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 bmr17136_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -3.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 4.66 _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 64 MET -7.36 -1.63 0 19 LYS 5.63 1.15 0 10 ALA 4.67 3.38 1 11 ASP 3.82 2.84 1 12 ALA 2.94 2.66 1 13 HIS 6.06 6.13 1 14 GLN 5.29 3.58 1 15 LYS 3.93 4.09 1 16 LEU 2.71 2.53 1 17 GLN 3.97 3.29 1 18 GLU -0.23 -0.85 1 20 GLU -1.53 0.09 1 21 ALA -6.13 -1.96 1 22 VAL -3.05 -2.10 1 23 LEU -4.87 -1.32 1 24 VAL -5.38 -4.41 1 25 ASP -6.05 -2.72 1 26 ILE -0.05 -1.10 1 27 ARG -0.07 0.76 1 28 ASP 2.15 1.15 1 30 GLN 5.56 3.92 1 31 SER 5.58 3.87 1 32 PHE 4.68 4.42 1 33 ALA 3.26 1.93 1 34 MET 1.64 1.34 1 36 HIS -3.23 -1.38 1 37 ALA 2.42 0.25 1 38 VAL 4.01 3.04 1 39 GLN 3.01 1.56 1 40 ALA -0.84 0.85 1 41 PHE -2.27 -0.93 1 42 HIS 0.07 0.09 1 43 LEU -3.16 -1.10 1 44 THR -6.30 -3.48 1 45 ASN 4.90 4.10 1 46 ASP 1.38 1.94 1 47 THR -0.82 -0.54 1 48 LEU 4.12 3.34 1 50 ALA 3.57 2.45 1 51 PHE 5.26 4.81 1 52 MET 2.54 2.84 1 53 ARG 3.30 2.48 1 54 ASP 0.11 0.69 1 55 ASN -1.88 -1.12 1 56 ASP -0.29 -0.47 1 57 PHE 3.18 1.48 1 58 ASP 1.05 -0.12 1 59 THR 1.26 2.13 1 61 VAL -3.55 -1.01 1 62 MET -4.09 -1.80 1 63 VAL -0.90 -0.83 1 66 TYR -3.29 -0.29 1 67 HIS -1.70 1.11 1 69 ASN 1.82 2.39 1 70 SER 4.67 3.68 1 71 SER 4.58 2.86 1 72 LYS 5.03 4.08 1 74 ALA 0.85 1.91 1 75 ALA 4.57 2.69 1 76 GLN 4.20 3.22 1 77 TYR 4.62 3.92 1 78 LEU 4.43 3.52 1 79 LEU 3.54 2.96 1 80 GLN 4.23 2.53 1 81 GLN 1.06 0.08 1 83 TYR 4.89 3.83 1 84 ASP 0.39 2.49 1 85 VAL -0.65 0.18 1 86 VAL -5.45 -2.53 1 87 TYR -6.57 -2.82 1 88 SER -2.88 -1.64 1 89 ILE 0.42 -0.18 1 90 ASP 2.96 2.10 1 93 PHE 4.17 3.45 1 94 GLU 3.65 3.25 1 95 ALA 1.99 1.91 1 96 TRP 4.64 3.98 1 97 GLN 4.64 2.67 1 98 ARG 2.71 2.34 1 99 GLN 1.33 1.60 1 100 PHE 0.23 -0.72 1 102 ALA 0.87 0.39 1 103 GLU -0.09 -1.27 1 104 VAL -2.83 -0.92 1 105 ALA -6.56 -2.95 1 106 TYR -3.61 -0.85 1 108 ALA 0.47 1.40 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17136_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 4.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.61 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 -1.40 _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 64 MET -7.36 5.73 0 19 LYS 5.63 -4.48 0 10 ALA 4.67 -1.29 1 11 ASP 3.82 -0.98 1 12 ALA 2.94 -0.28 1 13 HIS 6.06 0.07 1 14 GLN 5.29 -1.71 1 15 LYS 3.93 0.16 1 16 LEU 2.71 -0.18 1 17 GLN 3.97 -0.68 1 18 GLU -0.23 -0.62 1 20 GLU -1.53 1.62 1 21 ALA -6.13 4.17 1 22 VAL -3.05 0.95 1 23 LEU -4.87 3.55 1 24 VAL -5.38 0.97 1 25 ASP -6.05 3.33 1 26 ILE -0.05 -1.05 1 27 ARG -0.07 0.83 1 28 ASP 2.15 -1.00 1 30 GLN 5.56 -1.64 1 31 SER 5.58 -1.71 1 32 PHE 4.68 -0.26 1 33 ALA 3.26 -1.33 1 34 MET 1.64 -0.30 1 36 HIS -3.23 1.85 1 37 ALA 2.42 -2.17 1 38 VAL 4.01 -0.97 1 39 GLN 3.01 -1.45 1 40 ALA -0.84 1.69 1 41 PHE -2.27 1.34 1 42 HIS 0.07 0.02 1 43 LEU -3.16 2.06 1 44 THR -6.30 2.82 1 45 ASN 4.90 -0.80 1 46 ASP 1.38 0.56 1 47 THR -0.82 