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 bmr30025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.57 _LACS_plot.Line_1_terminator_val_y_1 -3.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.73 _LACS_plot.Line_2_terminator_val_x_2 9.08 _LACS_plot.Line_2_terminator_val_y_2 6.53 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 GLU -0.72 2.28 0 12 ASP 4.03 -0.05 0 53 ALA -7.57 -2.59 0 10 VAL -0.64 -2.35 1 11 GLU -1.79 -2.51 1 15 LEU 4.05 2.87 1 16 ILE 3.81 0.66 1 17 ALA 4.04 3.15 1 18 MET 3.26 3.17 1 19 MET 2.91 2.91 1 20 LEU 3.54 2.72 1 21 GLU 4.66 4.09 1 22 ASP 4.06 2.87 1 23 PHE 2.18 0.27 1 24 LEU 4.64 3.04 1 25 GLU 3.98 2.92 1 26 VAL 5.23 3.58 1 27 LEU 0.46 -0.73 1 28 ASP 3.80 1.36 1 29 LYS -3.76 -3.30 1 30 THR -1.68 -0.38 1 32 VAL 0.87 -1.03 1 34 THR -1.32 -0.92 1 35 VAL -5.26 -2.95 1 36 ASP -2.45 -1.25 1 37 THR -7.11 -3.20 1 38 VAL 6.29 4.66 1 39 ALA 4.05 2.78 1 41 ALA 2.17 2.91 1 42 LEU 4.77 2.74 1 43 ALA 3.58 2.16 1 44 ARG 2.68 0.13 1 45 VAL 5.75 4.05 1 46 GLU 2.56 1.73 1 47 ASP 1.12 1.23 1 50 ILE -3.62 -1.37 1 51 ASP -0.21 1.10 1 52 ALA -5.04 -1.79 1 54 ILE -0.66 -0.54 1 55 LEU -3.22 -1.95 1 56 ASP -1.46 -0.89 1 57 VAL 5.16 4.46 1 58 ASN -1.56 -0.72 1 59 LEU -0.05 -2.46 1 60 ARG 3.19 2.38 1 63 GLU -1.38 -0.30 1 64 LYS -1.68 -1.51 1 65 SER 0.20 -0.28 1 66 THR 9.08 6.40 1 68 VAL 4.55 2.49 1 69 ALA 4.22 1.98 1 70 GLU 2.74 2.76 1 71 ALA 2.77 2.13 1 72 LEU 4.80 2.74 1 73 ALA 3.36 2.29 1 74 ALA 3.01 1.93 1 75 ARG -1.22 -0.89 1 76 ASP 2.68 1.19 1 77 ILE -0.75 -0.38 1 79 PHE -5.16 -2.60 1 80 VAL -6.47 -4.60 1 81 PHE -2.63 -0.32 1 82 ALA -5.61 -2.76 1 83 THR -1.69 -2.14 1 86 SER -0.69 -0.70 1 87 ASP 1.71 1.20 1 88 ASP 0.47 0.11 1 89 SER 0.92 0.91 1 90 VAL -0.36 -0.69 1 91 ASP -1.51 1.02 1 92 SER 4.46 3.52 1 93 ARG 2.97 1.92 1 94 PHE -2.65 -1.60 1 95 ARG 3.25 1.96 1 96 ASP 0.51 -0.98 1 97 ARG 0.88 -1.15 1 99 VAL -3.60 -1.55 1 100 LEU -3.60 -2.25 1 101 GLN -0.33 -0.28 1 102 LYS -0.78 -0.03 1 104 PHE -3.36 -2.46 1 105 THR -5.69 -3.18 1 106 MET 4.99 3.98 1 107 ASP 2.64 2.56 1 109 VAL 6.54 4.64 1 110 ALA 4.07 2.89 1 111 LYS 3.70 3.10 1 112 ALA 3.04 2.24 1 113 LEU 3.77 1.96 1 114 ALA 3.54 1.99 1 115 ALA 2.61 1.23 1 116 LEU 1.32 0.60 1 117 LEU 0.10 -0.34 1 118 VAL 0.84 0.44 1 120 ARG 0.55 0.23 1 122 SER -0.05 -0.17 1 123 VAL 0.45 0.05 1 124 GLU -0.46 -0.