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 bmr30102_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.56 _LACS_plot.Line_1_terminator_val_y_1 -1.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 -1.37 _LACS_plot.Line_2_terminator_val_x_2 5.80 _LACS_plot.Line_2_terminator_val_y_2 4.71 _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 44 ASP -4.56 -1.66 0 10 ASP 5.18 4.20 1 11 GLU 4.88 4.18 1 12 ALA 2.62 2.44 1 13 PHE 4.06 4.44 1 14 ILE 5.08 5.13 1 15 GLU 2.10 0.87 1 16 GLN 4.58 3.28 1 17 PHE 3.80 3.16 1 18 ARG 4.56 4.65 1 19 GLN 4.54 2.88 1 20 GLU 3.97 2.62 1 21 LEU 2.46 2.35 1 22 LEU 2.50 2.33 1 23 ASN -0.66 0.89 1 24 ASN -0.60 -1.06 1 25 GLN 4.50 3.46 1 26 MET 4.45 3.32 1 27 LEU 2.20 2.21 1 28 ARG 5.45 4.75 1 29 SER 4.41 3.71 1 30 GLN 2.87 2.45 1 31 LEU 2.18 2.20 1 32 ILE 3.34 2.84 1 33 LEU 2.32 1.67 1 34 GLN -0.62 0.91 1 35 ILE -0.40 -0.55 1 38 LEU 3.42 3.42 1 39 ASN 4.15 3.34 1 40 ASP 1.91 1.98 1 41 LEU 0.39 2.04 1 42 VAL 3.16 2.16 1 43 ASN 0.29 0.84 1 46 LEU 3.55 2.63 1 47 LEU 2.49 2.37 1 48 PHE 5.81 5.78 1 49 ARG 4.61 4.19 1 50 GLU 2.39 2.99 1 51 ARG 1.39 1.10 1 52 LEU -1.34 -1.05 1 55 LEU 3.07 2.68 1 56 ILE 4.47 3.41 1 57 LEU 3.89 2.16 1 58 GLN 4.22 3.12 1 59 ARG 2.86 1.56 1 60 ARG 3.11 2.65 1 61 TYR 0.63 0.29 1 64 TYR 0.26 0.20 1 65 ASN 0.32 0.32 1 66 THR 0.48 0.15 1 67 ALA 0.03 0.40 1 68 MET 0.10 0.11 1 69 ASN 0.49 0.31 1 71 PHE -2.44 -1.53 1 73 ILE 1.59 0.39 1 75 GLN 4.11 3.09 1 76 ASP 3.90 2.53 1 77 GLU 2.55 2.19 1 78 TYR 4.86 4.86 1 79 THR 5.31 4.45 1 80 ARG 4.15 3.63 1 81 LEU 2.71 2.66 1 82 MET 0.72 -0.37 1 83 ALA 1.23 1.06 1 84 ASN -0.48 0.09 1 86 ASP -0.33 0.07 1 87 ASP -1.30 0.34 1 89 ASP 3.65 3.02 1 90 ASN 3.76 2.30 1 91 LYS 4.34 3.89 1 92 LYS 3.32 2.95 1 93 ARG 3.06 2.00 1 94 ILE 4.92 4.43 1 95 ALA 3.89 2.85 1 96 GLU 2.46 2.30 1 97 LEU 3.55 2.36 1 98 LEU 2.86 2.34 1 99 ASP 2.66 2.38 1 100 GLN 2.89 2.29 1 101 GLN 2.72 2.31 1 102 ALA 2.31 1.73 1 103 ILE 2.94 2.52 1 104 ASP 2.51 2.68 1 105 GLU 2.49 2.37 1 106 GLN 3.12 2.38 1 107 LEU 2.50 2.00 1 108 ARG 3.10 2.56 1 109 ASN 1.18 1.22 1 110 ALA 0.44 0.88 1 111 ILE 0.55 0.62 1 112 GLU -0.50 -0.03 1 113 TYR -0.26 0.16 1 114 THR -1.09 -0.64 1 116 GLU 0.31 1.64 