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 bmr15762_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.51 _LACS_plot.Line_1_terminator_val_y_1 -3.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 5.29 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ILE -9.51 -7.02 0 11 SER 0.28 0.22 1 12 THR 0.32 0.08 1 13 LYS 0.54 0.32 1 17 ILE -0.32 -0.18 1 18 ASP -0.42 -0.32 1 19 ILE 0.71 0.47 1 21 THR 0.27 0.28 1 22 VAL 0.43 0.18 1 24 ASP 2.23 2.30 1 25 ASN 0.20 0.32 1 26 ASP 0.55 0.50 1 27 ASN 1.28 0.99 1 29 THR -1.40 -0.14 1 30 SER -2.08 -0.49 1 31 LYS -2.45 -0.82 1 32 PHE -4.19 -0.35 1 33 SER -3.69 -2.04 1 34 ARG -4.53 -0.78 1 35 PHE -1.76 -0.98 1 36 PHE -6.03 -1.19 1 37 ALA 2.40 2.72 1 38 THR -7.51 -3.45 1 39 ARG 4.63 3.94 1 40 GLU 5.21 3.86 1 41 GLU 1.95 2.51 1 42 ALA 1.72 1.73 1 43 GLU 3.01 2.20 1 44 SER 4.49 3.15 1 45 PHE 3.38 3.90 1 46 MET 4.06 0.75 1 47 THR 6.99 5.56 1 48 LYS 4.47 2.18 1 49 LEU 3.90 2.97 1 50 LYS 5.20 4.52 1 51 GLU 3.50 2.72 1 52 LEU 3.77 2.45 1 53 ALA 4.58 2.88 1 54 ALA 3.39 2.05 1 55 ALA 2.35 1.37 1 56 ALA 0.63 0.90 1 57 SER -1.53 -0.54 1 58 SER 0.60 0.55 1 59 ALA -0.35 -0.24 1 60 ASP 2.07 1.64 1 61 GLU 0.64 0.12 1 63 ALA -1.65 -1.33 1 64 SER -1.01 -0.90 1 65 VAL -2.74 -1.43 1 66 ALA -4.61 -1.85 1 67 TYR -4.19 -1.49 1 68 LYS -4.97 -1.40 1 69 ILE -1.39 -0.95 1 70 LYS -3.75 -1.76 1 71 ASP 0.93 1.38 1 72 LEU -2.30 -1.49 1 73 GLU 2.25 0.54 1 75 GLN -2.72 -1.52 1 76 VAL -4.20 -2.93 1 77 GLU -5.92 -2.16 1 78 LEU -4.45 -1.28 1 79 ASP -2.88 -1.00 1 80 ALA -7.41 -1.85 1 81 ALA -4.14 -1.28 1 82 PHE -4.35 -1.86 1 83 THR 0.48 0.68 1 84 PHE -2.82 -0.40 1 85 SER 1.89 2.00 1 87 GLN 4.31 3.62 1 88 ALA 4.01 3.19 1 89 GLU 1.35 1.84 1 90 MET 3.50 3.50 1 91 ILE 4.68 3.46 1 92 ILE 5.09 3.77 1 93 PHE 3.22 2.86 1 94 GLU 4.81 3.75 1 95 LEU 4.06 2.92 1 96 SER 4.05 2.68 1 97 LEU 3.20 2.04 1 98 ARG 4.08 2.90 1 99 SER 2.75 2.05 1 100 LEU 1.20 0.79 1 101 ALA 1.36 0.59 1 102 LEU 0.51 0.33 1 103 GLU 0.00 0.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15762_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.51 _LACS_plot.Line_1_terminator_val_y_1 5.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 -1.69 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ILE -9.51 2.49 0 11 SER 0.28 -0.06 1 12 THR 0.32 -0.24 1 13 LYS 0.54 -0.22 1 17 ILE -0.32 0.14 1 18 ASP -0.42 0.10 1 19 ILE 0.71 -0.24 1 21 THR 0.27 0.01 1 22 VAL 0.43 -0.25 1 24 ASP 2.23 0.07 1 25 ASN 0.20 0.12 1 26 ASP 0.55 -0.05 1 27 ASN 1.28 -0.29 1 29 THR -1.40 1.26 1 30 SER -2.08 1.59 1 31 LYS -2.45 1.63 1 32 PHE -4.19 3.84 1 33 SER -3.69 1.65 1 34 ARG -4.53 3.75 1 35 PHE -1.76 0.78 1 36 PHE -6.03 4.84 1 37 ALA 2.40 0.32 1 38 THR -7.51 4.06 1 39 ARG 4.63 -0.69 1 40 GLU 5.21 -1.35 1 41 GLU 1.95 0.56 1 42 ALA 1.72 0.01 1 43 GLU 3.01 -0.81 1 44 SER 4.49 -1.34 1 45 PHE 3.38 0.52 1 46 MET 4.06 -3.31 1 47 THR 6.99 -1.43 1 48 LYS 4.47 -2.29 1 49 LEU 3.90 -0.93 1 50 LYS 5.20 -0.68 1 51 GLU 3.50 -0.78 1 52 LEU 3.77 -1.32 1 53 ALA 4.58 -1.70 1 54 ALA 3.39 -1.34 1 55 ALA 2.35 -0.98 1 56 ALA 0.63 0.27 1 57 SER -1.53 0.99 1 58 SER 0.60 -0.05 1 59 ALA -0.35 0.11 1 60 ASP 2.07 -0.43 1 61 GLU 0.64 -0.52 1 63 ALA -1.65 0.32 1 64 SER -1.01 0.11 1 65 VAL -2.74 1.31 1 66 ALA -4.61 2.76 1 67 TYR -4.19 2.70 1 68 LYS -4.97 3.57 1 69 ILE -1.39 0.44 1 70 LYS -3.75 1.99 1 71 ASP 0.93 0.45 1 72 LEU -2.30 0.81 1 73 GLU 2.25 -1.71 1 75 GLN -2.72 1.20 1 76 VAL -4.20 1.27 1 77 GLU -5.92 3.76 1 78 LEU -4.45 3.17 1 79 ASP -2.88 1.88 1 80 ALA -7.41 5.56 1 81 ALA -4.14 2.86 1 82 PHE -4.35 2.49 1 83 THR 0.48 0.20 1 84 PHE -2.82 2.42 1 85 SER 1.89 0.11 1 87 GLN 4.31 -0.69 1 88 ALA 4.01 -0.82 1 89 GLU 1.35 0.49 1 90 MET 3.50 0.00 1 91 ILE 4.68 -1.22 1 92 ILE 5.09 -1.32 1 93 PHE 3.22 -0.36 1 94 GLU 4.81 -1.06 1 95 LEU 4.06 -1.14 1 96 SER 4.05 -1.37 1 97 LEU 3.20 -1.16 1 98 ARG 4.08 -1.18 1 99 SER 2.75 -0.70 1 100 LEU 1.20 -0.41 1 101 ALA 1.36 -0.77 1 102 LEU 0.51 -0.18 1 103 GLU 0.00 0.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15762_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.51 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _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 42 ALA 1.72 -1.79 0 11 SER 0.28 0.04 1 12 THR 0.32 0.03 1 13 LYS 0.54 0.02 1 17 ILE -0.32 0.00 1 18 ASP -0.42 0.02 1 19 ILE 0.71 0.02 1 21 THR 0.27 0.02 1 22 VAL 0.43 0.03 1 23 ILE -9.51 0.44 1 24 ASP 2.23 -0.33 1 25 ASN 0.20 -0.10 1 26 ASP 0.55 0.02 1 27 ASN 1.28 -0.03 1 29 THR -1.40 1.22 1 30 SER -2.08 0.47 1 31 LYS -2.45 1.12 1 32 PHE -4.19 0.39 1 33 SER -3.69 1.26 1 34 ARG -4.53 -0.14 1 35 PHE -1.76 0.96 1 36 PHE -6.03 0.17 1 37 ALA 2.40 0.14 1 38 THR -7.51 0.45 1 39 ARG 4.63 -0.52 1 40 GLU 5.21 -0.38 1 41 GLU 1.95 -0.35 1 43 GLU 3.01 -0.34 1 44 SER 4.49 -0.25 1 45 PHE 3.38 -0.51 1 46 MET 4.06 -0.06 1 47 THR 6.99 -0.59 1 48 LYS 4.47 -0.23 1 49 LEU 3.90 -0.55 1 50 LYS 5.20 -0.37 1 51 GLU 3.50 -0.21 1 52 LEU 3.77 -0.15 1 53 ALA 4.58 -0.24 1 54 ALA 3.39 -0.12 1 55 ALA 2.35 -0.10 1 56 ALA 0.63 -0.16 1 57 SER -1.53 0.20 1 58 SER 0.60 0.03 1 59 ALA -0.35 0.10 1 60 ASP 2.07 -0.18 1 61 GLU 0.64 -0.04 1 63 ALA -1.65 0.01 1 64 SER -1.01 0.16 1 65 VAL -2.74 0.33 1 66 ALA -4.61 0.48 1 67 TYR -4.19 1.03 1 68 LYS -4.97 0.10 1 69 ILE -1.39 0.92 1 70 LYS -3.75 0.33 1 71 