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.57 _LACS_plot.Line_1_terminator_val_y_1 3.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 9.08 _LACS_plot.Line_2_terminator_val_y_2 -2.55 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 GLU -0.72 3.00 0 12 ASP 4.03 -4.08 0 53 ALA -7.57 4.98 0 10 VAL -0.64 -1.71 1 11 GLU -1.79 -0.72 1 15 LEU 4.05 -1.18 1 16 ILE 3.81 -3.15 1 17 ALA 4.04 -0.89 1 18 MET 3.26 -0.09 1 19 MET 2.91 0.00 1 20 LEU 3.54 -0.82 1 21 GLU 4.66 -0.57 1 22 ASP 4.06 -1.19 1 23 PHE 2.18 -1.91 1 24 LEU 4.64 -1.60 1 25 GLU 3.98 -1.06 1 26 VAL 5.23 -1.65 1 27 LEU 0.46 -1.19 1 28 ASP 3.80 -2.44 1 29 LYS -3.76 0.46 1 30 THR -1.68 1.30 1 32 VAL 0.87 -1.90 1 34 THR -1.32 0.40 1 35 VAL -5.26 2.31 1 36 ASP -2.45 1.20 1 37 THR -7.11 3.91 1 38 VAL 6.29 -1.63 1 39 ALA 4.05 -1.27 1 41 ALA 2.17 0.74 1 42 LEU 4.77 -2.03 1 43 ALA 3.58 -1.42 1 44 ARG 2.68 -2.55 1 45 VAL 5.75 -1.70 1 46 GLU 2.56 -0.83 1 47 ASP 1.12 0.11 1 50 ILE -3.62 2.25 1 51 ASP -0.21 1.31 1 52 ALA -5.04 3.25 1 54 ILE -0.66 0.12 1 55 LEU -3.22 1.27 1 56 ASP -1.46 0.57 1 57 VAL 5.16 -0.70 1 58 ASN -1.56 0.84 1 59 LEU -0.05 -2.41 1 60 ARG 3.19 -0.81 1 63 GLU -1.38 1.08 1 64 LYS -1.68 0.17 1 65 SER 0.20 -0.48 1 66 THR 9.08 -2.68 1 68 VAL 4.55 -2.06 1 69 ALA 4.22 -2.24 1 70 GLU 2.74 0.02 1 71 ALA 2.77 -0.64 1 72 LEU 4.80 -2.06 1 73 ALA 3.36 -1.07 1 74 ALA 3.01 -1.08 1 75 ARG -1.22 0.33 1 76 ASP 2.68 -1.49 1 77 ILE -0.75 0.37 1 79 PHE -5.16 2.56 1 80 VAL -6.47 1.87 1 81 PHE -2.63 2.31 1 82 ALA -5.61 2.85 1 83 THR -1.69 -0.45 1 86 SER -0.69 -0.01 1 87 ASP 1.71 -0.51 1 88 ASP 0.47 -0.36 1 89 SER 0.92 -0.01 1 90 VAL -0.36 -0.33 1 91 ASP -1.51 2.53 1 92 SER 4.46 -0.94 1 93 ARG 2.97 -1.05 1 94 PHE -2.65 1.05 1 95 ARG 3.25 -1.29 1 96 ASP 0.51 -1.49 1 97 ARG 0.88 -2.03 1 99 VAL -3.60 2.05 1 100 LEU -3.60 1.35 1 101 GLN -0.33 0.05 1 102 LYS -0.78 0.75 1 104 PHE -3.36 0.90 1 105 THR -5.69 2.51 1 106 MET 4.99 -1.01 1 107 ASP 2.64 -0.08 1 109 VAL 6.54 -1.90 1 110 ALA 4.07 -1.18 1 111 LYS 3.70 -0.60 1 112 ALA 3.04 -0.80 1 113 LEU 3.77 -1.81 1 114 ALA 3.54 -1.55 1 115 ALA 2.61 -1.38 1 116 LEU 1.32 -0.72 1 117 LEU 0.10 -0.44 1 118 VAL 0.84 -0.40 1 120 ARG 0.55 -0.32 1 122 SER -0.05 -0.12 1 123 VAL 0.45 -0.40 1 124 GLU -0.46 0.16 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.57 _LACS_plot.Line_1_terminator_val_y_1 0.