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 bmr6442_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.16 _LACS_plot.Line_1_terminator_val_y_1 -2.42 _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 -1.47 _LACS_plot.Line_2_terminator_val_x_2 8.89 _LACS_plot.Line_2_terminator_val_y_2 6.33 _LACS_plot.Y_axis_chem_shift_offset 0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ILE 1.76 -2.75 0 60 VAL 0.78 -3.30 0 11 PHE 5.14 4.75 1 12 ASP 3.58 2.51 1 13 SER 4.41 3.06 1 14 ILE 5.04 3.54 1 15 ILE 4.50 2.45 1 16 SER 1.94 1.69 1 17 GLN -0.33 0.19 1 18 ASN -4.63 -1.04 1 19 GLU 3.37 3.39 1 20 LEU -4.50 -1.40 1 21 VAL -6.60 -2.48 1 22 ILE -5.08 -2.75 1 23 VAL -4.42 -2.21 1 24 ASP -1.89 -3.78 1 25 PHE 0.77 -0.44 1 26 PHE -7.16 -3.45 1 27 ALA -5.51 -2.90 1 28 GLU 1.74 1.48 1 29 TRP -3.29 -4.07 1 34 LYS 3.69 2.42 1 35 ARG 3.88 2.90 1 36 ILE -3.43 -1.38 1 37 ALA 8.89 6.21 1 39 PHE 3.23 2.84 1 40 TYR 4.96 4.55 1 41 GLU 3.38 2.30 1 42 GLU 3.92 2.84 1 44 SER 4.67 2.78 1 45 LYS 1.23 0.78 1 46 THR 2.26 2.29 1 47 TYR 2.77 -0.37 1 48 THR 2.80 1.47 1 49 LYS 2.05 1.60 1 50 MET -6.92 -1.70 1 51 VAL 0.23 -0.29 1 52 PHE -2.79 -2.08 1 53 ILE -5.90 -2.48 1 54 LYS -4.51 -1.13 1 55 VAL -4.42 -1.12 1 56 ASP -1.35 -2.14 1 57 VAL 2.42 0.53 1 58 ASP 1.39 1.42 1 59 GLU -0.73 0.38 1 61 SER 4.95 3.61 1 62 GLU 3.38 3.12 1 63 VAL 4.60 2.71 1 64 THR 6.63 4.48 1 65 GLU 2.28 2.02 1 66 LYS 3.97 2.70 1 67 GLU -0.45 -1.80 1 68 ASN 2.48 0.33 1 70 THR -1.57 -0.99 1 71 SER 0.03 -0.22 1 72 MET -0.94 0.13 1 74 THR -1.30 1.20 1 75 PHE -3.89 -2.36 1 76 LYS -5.60 -1.13 1 77 VAL -1.96 -1.39 1 78 TYR -3.24 -1.46 1 79 LYS -5.87 -2.77 1 80 ASN 2.75 1.42 1 82 SER -2.98 -1.32 1 83 SER 0.85 -0.50 1 84 VAL -3.06 -1.94 1 85 ASP -5.72 0.05 1 86 THR -2.94 -0.17 1 87 LEU -5.59 -1.12 1 88 LEU -0.67 -1.12 1 90 ALA -1.68 -1.80 1 91 ASN -1.07 -0.76 1 92 ASP 6.31 3.33 1 93 SER 4.41 3.06 1 94 ALA 2.15 1.48 1 95 LEU 4.25 2.43 1 96 LYS 3.69 2.97 1 97 GLN 4.05 3.20 1 98 LEU 3.43 2.70 1 99 ILE 5.09 4.68 1 100 GLU 3.97 2.89 1 101 LYS 3.42 2.70 1 102 TYR -1.06 1.27 1 103 ALA -2.23 -0.98 1 104 ALA 1.05 1.75 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6442_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.16 _LACS_plot.Line_1_terminator_val_y_1 4.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.53 _LACS_plot.Line_2_terminator_val_x_2 8.89 _LACS_plot.Line_2_terminator_val_y_2 -2.56 _LACS_plot.Y_axis_chem_shift_offset 0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ILE 1.76 -4.51 0 60 VAL 0.78 -4.08 0 11 PHE 5.14 -0.39 1 12 ASP 3.58 -1.07 1 13 SER 4.41 -1.35 1 14 ILE 5.04 -1.50 1 15 ILE 4.50 -2.05 1 16 SER 1.94 -0.25 1 17 GLN -0.33 0.52 1 18 ASN -4.63 3.59 1 19 GLU 3.37 0.02 1 20 LEU -4.50 3.10 