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30102_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.56 _LACS_plot.Line_1_terminator_val_y_1 2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.76 _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 5.80 _LACS_plot.Line_2_terminator_val_y_2 -1.09 _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 44 ASP -4.56 2.90 0 10 ASP 5.18 -0.98 1 11 GLU 4.88 -0.70 1 12 ALA 2.62 -0.18 1 13 PHE 4.06 0.38 1 14 ILE 5.08 0.05 1 15 GLU 2.10 -1.23 1 16 GLN 4.58 -1.30 1 17 PHE 3.80 -0.64 1 18 ARG 4.56 0.09 1 19 GLN 4.54 -1.66 1 20 GLU 3.97 -1.35 1 21 LEU 2.46 -0.11 1 22 LEU 2.50 -0.17 1 23 ASN -0.66 1.55 1 24 ASN -0.60 -0.46 1 25 GLN 4.50 -1.04 1 26 MET 4.45 -1.13 1 27 LEU 2.20 0.01 1 28 ARG 5.45 -0.70 1 29 SER 4.41 -0.70 1 30 GLN 2.87 -0.42 1 31 LEU 2.18 0.02 1 32 ILE 3.34 -0.50 1 33 LEU 2.32 -0.65 1 34 GLN -0.62 1.53 1 35 ILE -0.40 -0.15 1 38 LEU 3.42 0.00 1 39 ASN 4.15 -0.81 1 40 ASP 1.91 0.07 1 41 LEU 0.39 1.65 1 42 VAL 3.16 -1.00 1 43 ASN 0.29 0.55 1 46 LEU 3.55 -0.92 1 47 LEU 2.49 -0.12 1 48 PHE 5.81 -0.03 1 49 ARG 4.61 -0.42 1 50 GLU 2.39 0.60 1 51 ARG 1.39 -0.29 1 52 LEU -1.34 0.29 1 55 LEU 3.07 -0.39 1 56 ILE 4.47 -1.06 1 57 LEU 3.89 -1.73 1 58 GLN 4.22 -1.10 1 59 ARG 2.86 -1.30 1 60 ARG 3.11 -0.46 1 61 TYR 0.63 -0.34 1 64 TYR 0.26 -0.06 1 65 ASN 0.32 0.00 1 66 THR 0.48 -0.33 1 67 ALA 0.03 0.37 1 68 MET 0.10 0.01 1 69 ASN 0.49 -0.18 1 71 PHE -2.44 0.91 1 73 ILE 1.59 -1.20 1 75 GLN 4.11 -1.02 1 76 ASP 3.90 -1.37 1 77 GLU 2.55 -0.36 1 78 TYR 4.86 0.00 1 79 THR 5.31 -0.86 1 80 ARG 4.15 -0.52 1 81 LEU 2.71 -0.05 1 82 MET 0.72 -1.09 1 83 ALA 1.23 -0.17 1 84 ASN -0.48 0.57 1 86 ASP -0.33 0.40 1 87 ASP -1.30 1.64 1 89 ASP 3.65 -0.63 1 90 ASN 3.76 -1.46 1 91 LYS 4.34 -0.45 1 92 LYS 3.32 -0.37 1 93 ARG 3.06 -1.06 1 94 ILE 4.92 -0.49 1 95 ALA 3.89 -1.04 1 96 GLU 2.46 -0.16 1 97 LEU 3.55 -1.19 1 98 LEU 2.86 -0.52 1 99 ASP 2.66 -0.28 1 100 GLN 2.89 -0.60 1 101 GLN 2.72 -0.41 1 102 ALA 2.31 -0.58 1 103 ILE 2.94 -0.42 1 104 ASP 2.51 0.17 1 105 GLU 2.49 -0.12 1 106 GLN 3.12 -0.74 1 107 LEU 2.50 -0.50 1 108 ARG 3.10 -0.54 1 109 ASN 1.18 0.04 1 110 ALA 0.44 0.44 1 111 ILE 0.55 0.07 1 112 GLU -0.50 0.47 1 113 TYR -0.26 0.42 1 114 THR -1.09 0.45 1 116 GLU 0.31 1.