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 9.08 _LACS_plot.Line_2_terminator_val_y_2 -1.08 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ALA 4.22 -1.87 0 10 VAL -0.64 0.74 1 11 GLU -1.79 0.36 1 12 ASP 4.03 -0.64 1 13 GLU -0.72 -0.36 1 15 LEU 4.05 -0.34 1 16 ILE 3.81 -0.45 1 17 ALA 4.04 -0.63 1 18 MET 3.26 -0.55 1 19 MET 2.91 -0.69 1 20 LEU 3.54 -0.57 1 21 GLU 4.66 -0.93 1 22 ASP 4.06 -0.36 1 23 PHE 2.18 -0.14 1 24 LEU 4.64 -0.70 1 25 GLU 3.98 -0.13 1 26 VAL 5.23 -0.38 1 27 LEU 0.46 -0.17 1 28 ASP 3.80 -0.32 1 29 LYS -3.76 0.27 1 30 THR -1.68 0.04 1 32 VAL 0.87 0.19 1 34 THR -1.32 1.11 1 35 VAL -5.26 0.55 1 36 ASP -2.45 -0.32 1 37 THR -7.11 0.44 1 38 VAL 6.29 -1.08 1 39 ALA 4.05 -0.51 1 41 ALA 2.17 -0.49 1 42 LEU 4.77 -0.71 1 43 ALA 3.58 -0.36 1 44 ARG 2.68 -0.12 1 45 VAL 5.75 -0.88 1 46 GLU 2.56 -0.57 1 47 ASP 1.12 -0.18 1 50 ILE -3.62 -0.34 1 51 ASP -0.21 0.03 1 52 ALA -5.04 0.58 1 53 ALA -7.57 1.09 1 54 ILE -0.66 0.10 1 55 LEU -3.22 0.27 1 56 ASP -1.46 0.89 1 57 VAL 5.16 -0.57 1 58 ASN -1.56 -0.02 1 59 LEU -0.05 0.16 1 60 ARG 3.19 -0.34 1 63 GLU -1.38 -0.34 1 64 LYS -1.68 0.71 1 65 SER 0.20 -0.46 1 66 THR 9.08 -0.40 1 68 VAL 4.55 -0.81 1 70 GLU 2.74 -0.49 1 71 ALA 2.77 -0.32 1 72 LEU 4.80 -0.64 1 73 ALA 3.36 0.11 1 74 ALA 3.01 -0.27 1 75 ARG -1.22 -0.11 1 76 ASP 2.68 -0.47 1 77 ILE -0.75 -0.08 1 79 PHE -5.16 0.79 1 80 VAL -6.47 0.31 1 81 PHE -2.63 1.02 1 82 ALA -5.61 1.39 1 83 THR -1.69 0.69 1 86 SER -0.69 -0.06 1 87 ASP 1.71 -0.41 1 88 ASP 0.47 -0.31 1 89 SER 0.92 -0.33 1 90 VAL -0.36 -0.62 1 91 ASP -1.51 -0.41 1 92 SER 4.46 -0.69 1 93 ARG 2.97 -0.51 1 94 PHE -2.65 0.57 1 95 ARG 3.25 -0.32 1 96 ASP 0.51 -0.20 1 97 ARG 0.88 -0.23 1 99 VAL -3.60 0.50 1 100 LEU -3.60 0.09 1 101 GLN -0.33 0.17 1 102 LYS -0.78 -0.63 1 104 PHE -3.36 0.44 1 105 THR -5.69 0.15 1 106 MET 4.99 -1.45 1 107 ASP 2.64 -0.46 1 109 VAL 6.54 -0.87 1 110 ALA 4.07 -0.56 1 111 LYS 3.70 -0.46 1 112 ALA 3.04 -0.29 1 113 LEU 3.77 -0.59 1 114 ALA 3.54 -0.38 1 115 ALA 2.61 -0.26 1 116 LEU 1.32 -0.40 1 117 LEU 0.10 -0.22 1 118 VAL 0.84 -0.28 1 120 ARG 0.55 -0.16 1 122 SER -0.05 -0.13 1 123 VAL 0.45 -0.19 1 124 GLU -0.46 -0.31 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.57 _LACS_plot.Line_1_terminator_val_y_1 -2.