1 21 VAL -6.60 4.12 1 22 ILE -5.08 2.33 1 23 VAL -4.42 2.21 1 24 ASP -1.89 -1.89 1 25 PHE 0.77 -1.21 1 26 PHE -7.16 3.71 1 27 ALA -5.51 2.61 1 28 GLU 1.74 -0.26 1 29 TRP -3.29 -0.78 1 34 LYS 3.69 -1.27 1 35 ARG 3.88 -0.98 1 36 ILE -3.43 2.05 1 37 ALA 8.89 -2.68 1 39 PHE 3.23 -0.39 1 40 TYR 4.96 -0.41 1 41 GLU 3.38 -1.08 1 42 GLU 3.92 -1.08 1 44 SER 4.67 -1.89 1 45 LYS 1.23 -0.45 1 46 THR 2.26 0.03 1 47 TYR 2.77 -3.14 1 48 THR 2.80 -1.33 1 49 LYS 2.05 -0.45 1 50 MET -6.92 5.22 1 51 VAL 0.23 -0.52 1 52 PHE -2.79 0.71 1 53 ILE -5.90 3.42 1 54 LYS -4.51 3.38 1 55 VAL -4.42 3.30 1 56 ASP -1.35 -0.79 1 57 VAL 2.42 -1.89 1 58 ASP 1.39 0.03 1 59 GLU -0.73 1.11 1 61 SER 4.95 -1.34 1 62 GLU 3.38 -0.26 1 63 VAL 4.60 -1.89 1 64 THR 6.63 -2.15 1 65 GLU 2.28 -0.26 1 66 LYS 3.97 -1.27 1 67 GLU -0.45 -1.35 1 68 ASN 2.48 -2.15 1 70 THR -1.57 0.58 1 71 SER 0.03 -0.25 1 72 MET -0.94 1.07 1 74 THR -1.30 2.50 1 75 PHE -3.89 1.53 1 76 LYS -5.60 4.47 1 77 VAL -1.96 0.57 1 78 TYR -3.24 1.78 1 79 LYS -5.87 3.10 1 80 ASN 2.75 -1.33 1 82 SER -2.98 1.66 1 83 SER 0.85 -1.35 1 84 VAL -3.06 1.12 1 85 ASP -5.72 5.77 1 86 THR -2.94 2.77 1 87 LEU -5.59 4.47 1 88 LEU -0.67 -0.45 1 90 ALA -1.68 -0.12 1 91 ASN -1.07 0.31 1 92 ASP 6.31 -2.98 1 93 SER 4.41 -1.35 1 94 ALA 2.15 -0.67 1 95 LEU 4.25 -1.82 1 96 LYS 3.69 -0.72 1 97 GLN 4.05 -0.85 1 98 LEU 3.43 -0.73 1 99 ILE 5.09 -0.41 1 100 GLU 3.97 -1.08 1 101 LYS 3.42 -0.72 1 102 TYR -1.06 2.33 1 103 ALA -2.23 1.25 1 104 ALA 1.05 0.70 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6442_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.16 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 8.89 _LACS_plot.Line_2_terminator_val_y_2 -1.09 _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 56 ASP -1.35 -1.00 0 75 PHE -3.89 1.66 0 11 PHE 5.14 -0.95 1 12 ASP 3.58 -0.46 1 13 SER 4.41 -0.36 1 14 ILE 5.04 -0.65 1 15 ILE 4.50 -0.58 1 16 SER 1.94 -0.20 1 17 GLN -0.33 0.04 1 18 ASN -4.63 0.24 1 19 GLU 3.37 -0.35 1 20 LEU -4.50 1.10 1 21 VAL -6.60 0.92 1 22 ILE -5.08 1.32 1 23 VAL -4.42 0.26 1 24 ASP -1.89 -0.21 1 25 PHE 0.77 0.49 1 26 PHE -7.16 0.49 1 27 ALA -5.51 0.11 1 28 GLU 1.74 -0.27 1 29 TRP -3.29 -0.19 1 34 LYS 3.69 -0.31 1 35 ARG 3.88 -0.26 1 36 ILE -3.43 0.55 1 37 ALA 8.89 -0.42 1 39 PHE 3.23 -0.12 1 40 TYR 4.96 -0.61 1 41 GLU 3.38 -0.74 1 42 GLU 3.92 -0.53 1 44 SER 4.67 -0.86 1 45 LYS 1.23 -0.38 1 46 THR 2.26 -0.40 1 47 TYR 2.77 0.35 1 48 THR 2.80 -0.05 1 49 LYS 2.05 -0.03 1 50 MET -6.92 0.07 1 51 VAL 0.23 0.11 1 52 PHE -2.79 0.53 1 53 ILE -5.90 1.50 1 54 LYS -4.51 0.98 1 55 VAL -4.42 0.11 1 57 VAL 2.42 -0.40 1 58 ASP 1.39 -0.01 1 59 GLU -0.73 -0.08 1 60 VAL 0.78 0.34 1 61 SER 4.95 -0.39 1 62 GLU 3.38 -0.23 1 63 VAL 4.60 -0.46 1 64 THR 