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 bmr30345_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.65 _LACS_plot.Line_1_terminator_val_y_1 -3.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.36 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 4.56 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 LEU -7.65 -1.47 0 10 VAL -4.48 -2.01 1 11 THR -5.85 -3.66 1 12 GLU -0.30 0.65 1 13 ASP -3.99 -0.54 1 14 GLU 3.07 3.06 1 15 ASN 0.70 0.98 1 16 ASP -2.15 -1.09 1 17 GLU -0.89 0.23 1 19 ILE -3.28 -1.98 1 21 ILE -3.70 -4.40 1 23 SER -3.57 -1.68 1 24 GLU -3.55 -2.09 1 25 ASP 3.85 2.84 1 26 ASP -0.46 -1.35 1 28 THR -1.08 0.10 1 29 VAL -3.56 -0.92 1 30 LEU 1.21 -0.14 1 31 LEU 4.46 3.26 1 32 SER 4.07 2.47 1 33 THR 6.48 4.61 1 34 VAL 6.00 4.95 1 35 THR 3.44 2.57 1 36 ALA 1.30 1.68 1 37 GLN -1.28 -1.58 1 38 PHE -1.15 -0.73 1 41 ALA -0.17 0.73 1 45 ARG -5.30 -1.65 1 46 TYR -3.94 -1.75 1 47 ARG -1.48 -1.05 1 48 ASN -1.07 -0.43 1 50 VAL 2.94 1.94 1 51 GLU -2.29 -0.39 1 52 GLN 3.20 0.89 1 54 MET -0.56 -1.09 1 55 ARG -5.16 -2.34 1 57 VAL 0.32 0.10 1 58 ARG 2.35 2.39 1 59 LEU -3.26 -1.45 1 60 VAL -2.73 -0.76 1 61 GLU 2.70 0.60 1 63 ILE 0.34 0.29 1 64 LEU -0.48 -0.85 1 65 HIS -3.86 -0.51 1 66 ALA 1.53 -0.61 1 68 ASP 4.64 3.46 1 69 ALA 0.51 0.17 1 71 TRP -0.21 1.27 1 73 ASN -0.60 -1.00 1 74 LEU 0.20 -0.36 1 75 VAL 1.06 0.16 1 76 TYR -1.64 0.25 1 77 VAL -3.16 -2.33 1 78 VAL 0.94 0.69 1 79 ASN -3.72 -2.22 1 80 TYR -0.50 0.53 1 82 LYS -0.49 -0.29 1 83 ASP 0.97 2.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30345_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.65 _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 -0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.64 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -1.91 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 LEU -7.65 6.18 0 10 VAL -4.48 2.47 1 11 THR -5.85 2.19 1 12 GLU -0.30 0.95 1 13 ASP -3.99 3.45 1 14 GLU 3.07 -0.01 1 15 ASN 0.70 0.28 1 16 ASP -2.15 1.06 1 17 GLU -0.89 1.12 1 19 ILE -3.28 1.30 1 21 ILE -3.70 -0.70 1 23 SER -3.57 1.89 1 24 GLU -3.55 1.46 1 25 ASP 3.85 -1.01 1 26 ASP -0.46 -0.89 1 28 THR -1.08 1.18 1 29 VAL -3.56 2.64 1 30 LEU 1.21 -1.35 1 31 LEU 4.46 -1.20 1 32 SER 4.07 -1.60 1 33 THR 6.48 -1.87 1 34 VAL 6.00 -1.05 1 35 THR 3.44 -0.87 1 36 ALA 1.30 0.38 1 37 GLN -1.28 -0.30 1 38 PHE -1.15 0.42 1 41 ALA -0.17 0.90 1 45 ARG -5.30 3.65 1 46 TYR -3.94 2.19 1 47 ARG -1.48 0.43 1 48 ASN -1.07 0.64 1 50 VAL 2.94 -1.00 1 51 GLU -2.29 1.90 1 52 GLN 3.20 -2.31 1 54 MET -0.56 -0.53 1 55 ARG -5.16 2.82 1 57 VAL 0.32 -0.22 1 58 ARG 2.35 0.04 1 59 LEU -3.26 1.81 1 60 VAL -2.73 1.97 1 61 GLU 2.70 -2.10 1 63 ILE 0.34 -0.05 1 64 LEU -0.48 -0.37 1 65 HIS -3.86 3.35 1 66 ALA 1.53 -2.14 1 68 ASP 4.64 -1.18 1 69 ALA 0.51 -0.34 1 71 TRP -0.21 1.48 1 73 ASN -0.60 -0.40 1 74 LEU 0.20 -0.56 1 75 VAL 1.06 -0.90 1 76 TYR -1.64 1.89 1 77 VAL -3.16 0.83 1 78 VAL 0.94 -0.25 1 79 ASN -3.72 1.50 1 80 TYR -0.50 1.03 1 82 LYS -0.49 0.20 1 83 ASP 0.97 1.06 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30345_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.65 _LACS_plot.Line_1_terminator_val_y_1 0.