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 2.27 _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 25 GLU 3.98 4.65 0 37 THR -7.11 -0.28 0 10 VAL -0.64 -2.79 1 11 GLU -1.79 -3.75 1 12 ASP 4.03 -0.96 1 15 LEU 4.05 2.29 1 16 ILE 3.81 1.42 1 17 ALA 4.04 1.02 1 18 MET 3.26 1.73 1 19 MET 2.91 1.12 1 20 LEU 3.54 0.51 1 21 GLU 4.66 1.20 1 22 ASP 4.06 2.69 1 23 PHE 2.18 2.14 1 24 LEU 4.64 0.72 1 26 VAL 5.23 1.31 1 27 LEU 0.46 -2.26 1 28 ASP 3.80 -0.96 1 29 LYS -3.76 -1.61 1 34 THR -1.32 -0.12 1 35 VAL -5.26 -2.10 1 36 ASP -2.45 -2.10 1 38 VAL 6.29 0.38 1 39 ALA 4.05 3.61 1 41 ALA 2.17 0.81 1 42 LEU 4.77 1.77 1 43 ALA 3.58 2.07 1 44 ARG 2.68 3.35 1 45 VAL 5.75 1.45 1 46 GLU 2.56 1.05 1 47 ASP 1.12 1.50 1 50 ILE -3.62 -1.70 1 51 ASP -0.21 -0.96 1 52 ALA -5.04 -3.03 1 53 ALA -7.57 -3.03 1 54 ILE -0.66 -3.12 1 55 LEU -3.22 -2.44 1 56 ASP -1.46 1.07 1 57 VAL 5.16 -0.43 1 58 ASN -1.56 -1.62 1 60 ARG 3.19 2.33 1 63 GLU -1.38 -0.71 1 64 LYS -1.68 1.72 1 65 SER 0.20 0.58 1 68 VAL 4.55 0.07 1 69 ALA 4.22 0.26 1 70 GLU 2.74 2.46 1 71 ALA 2.77 2.57 1 72 LEU 4.80 1.77 1 73 ALA 3.36 4.13 1 74 ALA 3.01 0.83 1 75 ARG -1.22 -1.77 1 76 ASP 2.68 -1.77 1 79 PHE -5.16 -3.52 1 80 VAL -6.47 -1.19 1 81 PHE -2.63 -0.69 1 82 ALA -5.61 -1.83 1 83 THR -1.69 -1.52 1 86 SER -0.69 0.22 1 87 ASP 1.71 -0.26 1 88 ASP 0.47 -0.26 1 89 SER 0.92 -0.59 1 90 VAL -0.36 -0.77 1 91 ASP -1.51 1.08 1 92 SER 4.46 1.34 1 93 ARG 2.97 0.91 1 94 PHE -2.65 0.63 1 95 ARG 3.25 -1.63 1 96 ASP 0.51 -0.09 1 99 VAL -3.60 -1.19 1 100 LEU -3.60 -3.34 1 101 GLN -0.33 -0.55 1 104 PHE -3.36 -0.54 1 105 THR -5.69 -0.25 1 106 MET 4.99 1.08 1 109 VAL 6.54 1.28 1 110 ALA 4.07 3.34 1 111 LYS 3.70 2.54 1 112 ALA 3.04 0.83 1 113 LEU 3.77 2.42 1 114 ALA 3.54 2.51 1 115 ALA 2.61 1.46 1 116 LEU 1.32 -0.19 1 117 LEU 0.10 -0.76 1 120 ARG 0.55 0.67 1 122 SER -0.05 0.05 1 123 VAL 0.45 -0.38 1 124 GLU -0.46 -0.56 1 stop_ save_