ASP 0.93 0.16 1 72 LEU -2.30 0.44 1 73 GLU 2.25 -0.07 1 75 GLN -2.72 0.61 1 76 VAL -4.20 1.16 1 77 GLU -5.92 0.45 1 78 LEU -4.45 0.72 1 79 ASP -2.88 0.79 1 80 ALA -7.41 0.98 1 81 ALA -4.14 1.00 1 82 PHE -4.35 0.16 1 83 THR 0.48 0.58 1 84 PHE -2.82 0.16 1 85 SER 1.89 -0.10 1 87 GLN 4.31 -0.27 1 88 ALA 4.01 -0.32 1 89 GLU 1.35 -0.47 1 90 MET 3.50 -1.50 1 91 ILE 4.68 -0.46 1 92 ILE 5.09 -0.54 1 93 PHE 3.22 -0.55 1 94 GLU 4.81 -0.83 1 95 LEU 4.06 -0.28 1 96 SER 4.05 -0.22 1 97 LEU 3.20 -0.62 1 98 ARG 4.08 -0.27 1 99 SER 2.75 -0.16 1 100 LEU 1.20 -0.07 1 101 ALA 1.36 -0.01 1 102 LEU 0.51 -0.02 1 103 GLU 0.00 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15762_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.51 _LACS_plot.Line_1_terminator_val_y_1 -4.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.18 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 3.44 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ILE -9.51 -0.09 0 11 SER 0.28 0.33 1 12 THR 0.32 -0.10 1 13 LYS 0.54 0.42 1 17 ILE -0.32 -0.78 1 18 ASP -0.42 -0.01 1 19 ILE 0.71 0.32 1 21 THR 0.27 -0.31 1 22 VAL 0.43 -0.46 1 24 ASP 2.23 0.42 1 25 ASN 0.20 -0.03 1 26 ASP 0.55 -0.05 1 27 ASN 1.28 -0.23 1 29 THR -1.40 -1.11 1 30 SER -2.08 -0.28 1 31 LYS -2.45 -0.89 1 32 PHE -4.19 -2.45 1 33 SER -3.69 -1.21 1 34 ARG -4.53 -3.18 1 35 PHE -1.76 -0.42 1 36 PHE -6.03 -1.02 1 37 ALA 2.40 0.86 1 38 THR -7.51 -0.29 1 39 ARG 4.63 1.13 1 40 GLU 5.21 2.97 1 41 GLU 1.95 2.26 1 42 ALA 1.72 0.93 1 43 GLU 3.01 3.27 1 44 SER 4.49 2.58 1 45 PHE 3.38 1.81 1 46 MET 4.06 2.17 1 47 THR 6.99 1.61 1 48 LYS 4.47 2.54 1 49 LEU 3.90 1.99 1 50 LYS 5.20 3.10 1 51 GLU 3.50 3.38 1 52 LEU 3.77 2.92 1 53 ALA 4.58 1.45 1 54 ALA 3.39 2.31 1 55 ALA 2.35 1.32 1 56 ALA 0.63 -0.62 1 57 SER -1.53 0.18 1 58 SER 0.60 0.26 1 59 ALA -0.35 0.43 1 60 ASP 2.07 0.72 1 61 GLU 0.64 -0.01 1 63 ALA -1.65 -0.45 1 64 SER -1.01 -1.12 1 65 VAL -2.74 -2.30 1 66 ALA -4.61 -2.29 1 67 TYR -4.19 -3.15 1 68 LYS -4.97 -2.19 1 69 ILE -1.39 -1.02 1 70 LYS -3.75 -1.26 1 71 ASP 0.93 -0.98 1 72 LEU -2.30 -1.51 1 73 GLU 2.25 0.10 1 75 GLN -2.72 -2.37 1 77 GLU -5.92 -1.84 1 78 LEU -4.45 -3.97 1 79 ASP -2.88 -1.80 1 80 ALA -7.41 -2.57 1 81 ALA -4.14 -2.44 1 82 PHE -4.35 2.11 1 83 THR 0.48 -1.26 1 84 PHE -2.82 -0.85 1 85 SER 1.89 -0.43 1 87 GLN 4.31 1.69 1 88 ALA 4.01 2.53 1 89 GLU 1.35 0.06 1 90 MET 3.50 1.35 1 91 ILE 4.68 1.94 1 92 ILE 5.09 2.70 1 93 PHE 3.22 -1.84 1 94 GLU 4.81 3.30 1 95 LEU 4.06 2.79 1 96 SER 4.05 1.39 1 97 LEU 3.20 1.54 1 98 ARG 4.08 2.17 1 99 SER 2.75 0.83 1 100 LEU 1.20 -0.10 1 101 ALA 1.36 0.09 1 102 LEU 0.51 0.01 1 stop_ save_