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30102_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.56 _LACS_plot.Line_1_terminator_val_y_1 0.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _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 5.80 _LACS_plot.Line_2_terminator_val_y_2 -0.48 _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 18 ARG 4.56 -1.35 0 10 ASP 5.18 -0.27 1 11 GLU 4.88 -0.36 1 12 ALA 2.62 -0.01 1 13 PHE 4.06 -0.54 1 14 ILE 5.08 -0.42 1 15 GLU 2.10 -0.05 1 16 GLN 4.58 -0.34 1 17 PHE 3.80 -0.36 1 19 GLN 4.54 -0.67 1 20 GLU 3.97 -0.26 1 21 LEU 2.46 -0.48 1 22 LEU 2.50 -0.50 1 23 ASN -0.66 0.04 1 24 ASN -0.60 0.15 1 25 GLN 4.50 -0.38 1 26 MET 4.45 -0.21 1 27 LEU 2.20 -0.17 1 28 ARG 5.45 -0.57 1 29 SER 4.41 -0.27 1 30 GLN 2.87 -0.08 1 31 LEU 2.18 -0.04 1 32 ILE 3.34 -0.11 1 33 LEU 2.32 -0.14 1 34 GLN -0.62 0.12 1 35 ILE -0.40 0.08 1 38 LEU 3.42 -0.39 1 39 ASN 4.15 -0.36 1 40 ASP 1.91 0.04 1 41 LEU 0.39 0.01 1 42 VAL 3.16 -0.42 1 43 ASN 0.29 -0.14 1 44 ASP -4.56 0.38 1 46 LEU 3.55 -0.04 1 47 LEU 2.49 -0.15 1 48 PHE 5.81 -0.82 1 49 ARG 4.61 -0.44 1 50 GLU 2.39 -0.29 1 51 ARG 1.39 0.02 1 52 LEU -1.34 0.26 1 55 LEU 3.07 -0.22 1 56 ILE 4.47 -0.73 1 57 LEU 3.89 -0.34 1 58 GLN 4.22 -0.21 1 59 ARG 2.86 -0.17 1 60 ARG 3.11 -0.52 1 61 TYR 0.63 0.11 1 64 TYR 0.26 0.01 1 65 ASN 0.32 -0.01 1 66 THR 0.48 -0.01 1 67 ALA 0.03 -0.01 1 68 MET 0.10 -0.03 1 69 ASN 0.49 -0.43 1 71 PHE -2.44 0.26 1 73 ILE 1.59 0.35 1 75 GLN 4.11 -0.17 1 76 ASP 3.90 -0.21 1 77 GLU 2.55 -0.23 1 78 TYR 4.86 -0.56 1 79 THR 5.31 -0.62 1 80 ARG 4.15 -0.26 1 81 LEU 2.71 -0.45 1 82 MET 0.72 -0.20 1 83 ALA 1.23 -0.07 1 84 ASN -0.48 0.13 1 86 ASP -0.33 0.07 1 87 ASP -1.30 -0.17 1 89 ASP 3.65 -0.07 1 90 ASN 3.76 -0.32 1 91 LYS 4.34 -0.34 1 92 LYS 3.32 -0.18 1 93 ARG 3.06 -0.14 1 94 ILE 4.92 -0.70 1 95 ALA 3.89 -0.22 1 96 GLU 2.46 -0.19 1 97 LEU 3.55 -0.32 1 98 LEU 2.86 -0.12 1 99 ASP 2.66 -0.06 1 100 GLN 2.89 -0.22 1 101 GLN 2.72 -0.07 1 102 ALA 2.31 0.01 1 103 ILE 2.94 -0.25 1 104 ASP 2.51 -0.19 1 105 GLU 2.49 -0.29 1 106 GLN 3.12 -0.14 1 107 LEU 2.50 -0.13 1 108 ARG 3.10 -0.26 1 109 ASN 1.18 -0.07 1 110 ALA 0.44 0.04 1 111 ILE 0.55 -0.06 1 112 GLU -0.50 -0.03 1 113 TYR -0.26 0.10 1 114 THR -1.09 -0.05 1 116 GLU 0.31 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30102_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.56 _LACS_plot.Line_1_terminator_val_y_1 -1.