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 bmr25703_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.72 _LACS_plot.Line_2_terminator_val_x_2 9.25 _LACS_plot.Line_2_terminator_val_y_2 6.70 _LACS_plot.Y_axis_chem_shift_offset -0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 MET 0.89 4.59 0 29 TRP -3.44 -3.58 0 53 TYR -9.30 -1.69 0 10 GLU 1.03 2.67 1 11 PHE 4.88 3.48 1 12 ASP 3.66 3.35 1 13 SER 3.41 3.11 1 14 ALA 2.02 2.21 1 15 ILE 3.48 2.96 1 16 ALA -0.04 -0.18 1 17 GLN -4.22 0.72 1 19 LYS -2.66 -1.04 1 20 LEU 2.42 2.03 1 21 VAL -1.52 0.31 1 22 VAL -1.37 -0.64 1 23 VAL -1.67 -0.53 1 24 ALA -1.84 -0.79 1 25 PHE -0.13 0.50 1 26 TYR -6.88 -2.66 1 27 ALA -5.16 -1.53 1 28 THR 4.52 4.06 1 34 LYS 4.05 3.46 1 35 MET 2.81 2.54 1 36 ILE -1.30 -0.44 1 37 ALA 9.25 7.06 1 39 MET 4.50 2.99 1 40 ILE 5.83 3.29 1 41 GLU 3.28 3.28 1 42 LYS 5.15 3.33 1 43 PHE 3.49 1.63 1 44 SER 4.31 2.86 1 45 GLU 0.85 1.14 1 46 GLN 1.91 2.67 1 47 TYR 0.54 0.72 1 49 GLN 2.37 1.13 1 50 ALA -5.63 -1.98 1 51 ASP -4.36 -0.68 1 52 PHE -3.20 -0.51 1 54 LYS -6.11 -2.26 1 55 LEU -3.32 0.81 1 56 ASP -0.42 -0.13 1 57 VAL 4.13 2.89 1 58 ASP 3.76 3.49 1 59 GLU -0.96 1.28 1 60 LEU -2.11 -2.24 1 62 ASP 4.30 2.85 1 63 VAL 4.86 3.68 1 64 ALA 4.63 3.83 1 65 GLN 4.42 3.82 1 66 LYS 3.47 3.08 1 67 ASN -0.22 1.45 1 68 GLU 3.45 0.87 1 69 VAL 2.75 1.11 1 70 SER -1.46 -0.11 1 71 ALA -3.06 -0.60 1 74 THR -1.93 2.13 1 75 LEU -4.01 -1.25 1 76 LEU -5.40 -1.07 1 77 LEU -0.86 -0.01 1 78 PHE -6.09 -0.83 1 79 LYS -2.15 1.78 1 80 ASN 2.67 1.82 1 82 LYS -3.33 -0.60 1 83 GLU -0.29 0.74 1 84 VAL -1.54 -0.75 1 85 ALA -2.81 0.63 1 86 LYS -3.22 -0.34 1 87 VAL -2.19 -0.13 1 88 VAL -0.11 0.26 1 90 ALA -0.97 -1.59 1 91 ASN -1.61 -0.80 1 93 ALA 3.50 2.85 1 94 ALA 2.75 2.92 1 95 ILE 5.41 5.46 1 96 LYS 4.71 4.22 1 97 GLN 3.97 3.37 1 98 ALA 3.45 2.71 1 99 ILE 5.00 4.82 1 100 ALA 3.43 2.99 1 101 ALA 1.13 1.61 1 102 ASN -2.78 1.71 1 103 ALA 2.41 2.69 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25703_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 6.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.28 _LACS_plot.Line_2_terminator_val_x_2 9.25 _LACS_plot.Line_2_terminator_val_y_2 -2.55 _LACS_plot.Y_axis_chem_shift_offset -0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 MET 0.89 3.70 0 29 TRP -3.44 -0.14 0 53 TYR -9.30 7.61 0 10 GLU 1.03 1.64 1 11 PHE 4.88 -1.40 1 12 ASP 3.66 -0.31 1 13 SER 3.41 -0.30 1 14 ALA 2.02 0.19 1 15 ILE 3.48 -0.52 1 16 ALA -0.04 -0.14 1 17 GLN -4.22 4.94 1 19 LYS -2.66 1.62 1 20 LEU 2.42 -0.39 1 21 VAL -1.52 1.83 1 22 VAL -1.37 0.73 1 23 VAL -1.67 