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 bmr25675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 -3.33 _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 -1.57 _LACS_plot.Line_2_terminator_val_x_2 5.66 _LACS_plot.Line_2_terminator_val_y_2 3.94 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 LEU -7.64 -1.45 0 10 HIS 0.37 0.27 1 12 SER 0.25 0.23 1 13 MET 0.16 0.10 1 15 GLU -1.30 -0.97 1 16 TYR -3.90 -1.19 1 17 ILE -3.72 -1.66 1 18 ARG -0.99 -0.16 1 19 VAL -5.12 -2.31 1 20 THR -6.10 -4.07 1 21 GLU 1.25 0.30 1 22 ASP -2.51 -0.73 1 23 GLU 3.30 2.84 1 24 ASN 0.80 0.80 1 25 ASP -1.70 -2.01 1 26 GLU 0.22 -0.08 1 28 ILE -3.48 -1.65 1 29 GLU -0.45 -1.31 1 30 ILE -3.14 -2.99 1 32 SER -3.99 -2.09 1 34 ASP 3.77 2.76 1 35 ASP 0.01 -1.28 1 37 THR -1.72 -0.23 1 38 VAL -3.73 -1.16 1 39 LEU 1.63 -0.11 1 40 LEU 4.56 3.16 1 41 SER 3.86 2.09 1 42 THR 5.30 3.41 1 43 VAL 5.67 4.61 1 44 THR 3.39 2.56 1 45 ALA 2.95 2.13 1 46 GLN -0.97 -0.45 1 47 PHE -1.37 -0.86 1 50 ALA -0.38 0.91 1 54 ARG -5.19 -1.55 1 55 TYR -4.21 -1.91 1 56 ARG -0.68 -0.83 1 57 ASN -1.08 -0.04 1 59 VAL 3.46 2.52 1 60 SER -1.32 0.01 1 61 GLN 5.04 1.64 1 63 MET -0.34 -0.41 1 64 ARG -4.84 -2.21 1 66 VAL 0.50 0.28 1 67 ARG 2.35 2.38 1 68 LEU -2.98 -1.29 1 69 VAL -3.05 -0.85 1 70 GLU 2.94 0.23 1 72 ILE 0.28 0.33 1 73 LEU -0.34 -0.86 1 74 HIS -3.02 -1.17 1 75 ALA 1.59 -0.56 1 77 ASP 4.49 3.30 1 78 ALA 0.57 0.22 1 80 TRP -0.32 1.17 1 82 ASN -0.88 -1.12 1 83 LEU 0.24 -0.30 1 84 VAL 1.18 0.24 1 85 TYR -1.52 0.22 1 86 VAL -2.72 -2.20 1 87 VAL 1.71 1.53 1 88 ASN -3.64 -1.77 1 89 TYR -0.01 1.71 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 4.31 _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 0.43 _LACS_plot.Line_2_terminator_val_x_2 5.66 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 LEU -7.64 6.19 0 10 HIS 0.37 -0.10 1 12 SER 0.25 -0.02 1 13 MET 0.16 -0.06 1 15 GLU -1.30 0.33 1 16 TYR -3.90 2.71 1 17 ILE -3.72 2.06 1 18 ARG -0.99 0.83 1 19 VAL -5.12 2.81 1 20 THR -6.10 2.03 1 21 GLU 1.25 -0.95 1 22 ASP -2.51 1.78 1 23 GLU 3.30 -0.46 1 24 ASN 0.80 0.00 1 25 ASP -1.70 -0.31 1 26 GLU 0.22 -0.30 1 28 ILE -3.48 1.83 1 29 GLU -0.45 -0.86 1 30 ILE -3.14 0.15 1 32 SER -3.99 1.90 1 34 ASP 3.77 -1.01 1 35 ASP 0.01 -1.29 1 37 THR -1.72 1.49 1 38 VAL -3.73 2.57 1 39 LEU 1.63 -1.74 1 40 LEU 4.56 -1.40 1 41 SER 3.86 -1.77 1 42 THR 5.30 -1.89 1 43 VAL 5.67 -1.06 1 44 THR 3.39 -0.83 1 45 ALA 2.95 -0.82 1 46 GLN -0.97 0.52 1 47 PHE -1.37 0.51 1 50 ALA -0.38 1.29 1 54 ARG -5.19 3.64 1 55 TYR -4.21 2.30 1 56 ARG -0.68 -0.15 1 57 ASN -1.08 1.04 1 59 VAL 3.46 -0.94 1 60 SER -1.32 1.33 1 61 GLN 5.04 -3.40 1 63 MET -0.34 -0.07 1 64 ARG -4.84 2.63 1 66 VAL 0.50 -0.22 1 67 ARG 2.35 0.03 1 68 LEU -2.98 1.69 1 69 VAL -3.05 2.20 1 70 GLU 2.94 -2.71 1 72 ILE 0.28 0.05 1 73 LEU -0.34 -0.52 1 74 HIS -3.02 1.85 1 75 ALA 1.59 -2.15 1 77 ASP 4.49 -1.19 1 78 ALA 0.57 -0.35 1 80 TRP -0.32 1.49 1 82 ASN -0.88 -0.24 1 83 LEU 0.24 -0.54 1 84 VAL 1.18 -0.94 1 85 TYR -1.52 