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 bmr27738_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 -2.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 5.89 _LACS_plot.Line_2_terminator_val_y_2 4.39 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 HIS -7.30 -0.50 0 11 ASP 1.80 0.40 1 13 ARG -3.00 0.80 1 14 THR 3.30 0.20 1 15 PHE -2.18 -1.08 1 17 LYS -4.80 -2.70 1 18 ARG 3.60 2.80 1 20 GLN -1.20 0.60 1 21 THR 2.00 1.30 1 23 VAL 0.50 -0.70 1 24 VAL -7.60 -4.30 1 26 TYR -7.90 -2.00 1 27 THR -1.60 1.20 1 30 LEU -0.40 -0.90 1 31 GLU 2.90 3.20 1 32 ASP 0.20 -0.60 1 34 LYS 1.20 1.10 1 35 LYS 0.26 0.50 1 36 PHE -3.30 -1.40 1 37 ASP -3.30 0.50 1 38 SER -2.50 -1.30 1 39 SER 4.90 3.30 1 40 ARG 4.60 3.00 1 41 ASP 2.90 2.30 1 42 ARG -0.50 0.20 1 43 ASN 1.95 1.07 1 44 LYS -3.77 -0.50 1 46 PHE -4.80 -0.90 1 47 LYS -4.70 -2.00 1 48 PHE -4.30 -2.00 1 49 MET -2.20 -1.00 1 50 LEU 2.40 2.10 1 52 LYS -1.90 -1.40 1 53 GLN 4.40 1.50 1 54 GLU -0.70 0.80 1 55 VAL -7.81 -4.59 1 56 ILE 1.00 0.90 1 57 ARG 3.80 3.90 1 59 TRP 2.40 2.20 1 60 GLU 4.60 4.40 1 61 GLU 1.70 2.00 1 63 VAL 4.70 3.20 1 64 ALA 2.10 2.00 1 65 GLN -1.20 -0.20 1 66 MET -3.30 -0.30 1 67 SER -6.30 -3.90 1 68 VAL 5.90 4.90 1 70 GLN -1.40 0.10 1 71 ARG -5.30 -2.10 1 72 ALA -6.20 -1.40 1 73 LYS -3.10 -1.50 1 74 LEU -3.50 -1.80 1 75 THR 2.20 1.50 1 76 ILE -3.13 -0.13 1 77 SER 1.68 1.43 1 79 ASP 3.40 1.90 1 80 TYR -0.70 -0.20 1 81 ALA -1.20 -0.80 1 82 TYR 1.79 1.07 1 84 ALA 0.80 1.20 1 85 THR 2.43 2.23 1 87 HIS -4.05 -0.57 1 90 ILE -1.40 1.70 1 91 ILE -4.49 -2.09 1 94 HIS 2.97 1.91 1 95 ALA -1.60 0.20 1 96 THR 1.70 1.90 1 97 LEU -6.50 -2.20 1 98 VAL -3.30 -1.50 1 99 PHE -6.60 -2.50 1 100 ASP -2.90 -1.40 1 101 VAL -4.00 -1.10 1 102 GLU -6.80 -2.60 1 103 LEU -0.20 -0.80 1 104 LEU 1.40 2.20 1 105 LYS -3.40 -0.70 1 106 LEU -4.30 -2.00 1 107 GLU -3.09 0.02 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27738_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 4.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 5.89 _LACS_plot.Line_2_terminator_val_y_2 -1.50 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 HIS -7.30 6.80 0 11 ASP 1.80 -1.40 1 13 ARG -3.00 3.80 1 14 THR 3.30 -3.10 1 15 PHE -2.18 1.10 1 17 LYS -4.80 2.10 1 18 ARG 3.60 -0.80 1 20 GLN -1.20 1.80 1 21 THR 2.00 -0.70 1 23 VAL 0.50 -1.20 1 24 VAL -7.60 3.30 1 26 TYR -7.90 5.90 1 27 THR -1.60 2.80 1 30 LEU -0.40 -0.50 1 31 GLU 2.90 0.30 1 32 ASP 0.20 -0.80 1 34 LYS 1.20 -0.10 1 35 LYS 0.26 0.24 1 