6.63 -1.09 1 65 GLU 2.28 -0.27 1 66 LYS 3.97 -0.26 1 67 GLU -0.45 -0.15 1 68 ASN 2.48 -0.51 1 69 ILE 1.76 -0.07 1 70 THR -1.57 0.07 1 71 SER 0.03 0.12 1 72 MET -0.94 0.19 1 74 THR -1.30 0.54 1 76 LYS -5.60 1.14 1 77 VAL -1.96 0.65 1 78 TYR -3.24 0.30 1 79 LYS -5.87 1.28 1 80 ASN 2.75 -0.17 1 82 SER -2.98 0.51 1 83 SER 0.85 -0.39 1 84 VAL -3.06 0.46 1 85 ASP -5.72 0.12 1 86 THR -2.94 0.92 1 87 LEU -5.59 0.42 1 88 LEU -0.67 0.55 1 90 ALA -1.68 0.12 1 91 ASN -1.07 0.05 1 92 ASP 6.31 -0.88 1 93 SER 4.41 -0.37 1 94 ALA 2.15 -0.22 1 95 LEU 4.25 -0.52 1 96 LYS 3.69 -0.50 1 97 GLN 4.05 -0.37 1 98 LEU 3.43 -0.22 1 99 ILE 5.09 -0.98 1 100 GLU 3.97 -0.78 1 101 LYS 3.42 -0.55 1 102 TYR -1.06 -0.07 1 103 ALA -2.23 0.19 1 104 ALA 1.05 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6442_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.16 _LACS_plot.Line_1_terminator_val_y_1 -2.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.65 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.81 _LACS_plot.Line_2_terminator_val_x_2 6.62 _LACS_plot.Line_2_terminator_val_y_2 2.20 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 22 ILE -5.08 -4.70 0 26 PHE -7.16 -5.00 0 79 LYS -5.87 0.40 0 27 ALA -5.51 0.70 0 53 ILE -5.90 0.50 0 11 PHE 5.14 -0.30 1 12 ASP 3.58 3.50 1 13 SER 4.41 1.10 1 15 ILE 4.50 0.60 1 16 SER 1.94 1.90 1 17 GLN -0.33 -1.00 1 18 ASN -4.63 -1.60 1 19 GLU 3.37 -0.50 1 20 LEU -4.50 -2.20 1 21 VAL -6.60 -3.10 1 23 VAL -4.42 -2.20 1 24 ASP -1.89 -1.40 1 25 PHE 0.77 -2.60 1 28 GLU 1.74 -0.50 1 29 TRP -3.29 -0.30 1 34 LYS 3.69 2.80 1 35 ARG 3.88 1.80 1 36 ILE -3.43 -1.20 1 39 PHE 3.23 2.10 1 40 TYR 4.96 0.90 1 41 GLU 3.38 3.20 1 42 GLU 3.92 3.60 1 44 SER 4.67 0.00 1 45 LYS 1.23 0.50 1 47 TYR 2.77 0.70 1 48 THR 2.80 1.60 1 49 LYS 2.05 -1.50 1 50 MET -6.92 -3.10 1 51 VAL 0.23 -1.50 1 52 PHE -2.79 0.10 1 54 LYS -4.51 -3.80 1 55 VAL -4.42 -4.30 1 56 ASP -1.35 1.60 1 57 VAL 2.42 1.60 1 58 ASP 1.39 3.20 1 59 GLU -0.73 0.60 1 60 VAL 0.78 0.10 1 61 SER 4.95 2.10 1 62 GLU 3.38 3.20 1 64 THR 6.63 1.20 1 65 GLU 2.28 3.00 1 66 LYS 3.97 1.80 1 67 GLU -0.45 -1.40 1 68 ASN 2.48 -1.50 1 69 ILE 1.76 0.80 1 70 THR -1.57 -0.80 1 71 SER 0.03 -1.60 1 74 THR -1.30 -3.00 1 75 PHE -3.89 0.30 1 76 LYS -5.60 -2.10 1 77 VAL -1.96 -2.00 1 78 TYR -3.24 -2.00 1 80 ASN 2.75 1.00 1 82 SER -2.98 -1.70 1 83 SER 0.85 1.70 1 84 VAL -3.06 -1.15 1 85 ASP -5.72 -1.20 1 86 THR -2.94 -2.20 1 88 LEU -0.67 0.00 1 90 ALA -1.68 -2.30 1 91 ASN -1.07 -0.50 1 92 ASP 6.31 0.90 1 93 SER 4.41 2.50 1 94 ALA 2.15 2.50 1 95 LEU 4.25 -0.30 1 96 LYS 3.69 1.00 1 97 GLN 4.05 2.30 1 98 LEU 3.43 -0.30 1 99 ILE 5.09 2.70 1 100 GLU 3.97 1.00 1 101 LYS 3.42 0.60 1 102 TYR -1.06 0.40 1 103 ALA -2.23 -2.50 1 stop_ save_