 81 THR 0.61 -0.14 1 86 SER -2.85 1.08 1 87 VAL -6.44 0.97 1 88 VAL -7.93 0.99 1 89 PHE -0.29 0.09 1 90 ILE -1.49 0.13 1 91 VAL 1.20 -0.78 1 95 ASN 6.21 -0.23 1 96 LYS 0.98 -0.08 1 98 LYS -0.27 -0.06 1 99 ASP 0.79 -0.04 1 101 LYS 0.55 -0.03 1 102 ASN 0.63 -0.07 1 103 LYS 5.21 -0.08 1 106 GLU -1.05 0.45 1 107 TYR 4.60 -0.69 1 108 LYS 4.26 -0.30 1 109 GLU 4.20 -0.15 1 110 SER 4.54 -0.60 1 111 PHE 4.04 -0.49 1 112 ASN 2.95 -0.33 1 113 GLU 7.07 -0.58 1 114 VAL 7.52 -0.96 1 115 VAL 4.37 -0.30 1 116 LYS 3.53 -0.30 1 117 GLU 6.69 -0.66 1 118 VAL 5.16 -0.35 1 119 GLN 3.41 -0.84 1 120 ALA 2.46 -0.36 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.93 _LACS_plot.Line_1_terminator_val_y_1 -3.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.50 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 2.71 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 TYR -7.11 -5.40 0 47 SER -2.93 3.82 0 10 LYS 4.47 2.25 1 11 THR 7.93 1.51 1 12 VAL 6.83 1.61 1 14 LYS 3.13 3.01 1 15 ALA 2.28 2.17 1 16 SER 4.79 4.11 1 17 LYS 4.09 0.96 1 18 ALA -0.75 -2.55 1 19 LYS 5.92 0.59 1 20 ASN -3.22 -2.02 1 21 VAL -3.52 -0.77 1 22 LYS -2.39 -1.04 1 23 ARG -2.75 -0.16 1 25 VAL 6.09 0.07 1 26 LYS 5.03 3.63 1 27 GLU 2.37 3.50 1 28 VAL 7.27 0.67 1 29 VAL 6.90 1.41 1 30 LYS 4.09 2.09 1 31 ALA 2.68 1.95 1 32 LEU 2.87 3.32 1 33 ARG 4.53 2.17 1 34 LYS 0.68 0.40 1 36 GLU 1.38 -0.98 1 37 LYS -3.94 -0.62 1 39 LEU -5.37 -2.95 1 40 VAL 0.35 -2.43 1 41 VAL -2.12 -2.37 1 42 ILE -2.72 -1.43 1 43 ALA -0.60 0.18 1 45 ASP 0.29 0.20 1 46 ILE -1.56 -2.58 1 49 ALA 1.91 0.90 1 50 ASP 2.54 1.42 1 51 VAL 3.47 0.67 1 52 ILE -3.19 1.72 1 54 HIS -2.71 2.43 1 57 VAL 5.37 1.70 1 58 LEU 1.85 2.85 1 60 GLU 4.10 4.14 1 61 ASP 3.37 1.70 1 62 HIS 1.35 -0.37 1 63 SER 3.16 -0.81 1 64 VAL -3.41 -0.56 1 67 ILE -2.10 0.57 1 68 PHE -0.31 0.39 1 69 ILE 1.92 0.51 1 71 SER 3.00 1.35 1 75 LEU 1.80 1.55 1 77 ALA 1.12 -0.43 1 78 ALA 0.26 -1.27 1 80 ALA 0.61 -1.67 1 86 SER -2.85 -3.83 1 87 VAL -6.44 -3.09 1 88 VAL -7.93 -0.91 1 89 PHE -0.29 -2.53 1 90 ILE -1.49 -1.07 1 91 VAL 1.20 3.46 1 95 ASN 6.21 1.69 1 96 LYS 4.87 0.33 1 97 LYS 0.98 0.01 1 98 LYS -0.27 0.60 1 99 ASP 0.79 -1.45 1 101 LYS 0.55 0.65 1 102 ASN -1.05 -0.52 1 107 TYR 4.60 1.06 1 108 LYS 4.26 2.98 1 109 GLU 4.20 1.92 1 110 SER 4.54 0.20 1 111 PHE 4.04 3.11 1 112 ASN 2.95 2.81 1 113 GLU 7.07 1.31 1 114 VAL 7.52 1.20 1 115 VAL 4.37 3.26 1 116 LYS 3.53 2.93 1 117 GLU 6.69 1.68 1 118 VAL 5.16 2.98 1 119 GLN 3.41 2.96 1 stop_ save_