1.74 1 86 VAL -2.72 0.52 1 87 VAL 1.71 -0.18 1 88 ASN -3.64 1.87 1 89 TYR -0.01 1.72 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 0.65 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 5.66 _LACS_plot.Line_2_terminator_val_y_2 -0.48 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 ALA 1.59 -2.87 0 10 HIS 0.37 -0.14 1 12 SER 0.25 -0.06 1 13 MET 0.16 0.04 1 15 GLU -1.30 -0.11 1 16 TYR -3.90 0.51 1 17 ILE -3.72 0.38 1 18 ARG -0.99 0.54 1 19 VAL -5.12 1.34 1 20 THR -6.10 0.73 1 21 GLU 1.25 -0.18 1 22 ASP -2.51 -0.04 1 23 GLU 3.30 -0.41 1 24 ASN 0.80 -0.05 1 25 ASP -1.70 0.32 1 26 GLU 0.22 -0.11 1 28 ILE -3.48 0.30 1 29 GLU -0.45 0.56 1 30 ILE -3.14 0.30 1 32 SER -3.99 0.10 1 34 ASP 3.77 -0.37 1 35 ASP 0.01 -0.14 1 37 THR -1.72 0.44 1 38 VAL -3.73 0.23 1 39 LEU 1.63 0.16 1 40 LEU 4.56 -0.37 1 41 SER 3.86 -0.11 1 42 THR 5.30 -0.36 1 43 VAL 5.67 -0.53 1 44 THR 3.39 -0.15 1 45 ALA 2.95 -0.27 1 46 GLN -0.97 -0.21 1 47 PHE -1.37 0.07 1 50 ALA -0.38 -0.49 1 53 LEU -7.64 1.00 1 54 ARG -5.19 1.27 1 55 TYR -4.21 0.24 1 56 ARG -0.68 -0.06 1 57 ASN -1.08 -0.24 1 59 VAL 3.46 -0.21 1 60 SER -1.32 -0.04 1 61 GLN 5.04 -0.48 1 63 MET -0.34 -0.39 1 64 ARG -4.84 0.13 1 66 VAL 0.50 0.08 1 67 ARG 2.35 -0.29 1 68 LEU -2.98 0.86 1 69 VAL -3.05 0.21 1 70 GLU 2.94 -0.43 1 72 ILE 0.28 0.07 1 73 LEU -0.34 0.86 1 74 HIS -3.02 -0.12 1 77 ASP 4.49 -0.55 1 78 ALA 0.57 -0.07 1 80 TRP -0.32 -0.12 1 82 ASN -0.88 0.34 1 83 LEU 0.24 -0.21 1 84 VAL 1.18 -0.07 1 85 TYR -1.52 0.15 1 86 VAL -2.72 0.63 1 87 VAL 1.71 -0.33 1 88 ASN -3.64 0.03 1 89 TYR -0.01 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 -2.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 5.66 _LACS_plot.Line_2_terminator_val_y_2 0.96 _LACS_plot.Y_axis_chem_shift_offset 0.51 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 TRP -0.32 4.09 0 10 HIS 0.37 0.48 1 12 SER 0.25 0.22 1 13 MET 0.16 -0.30 1 15 GLU -1.30 -1.70 1 16 TYR -3.90 -0.96 1 17 ILE -3.72 -1.65 1 18 ARG -0.99 -1.31 1 19 VAL -5.12 -2.32 1 20 THR -6.10 -2.39 1 21 GLU 1.25 -1.34 1 22 ASP -2.51 -0.91 1 23 GLU 3.30 -0.54 1 24 ASN 0.80 -0.56 1 25 ASP -1.70 -1.03 1 28 ILE -3.48 -1.22 1 29 GLU -0.45 -0.86 1 32 SER -3.99 0.57 1 34 ASP 3.77 -0.62 1 35 ASP 0.01 1.17 1 37 THR -1.72 1.17 1 38 VAL -3.73 -1.11 1 39 LEU 1.63 1.06 1 40 LEU 4.56 1.02 1 41 SER 3.86 2.16 1 42 THR 5.30 1.53 1 43 VAL 5.67 2.50 1 44 THR 3.39 1.64 1 45 ALA 2.95 0.89 1 46 GLN -0.97 -1.18 1 50 ALA -0.38 -0.27 1 53 LEU -7.64 -2.04 1 54 ARG -5.19 -2.66 1 55 TYR -4.21 -3.48 1 56 ARG -0.68 -0.70 1 59 VAL 3.46 0.78 1 60 SER -1.32 0.65 1 61 GLN 5.04 -1.12 1 63 MET -0.34 0.14 1 64 ARG -4.84 -1.68 1 66 VAL 0.50 -0.08 1 67 ARG 2.35 -2.80 1 68 LEU -2.98 -1.65 1 69 VAL -3.05 -0.14 1 70 GLU 2.94 -0.71 1 72 ILE 0.28 -1.52 1 73 LEU -0.34 -1.67 1 74 HIS -3.02 -1.73 1 77 ASP 4.49 0.68 1 78 ALA 0.57 -0.34 1 82 ASN -0.88 0.01 1 83 LEU 0.24 -3.16 1 84 VAL 1.18 -1.67 1 85 TYR -1.52 -1.59 1 86 VAL -2.72 0.23 1 87 VAL 1.71 -1.56 1 88 ASN -3.64 -2.30 1 stop_ save_