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -0.43 _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 66 ALA 1.53 -2.88 0 10 VAL -4.48 1.34 1 11 THR -5.85 0.73 1 12 GLU -0.30 -0.01 1 13 ASP -3.99 0.00 1 14 GLU 3.07 -0.43 1 15 ASN 0.70 0.00 1 16 ASP -2.15 0.22 1 17 GLU -0.89 -0.12 1 19 ILE -3.28 0.33 1 21 ILE -3.70 -0.28 1 23 SER -3.57 0.11 1 24 GLU -3.55 -0.19 1 25 ASP 3.85 -0.37 1 26 ASP -0.46 -0.10 1 28 THR -1.08 0.42 1 29 VAL -3.56 0.24 1 30 LEU 1.21 0.23 1 31 LEU 4.46 -0.32 1 32 SER 4.07 -0.09 1 33 THR 6.48 -0.25 1 34 VAL 6.00 -0.44 1 35 THR 3.44 -0.18 1 36 ALA 1.30 -0.15 1 37 GLN -1.28 -0.31 1 38 PHE -1.15 0.04 1 41 ALA -0.17 -0.15 1 44 LEU -7.65 1.02 1 45 ARG -5.30 1.35 1 46 TYR -3.94 0.34 1 47 ARG -1.48 0.10 1 48 ASN -1.07 -0.06 1 50 VAL 2.94 -0.11 1 51 GLU -2.29 0.02 1 52 GLN 3.20 -0.38 1 54 MET -0.56 0.40 1 55 ARG -5.16 0.13 1 57 VAL 0.32 0.12 1 58 ARG 2.35 -0.26 1 59 LEU -3.26 1.00 1 60 VAL -2.73 0.24 1 61 GLU 2.70 -0.45 1 63 ILE 0.34 0.10 1 64 LEU -0.48 0.89 1 65 HIS -3.86 -0.19 1 68 ASP 4.64 -0.53 1 69 ALA 0.51 -0.05 1 71 TRP -0.21 -0.11 1 73 ASN -0.60 0.32 1 74 LEU 0.20 -0.13 1 75 VAL 1.06 0.04 1 76 TYR -1.64 0.14 1 77 VAL -3.16 0.76 1 78 VAL 0.94 -0.16 1 79 ASN -3.72 0.13 1 80 TYR -0.50 0.20 1 82 LYS -0.49 0.09 1 83 ASP 0.97 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30345_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.65 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _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 -1.04 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 1.33 _LACS_plot.Y_axis_chem_shift_offset 0.49 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 71 TRP -0.21 4.33 0 10 VAL -4.48 -2.57 1 11 THR -5.85 -2.77 1 12 GLU -0.30 -0.78 1 13 ASP -3.99 0.02 1 14 GLU 3.07 -0.35 1 15 ASN 0.70 -0.21 1 16 ASP -2.15 -0.54 1 23 SER -3.57 0.07 1 24 GLU -3.55 2.32 1 25 ASP 3.85 0.11 1 26 ASP -0.46 1.45 1 28 THR -1.08 -2.09 1 29 VAL -3.56 -0.94 1 30 LEU 1.21 1.23 1 31 LEU 4.46 1.01 1 32 SER 4.07 2.25 1 33 THR 6.48 1.81 1 34 VAL 6.00 2.91 1 35 THR 3.44 1.32 1 36 ALA 1.30 0.19 1 37 GLN -1.28 -1.32 1 41 ALA -0.17 -0.61 1 44 LEU -7.65 -2.08 1 45 ARG -5.30 -2.63 1 46 TYR -3.94 -3.62 1 47 ARG -1.48 -0.74 1 50 VAL 2.94 0.63 1 51 GLU -2.29 -0.59 1 52 GLN 3.20 -1.12 1 54 MET -0.56 -0.04 1 55 ARG -5.16 -1.50 1 57 VAL 0.32 -0.08 1 58 ARG 2.35 -2.98 1 59 LEU -3.26 -1.43 1 60 VAL -2.73 -0.29 1 61 GLU 2.70 -0.56 1 63 ILE 0.34 -1.82 1 64 LEU -0.48 -1.86 1 65 HIS -3.86 -0.92 1 68 ASP 4.64 0.87 1 69 ALA 0.51 -0.28 1 73 ASN -0.60 0.01 1 74 LEU 0.20 -3.04 1 75 VAL 1.06 -1.72 1 76 TYR -1.64 -1.43 1 77 VAL -3.16 0.64 1 78 VAL 0.94 -1.52 1 79 ASN -3.72 -1.84 1 82 LYS -0.49 -1.29 1 stop_ save_