0.28 1 48 LEU 4.12 -0.78 1 50 ALA 3.57 -1.12 1 51 PHE 5.26 -0.45 1 52 MET 2.54 0.30 1 53 ARG 3.30 -0.82 1 54 ASP 0.11 0.58 1 55 ASN -1.88 0.76 1 56 ASP -0.29 -0.18 1 57 PHE 3.18 -1.70 1 58 ASP 1.05 -1.17 1 59 THR 1.26 0.87 1 61 VAL -3.55 2.54 1 62 MET -4.09 2.29 1 63 VAL -0.90 0.07 1 66 TYR -3.29 3.00 1 67 HIS -1.70 2.81 1 69 ASN 1.82 0.57 1 70 SER 4.67 -0.99 1 71 SER 4.58 -1.72 1 72 LYS 5.03 -0.95 1 74 ALA 0.85 1.06 1 75 ALA 4.57 -1.88 1 76 GLN 4.20 -0.98 1 77 TYR 4.62 -0.70 1 78 LEU 4.43 -0.91 1 79 LEU 3.54 -0.58 1 80 GLN 4.23 -1.70 1 81 GLN 1.06 -0.98 1 83 TYR 4.89 -1.06 1 84 ASP 0.39 2.10 1 85 VAL -0.65 0.83 1 86 VAL -5.45 2.92 1 87 TYR -6.57 3.75 1 88 SER -2.88 1.24 1 89 ILE 0.42 -0.60 1 90 ASP 2.96 -0.86 1 93 PHE 4.17 -0.72 1 94 GLU 3.65 -0.40 1 95 ALA 1.99 -0.08 1 96 TRP 4.64 -0.66 1 97 GLN 4.64 -1.97 1 98 ARG 2.71 -0.37 1 99 GLN 1.33 0.27 1 100 PHE 0.23 -0.95 1 102 ALA 0.87 -0.48 1 103 GLU -0.09 -1.18 1 104 VAL -2.83 1.91 1 105 ALA -6.56 3.61 1 106 TYR -3.61 2.76 1 108 ALA 0.47 0.93 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17136_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _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 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 HIS -3.23 -1.01 0 10 ALA 4.67 -0.11 1 11 ASP 3.82 -0.22 1 12 ALA 2.94 -0.42 1 13 HIS 6.06 -0.83 1 14 GLN 5.29 -0.35 1 15 LYS 3.93 -0.36 1 16 LEU 2.71 -0.22 1 17 GLN 3.97 -0.46 1 18 GLU -0.23 -0.08 1 19 LYS 5.63 -0.27 1 20 GLU -1.53 -0.09 1 21 ALA -6.13 0.48 1 22 VAL -3.05 0.33 1 23 LEU -4.87 0.80 1 24 VAL -5.38 1.33 1 25 ASP -6.05 0.89 1 26 ILE -0.05 0.88 1 27 ARG -0.07 -0.35 1 28 ASP 2.15 -0.06 1 30 GLN 5.56 -0.25 1 31 SER 5.58 -0.38 1 32 PHE 4.68 -1.08 1 33 ALA 3.26 -0.31 1 34 MET 1.64 -0.13 1 37 ALA 2.42 0.20 1 38 VAL 4.01 -0.57 1 39 GLN 3.01 -0.24 1 40 ALA -0.84 -0.40 1 41 PHE -2.27 -0.08 1 42 HIS 0.07 -0.46 1 43 LEU -3.16 -0.12 1 44 THR -6.30 -0.05 1 45 ASN 4.90 -0.49 1 46 ASP 1.38 -0.01 1 47 THR -0.82 0.32 1 48 LEU 4.12 -0.23 1 50 ALA 3.57 -0.41 1 51 PHE 5.26 -1.19 1 52 MET 2.54 -0.37 1 53 ARG 3.30 -0.49 1 54 ASP 0.11 -0.13 1 55 ASN -1.88 -0.01 1 56 ASP -0.29 -0.44 1 57 PHE 3.18 -0.41 1 58 ASP 1.05 0.11 1 59 THR 1.26 -0.23 1 61 VAL -3.55 0.46 1 62 MET -4.09 0.78 1 63 VAL -0.90 0.26 1 64 MET -7.36 1.10 1 67 HIS -1.70 0.35 1 69 ASN 1.82 0.19 1 70 SER 4.67 0.02 1 71 SER 4.58 -0.78 1 72 LYS 5.03 -1.09 1 74 ALA 0.85 -0.23 1 75 ALA 4.57 -0.53 1 76 GLN 4.20 -0.33 1 77 TYR 4.62 -0.42 1 78 LEU 4.43 -0.35 1 79 LEU 3.54 0.29 1 80 GLN 4.23 -0.44 1 81 GLN 1.06 -0.41 1 83 TYR 4.89 -0.28 1 84 ASP 0.39 -0.20 1 85 VAL -0.65 -0.07 1 86 VAL -5.45 0.96 1 87 TYR -6.57 1.37 1 88 SER -2.88 0.39 1 89 ILE 0.42 0.39 1 90 ASP 2.96 -0.07 1 93 PHE 4.17 -0.07 1 94 GLU 3.65 -0.52 1 95 ALA 1.99 -0.22 1 96 TRP 4.64 -0.89 1 97 GLN 4.64 -1.01 1 98 ARG 2.71 -0.49 1 99 GLN 1.33 -0.66 1 100 PHE 0.23 -0.08 1 102 ALA 0.87 0.20 1 103 GLU -0.09 0.27 1 104 VAL -2.83 0.41 1 105 ALA -6.56 -0.03 1 106 TYR -3.61 -0.26 1 108 ALA 0.47 -0.15 1 stop_ save_