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.69 _LACS_plot.Line_2_terminator_val_x_2 5.80 _LACS_plot.Line_2_terminator_val_y_2 2.60 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 THR -1.09 6.85 0 10 ASP 5.18 1.86 1 11 GLU 4.88 2.87 1 12 ALA 2.62 2.41 1 13 PHE 4.06 2.00 1 14 ILE 5.08 1.05 1 15 GLU 2.10 1.43 1 16 GLN 4.58 2.76 1 17 PHE 3.80 1.12 1 18 ARG 4.56 1.88 1 19 GLN 4.54 2.67 1 20 GLU 3.97 2.36 1 21 LEU 2.46 1.31 1 22 LEU 2.50 0.97 1 23 ASN -0.66 -0.42 1 24 ASN -0.60 -1.10 1 25 GLN 4.50 2.30 1 26 MET 4.45 2.34 1 27 LEU 2.20 1.23 1 28 ARG 5.45 1.56 1 29 SER 4.41 1.35 1 30 GLN 2.87 2.54 1 31 LEU 2.18 1.72 1 32 ILE 3.34 0.32 1 33 LEU 2.32 0.60 1 34 GLN -0.62 -0.21 1 35 ILE -0.40 5.48 1 38 LEU 3.42 0.06 1 39 ASN 4.15 1.37 1 40 ASP 1.91 1.62 1 41 LEU 0.39 0.53 1 42 VAL 3.16 -1.60 1 43 ASN 0.29 -1.27 1 44 ASP -4.56 -1.81 1 46 LEU 3.55 1.52 1 47 LEU 2.49 1.75 1 48 PHE 5.81 1.41 1 49 ARG 4.61 2.50 1 50 GLU 2.39 1.54 1 51 ARG 1.39 1.45 1 52 LEU -1.34 -0.48 1 55 LEU 3.07 1.75 1 56 ILE 4.47 2.36 1 57 LEU 3.89 1.49 1 58 GLN 4.22 2.73 1 59 ARG 2.86 1.42 1 60 ARG 3.11 0.78 1 61 TYR 0.63 0.72 1 64 TYR 0.26 -0.23 1 65 ASN 0.32 0.32 1 66 THR 0.48 -0.31 1 67 ALA 0.03 -0.06 1 68 MET 0.10 -1.08 1 69 ASN 0.49 0.18 1 71 PHE -2.44 0.17 1 73 ILE 1.59 -1.28 1 75 GLN 4.11 1.93 1 76 ASP 3.90 2.00 1 77 GLU 2.55 1.15 1 78 TYR 4.86 0.75 1 79 THR 5.31 2.04 1 80 ARG 4.15 2.56 1 81 LEU 2.71 0.70 1 82 MET 0.72 1.80 1 83 ALA 1.23 0.52 1 86 ASP -0.33 0.51 1 87 ASP -1.30 0.29 1 89 ASP 3.65 2.46 1 90 ASN 3.76 1.75 1 91 LYS 4.34 2.72 1 92 LYS 3.32 1.60 1 93 ARG 3.06 1.86 1 94 ILE 4.92 0.71 1 95 ALA 3.89 2.40 1 96 GLU 2.46 2.70 1 97 LEU 3.55 1.97 1 98 LEU 2.86 1.97 1 99 ASP 2.66 1.73 1 100 GLN 2.89 1.51 1 101 GLN 2.72 1.27 1 102 ALA 2.31 1.98 1 103 ILE 2.94 0.86 1 104 ASP 2.51 1.79 1 105 GLU 2.49 1.66 1 106 GLN 3.12 2.53 1 107 LEU 2.50 0.85 1 108 ARG 3.10 1.11 1 109 ASN 1.18 0.46 1 110 ALA 0.44 0.07 1 111 ILE 0.55 -0.35 1 112 GLU -0.50 -0.79 1 113 TYR -0.26 -0.74 1 116 GLU 0.31 -3.39 1 stop_ save_