36 PHE -3.30 1.90 1 37 ASP -3.30 3.80 1 38 SER -2.50 1.20 1 39 SER 4.90 -1.60 1 40 ARG 4.60 -1.60 1 41 ASP 2.90 -0.60 1 42 ARG -0.50 0.70 1 43 ASN 1.95 -0.88 1 44 LYS -3.77 3.27 1 46 PHE -4.80 3.90 1 47 LYS -4.70 2.70 1 48 PHE -4.30 2.30 1 49 MET -2.20 1.20 1 50 LEU 2.40 -0.30 1 52 LYS -1.90 0.50 1 53 GLN 4.40 -2.90 1 54 GLU -0.70 1.50 1 55 VAL -7.81 3.22 1 56 ILE 1.00 -0.10 1 57 ARG 3.80 0.10 1 59 TRP 2.40 -0.20 1 60 GLU 4.60 -0.20 1 61 GLU 1.70 0.30 1 63 VAL 4.70 -1.50 1 64 ALA 2.10 -0.10 1 65 GLN -1.20 1.00 1 66 MET -3.30 3.00 1 67 SER -6.30 2.40 1 68 VAL 5.90 -1.00 1 70 GLN -1.40 1.50 1 71 ARG -5.30 3.20 1 72 ALA -6.20 4.80 1 73 LYS -3.10 1.60 1 74 LEU -3.50 1.70 1 75 THR 2.20 -0.70 1 76 ILE -3.13 3.00 1 77 SER 1.68 -0.25 1 79 ASP 3.40 -1.50 1 80 TYR -0.70 0.50 1 81 ALA -1.20 0.40 1 82 TYR 1.79 -0.72 1 84 ALA 0.80 0.40 1 85 THR 2.43 -0.20 1 87 HIS -4.05 3.48 1 90 ILE -1.40 3.10 1 91 ILE -4.49 2.40 1 94 HIS 2.97 -1.06 1 95 ALA -1.60 1.80 1 96 THR 1.70 0.20 1 97 LEU -6.50 4.30 1 98 VAL -3.30 1.80 1 99 PHE -6.60 4.10 1 100 ASP -2.90 1.50 1 101 VAL -4.00 2.90 1 102 GLU -6.80 4.20 1 103 LEU -0.20 -0.60 1 104 LEU 1.40 0.80 1 105 LYS -3.40 2.70 1 106 LEU -4.30 2.30 1 107 GLU -3.09 3.11 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27738_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 0.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 5.89 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 THR 2.20 0.69 0 55 VAL -7.81 0.17 0 26 TYR -7.90 1.89 0 11 ASP 1.80 -0.37 1 13 ARG -3.00 0.35 1 14 THR 3.30 -0.17 1 15 PHE -2.18 0.32 1 17 LYS -4.80 0.26 1 18 ARG 3.60 -0.74 1 20 GLN -1.20 0.13 1 21 THR 2.00 0.09 1 23 VAL 0.50 0.46 1 24 VAL -7.60 1.72 1 25 HIS -7.30 1.11 1 27 THR -1.60 0.16 1 30 LEU -0.40 0.40 1 31 GLU 2.90 -0.57 1 32 ASP 0.20 -0.24 1 34 LYS 1.20 -0.23 1 35 LYS 0.26 0.14 1 36 PHE -3.30 0.47 1 37 ASP -3.30 0.17 1 38 SER -2.50 0.13 1 39 SER 4.90 -0.35 1 40 ARG 4.60 -0.76 1 41 ASP 2.90 -0.36 1 42 ARG -0.50 0.06 1 43 ASN 1.95 -0.35 1 44 LYS -3.77 0.28 1 46 PHE -4.80 0.31 1 47 LYS -4.70 1.23 1 48 PHE -4.30 0.06 1 49 MET -2.20 0.20 1 50 LEU 2.40 -0.15 1 52 LYS -1.90 0.11 1 53 GLN 4.40 -0.40 1 54 GLU -0.70 -0.16 1 56 ILE 1.00 -0.34 1 57 ARG 3.80 -0.29 1 59 TRP 2.40 -0.46 1 60 GLU 4.60 -0.47 1 61 GLU 1.70 -0.22 1 63 VAL 4.70 -0.25 1 64 ALA 2.10 -0.36 1 65 GLN -1.20 -0.01 1 66 MET -3.30 0.29 1 67 SER -6.30 0.34 1 68 VAL 5.90 -1.04 1 70 GLN -1.40 -0.32 1 71 ARG -5.30 1.31 1 72 ALA -6.20 0.77 1 73 LYS -3.10 0.90 1 74 LEU -3.50 1.12 1 76 ILE -3.13 0.51 1 77 SER 1.68 -0.07 1 79 ASP 3.40 -0.27 1 80 TYR -0.70 -0.18 1 81 ALA -1.20 0.06 1 82 TYR 1.79 0.04 1 84 ALA 0.80 -0.99 1 85 THR 2.43 -0.32 1 87 HIS -4.05 -0.06 1 90 ILE -1.40 0.07 1 91 ILE -4.49 0.01 1 94 HIS 2.97 -0.92 1 95 ALA -1.60 0.12 1 96 THR 1.70 0.28 1 97 LEU -6.50 0.74 1 98 VAL -3.30 1.07 1 99 PHE -6.60 1.13 1 100 ASP -2.90 0.49 1 101 VAL -4.00 0.85 1 102 GLU -6.80 1.02 1 103 LEU -0.20 0.31 1 104 LEU 1.40 -0.19 1 105 LYS -3.40 -0.02 1 106 LEU -4.30 0.86 1 107 GLU -3.09 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27738_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.90 _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 0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 5.89 _LACS_plot.Line_2_terminator_val_y_2 1.67 _LACS_plot.Y_axis_chem_shift_offset 0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 GLU -3.09 4.01 0 25 HIS -7.30 2.58 0 11 ASP 1.80 2.00 1 13 ARG -3.00 -1.29 1 14 THR 3.30 -2.40 1 15 PHE -2.18 0.03 1 17 LYS -4.80 -0.55 1 18 ARG 3.60 1.07 1 20 GLN -1.20 -1.03 1 21 THR 2.00 -0.92 1 23 VAL 0.50 -0.40 1 24 VAL -7.60 -0.76 1 26 TYR -7.90 -2.09 1 27 THR -1.60 -1.93 1 30 LEU -0.40 1.68 1 31 GLU 2.90 -0.01 1 32 ASP 0.20 0.88 1 34 LYS 1.20 -0.30 1 35 LYS 0.26 0.08 1 36 PHE -3.30 -1.33 1 37 ASP -3.30 -1.52 1 38 SER -2.50 0.34 1 39 SER 4.90 2.43 1 40 ARG 4.60 3.49 1 41 ASP 2.90 0.54 1 42 ARG -0.50 -0.83 1 43 ASN 1.95 -1.11 1 44 LYS -3.77 -2.41 1 46 PHE -4.80 -2.82 1 47 LYS -4.70 -1.85 1 48 PHE -4.30 -4.10 1 49 MET -2.20 0.17 1 50 LEU 2.40 0.19 1 52 LYS -1.90 -1.18 1 53 GLN 4.40 0.05 1 54 GLU -0.70 -0.34 1 55 VAL -7.81 -1.04 1 56 ILE 1.00 0.93 1 57 ARG 3.80 3.13 1 59 TRP 2.40 1.38 1 60 GLU 4.60 1.80 1 61 GLU 1.70 2.71 1 63 VAL 4.70 1.06 1 64 ALA 2.10 -0.01 1 65 GLN -1.20 -0.44 1 66 MET -3.30 -3.86 1 67 SER -6.30 1.67 1 68 VAL 5.90 0.11 1 70 GLN -1.40 -2.41 1 71 ARG -5.30 -0.75 1 72 ALA -6.20 -4.73 1 73 LYS -3.10 -0.55 1 74 LEU -3.50 -1.48 1 75 THR 2.20 0.43 1 76 ILE -3.13 -2.43 1 77 SER 1.68 0.89 1 79 ASP 3.40 0.43 1 80 TYR -0.70 -2.58 1 81 ALA -1.20 -1.89 1 82 TYR 1.79 0.69 1 84 ALA 0.80 -0.43 1 85 THR 2.43 2.37 1 87 HIS -4.05 -0.37 1 90 ILE -1.40 -1.98 1 91 ILE -4.49 -0.69 1 94 HIS 2.97 -0.58 1 95 ALA -1.60 -0.57 1 96 THR 1.70 -0.96 1 97 LEU -6.50 -2.64 1 98 VAL -3.30 -1.13 1 99 PHE -6.60 -1.53 1 100 ASP -2.90 0.56 1 101 VAL -4.00 -3.71 1 102 GLU -6.80 -1.45 1 103 LEU -0.20 -3.37 1 104 LEU 1.40 0.31 1 105 LYS -3.40 -4.41 1 106 LEU -4.30 -1.60 1 stop_ save_