1.14 1 24 ALA -1.84 1.05 1 25 PHE -0.13 0.63 1 26 TYR -6.88 4.22 1 27 ALA -5.16 3.63 1 28 THR 4.52 -0.46 1 34 LYS 4.05 -0.59 1 35 MET 2.81 -0.27 1 36 ILE -1.30 0.86 1 37 ALA 9.25 -2.19 1 39 MET 4.50 -1.51 1 40 ILE 5.83 -2.54 1 41 GLU 3.28 0.00 1 42 LYS 5.15 -1.82 1 43 PHE 3.49 -1.86 1 44 SER 4.31 -1.45 1 45 GLU 0.85 0.29 1 46 GLN 1.91 0.76 1 47 TYR 0.54 0.18 1 49 GLN 2.37 -1.24 1 50 ALA -5.63 3.65 1 51 ASP -4.36 3.68 1 52 PHE -3.20 2.69 1 54 LYS -6.11 3.85 1 55 LEU -3.32 4.13 1 56 ASP -0.42 0.29 1 57 VAL 4.13 -1.24 1 58 ASP 3.76 -0.27 1 59 GLU -0.96 2.24 1 60 LEU -2.11 -0.13 1 62 ASP 4.30 -1.45 1 63 VAL 4.86 -1.18 1 64 ALA 4.63 -0.80 1 65 GLN 4.42 -0.60 1 66 LYS 3.47 -0.39 1 67 ASN -0.22 1.67 1 68 GLU 3.45 -2.58 1 69 VAL 2.75 -1.64 1 70 SER -1.46 1.35 1 71 ALA -3.06 2.46 1 74 THR -1.93 4.06 1 75 LEU -4.01 2.76 1 76 LEU -5.40 4.33 1 77 LEU -0.86 0.85 1 78 PHE -6.09 5.26 1 79 LYS -2.15 3.93 1 80 ASN 2.67 -0.85 1 82 LYS -3.33 2.73 1 83 GLU -0.29 1.03 1 84 VAL -1.54 0.79 1 85 ALA -2.81 3.44 1 86 LYS -3.22 2.88 1 87 VAL -2.19 2.06 1 88 VAL -0.11 0.37 1 90 ALA -0.97 -0.62 1 91 ASN -1.61 0.81 1 93 ALA 3.50 -0.65 1 94 ALA 2.75 0.17 1 95 ILE 5.41 0.05 1 96 LYS 4.71 -0.49 1 97 GLN 3.97 -0.60 1 98 ALA 3.45 -0.74 1 99 ILE 5.00 -0.18 1 100 ALA 3.43 -0.44 1 101 ALA 1.13 0.48 1 102 ASN -2.78 4.49 1 103 ALA 2.41 0.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25703_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 1.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.26 _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 9.25 _LACS_plot.Line_2_terminator_val_y_2 -1.06 _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 11 PHE 4.88 -1.76 0 10 GLU 1.03 -0.50 1 12 ASP 3.66 -0.80 1 13 SER 3.41 -0.45 1 14 ALA 2.02 -0.29 1 15 ILE 3.48 -0.45 1 16 ALA -0.04 -0.31 1 17 GLN -4.22 -0.14 1 19 LYS -2.66 0.06 1 20 LEU 2.42 0.63 1 21 VAL -1.52 0.32 1 22 VAL -1.37 0.29 1 23 VAL -1.67 0.30 1 24 ALA -1.84 0.63 1 25 PHE -0.13 0.38 1 26 TYR -6.88 0.56 1 27 ALA -5.16 0.01 1 28 THR 4.52 -0.44 1 29 TRP -3.44 -0.07 1 34 LYS 4.05 -0.35 1 35 MET 2.81 -0.29 1 36 ILE -1.30 0.17 1 37 ALA 9.25 -0.53 1 39 MET 4.50 -0.62 1 40 ILE 5.83 -0.57 1 41 GLU 3.28 -0.78 1 42 LYS 5.15 -0.39 1 43 PHE 3.49 0.02 1 44 SER 4.31 -1.50 1 45 GLU 0.85 -0.30 1 46 GLN 1.91 -0.39 1 47 TYR 0.54 0.13 1 49 GLN 2.37 0.03 1 50 ALA -5.63 0.73 1 51 ASP -4.36 0.46 1 52 PHE -3.20 0.55 1 53 TYR -9.30 0.95 1 54 LYS -6.11 1.18 1 55 LEU -3.32 0.13 1 56 ASP -0.42 -0.51 1 57 VAL 4.13 -0.63 1 58 ASP 3.76 0.19 1 59 GLU -0.96 0.01 1 60 LEU -2.11 0.58 1 62 ASP 4.30 -0.34 1 63 VAL 4.86 -0.81 1 64 ALA 4.63 -0.55 1 65 GLN 4.42 -0.33 1 66 LYS 3.47 -0.29 1 67 ASN -0.22 -0.04 1 68 GLU 3.45 -0.63 1 69 VAL 2.75 -0.23 1 70 SER -1.46 -0.02 1 71 ALA -3.06 0.23 1 72 MET 0.89 0.09 1 74 THR -1.93 0.65 1 75 LEU -4.01 1.15 1 76 LEU -5.40 0.59 1 77 LEU -0.86 0.91 1 78 PHE -6.09 0.78 1 79 LYS -2.15 0.50 1 80 ASN 2.67 -0.45 1 82 LYS -3.33 0.62 1 83 GLU -0.29 -0.48 1 84 VAL -1.54 0.30 1 85 ALA -2.81 0.09 1 86 LYS -3.22 0.61 1 87 VAL -2.19 0.16 1 88 VAL -0.11 0.33 1 90 ALA -0.97 -0.09 1 91 ASN -1.61 0.06 1 93 ALA 3.50 -0.25 1 94 ALA 2.75 -0.26 1 95 ILE 5.41 -0.81 1 96 LYS 4.71 -1.18 1 97 GLN 3.97 -0.49 1 98 ALA 3.45 -0.40 1 99 ILE 5.00 -1.13 1 100 ALA 3.43 -0.61 1 101 ALA 1.13 -0.24 1 102 ASN -2.78 0.01 1 103 ALA 2.41 -0.40 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25703_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 -4.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.87 _LACS_plot.Line_2_terminator_val_x_2 5.83 _LACS_plot.Line_2_terminator_val_y_2 1.36 _LACS_plot.Y_axis_chem_shift_offset 1.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 ALA -5.16 0.95 0 53 TYR -9.30 -1.90 0 10 GLU 1.03 1.69 1 11 PHE 4.88 0.99 1 12 ASP 3.66 1.99 1 13 SER 3.41 1.23 1 14 ALA 2.02 2.11 1 15 ILE 3.48 -0.89 1 16 ALA -0.04 -1.16 1 17 GLN -4.22 -1.03 1 19 LYS -2.66 -3.86 1 20 LEU 2.42 -3.66 1 21 VAL -1.52 -2.81 1 22 VAL -1.37 -1.97 1 23 VAL -1.67 -1.96 1 24 ALA -1.84 -3.12 1 25 PHE -0.13 -1.57 1 26 TYR -6.88 -5.17 1 28 THR 4.52 -0.34 1 34 LYS 4.05 1.45 1 35 MET 2.81 1.15 1 36 ILE -1.30 -0.22 1 39 MET 4.50 -1.86 1 40 ILE 5.83 0.87 1 41 GLU 3.28 3.00 1 42 LYS 5.15 2.79 1 43 PHE 3.49 1.54 1 44 SER 4.31 0.33 1 45 GLU 0.85 0.76 1 46 GLN 1.91 1.43 1 49 GLN 2.37 -1.56 1 50 ALA -5.63 -3.11 1 51 ASP -4.36 -2.13 1 52 PHE -3.20 -1.69 1 54 LYS -6.11 -3.81 1 55 LEU -3.32 -5.95 1 56 ASP -0.42 1.39 1 57 VAL 4.13 -0.89 1 58 ASP 3.76 0.83 1 59 GLU -0.96 0.01 1 60 LEU -2.11 -1.06 1 62 ASP 4.30 2.05 1 63 VAL 4.86 2.42 1 64 ALA 4.63 0.18 1 66 LYS 3.47 -0.16 1 67 ASN -0.22 -4.13 1 68 GLU 3.45 -1.47 1 69 VAL 2.75 -1.46 1 70 SER -1.46 -2.15 1 71 ALA -3.06 -2.78 1 74 THR -1.93 -3.81 1 75 LEU -4.01 -3.27 1 76 LEU -5.40 -3.87 1 77 LEU -0.86 -3.16 1 78 PHE -6.09 -1.88 1 79 LYS -2.15 0.59 1 80 ASN 2.67 -0.33 1 82 LYS -3.33 -2.24 1 83 GLU -0.29 0.13 1 84 VAL -1.54 -1.17 1 85 ALA -2.81 -4.51 1 86 LYS -3.22 -2.09 1 87 VAL -2.19 -2.30 1 88 VAL -0.11 -0.71 1 90 ALA -0.97 -3.52 1 93 ALA 3.50 1.87 1 94 ALA 2.75 2.57 1 95 ILE 5.41 -0.76 1 96 LYS 4.71 0.69 1 97 GLN 3.97 1.46 1 98 ALA 3.45 -3.35 1 99 ILE 5.00 0.08 1 100 ALA 3.43 2.11 1 101 ALA 1.13 -0.09 1 102 ASN -2.78 -2.99 1 stop_ save_