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 bmr18692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -2.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _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 8.17 _LACS_plot.Line_2_terminator_val_y_2 6.18 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 PHE 2.00 -1.45 0 10 LYS 0.47 1.49 1 11 ALA 0.58 0.79 1 13 ILE 1.23 -0.60 1 14 PHE 8.17 6.18 1 15 GLU 5.72 3.98 1 16 ARG 2.38 0.88 1 17 LEU 3.63 4.00 1 18 GLU 4.06 3.33 1 19 GLU 2.47 2.84 1 20 LEU 3.05 2.76 1 21 ILE 4.45 4.07 1 22 GLU 3.11 3.26 1 23 LYS 0.19 1.75 1 24 GLU -1.12 -0.36 1 25 MET -4.90 -0.38 1 26 GLN -0.41 -0.79 1 28 ASN 2.20 2.27 1 29 GLU -1.68 0.28 1 30 VAL -2.16 -1.64 1 31 ALA -6.70 -1.03 1 32 ILE -4.12 -1.50 1 33 PHE -3.05 -1.07 1 34 MET -5.43 -1.88 1 35 PHE -3.45 -1.60 1 36 GLU -0.36 0.58 1 39 ASP 4.17 0.22 1 41 SER 1.94 1.36 1 42 ASN 1.17 0.39 1 43 ILE 1.67 1.41 1 45 LYS 3.33 3.51 1 46 SER 6.58 4.90 1 47 ALA 3.97 3.20 1 48 GLU 2.63 2.50 1 49 PHE -1.99 0.11 1 50 ILE 3.91 1.78 1 51 GLN 4.11 3.16 1 52 SER 4.28 3.10 1 53 LYS -1.09 -1.54 1 55 HIS -2.47 -0.15 1 56 GLU -4.65 -1.44 1 57 LEU -1.60 -1.32 1 58 LEU 1.46 1.43 1 59 ASN -3.70 -0.71 1 60 SER -1.23 -1.38 1 61 LEU -2.17 0.01 1 62 ARG 1.36 1.29 1 63 PHE 3.37 3.68 1 64 ASN 1.82 0.37 1 65 GLN 4.18 3.43 1 66 ALA -2.35 0.25 1 67 ASP -3.52 0.53 1 68 TRP -5.37 -1.25 1 69 THR -5.90 -2.95 1 70 ILE -4.35 -1.46 1 71 VAL -0.13 -0.55 1 72 VAL -6.47 -1.95 1 73 ARG -5.16 -2.21 1 74 LYS -0.22 -0.22 1 75 LYS 3.10 -0.27 1 76 ALA -1.36 -0.71 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 4.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _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 8.17 _LACS_plot.Line_2_terminator_val_y_2 -1.99 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 PHE 2.00 -3.45 0 10 LYS 0.47 1.02 1 11 ALA 0.58 0.21 1 13 ILE 1.23 -1.83 1 14 PHE 8.17 -1.99 1 15 GLU 5.72 -1.74 1 16 ARG 2.38 -1.50 1 17 LEU 3.63 0.37 1 18 GLU 4.06 -0.73 1 19 GLU 2.47 0.37 1 20 LEU 3.05 -0.29 1 21 ILE 4.45 -0.38 1 22 GLU 3.11 0.15 1 23 LYS 0.19 1.56 1 24 GLU -1.12 0.76 1 25 MET -4.90 4.52 1 26 GLN -0.41 -0.38 1 28 ASN 2.20 0.07 1 29 GLU -1.68 1.96 1 30 VAL -2.16 0.52 1 31 ALA -6.70 5.67 1 32 ILE -4.12 2.62 1 33 PHE -3.05 1.98 1 34 MET -5.43 3.55 1 35 PHE -3.45 1.85 1 36 GLU -0.36 0.94 1 39 ASP 4.17 -3.95 1 41 SER 1.94 -0.58 1 42 ASN 1.17 -0.78 1 43 ILE 1.67 -0.26 1 45 LYS 3.33 0.18 1 46 SER 6.58 -1.68 1 47 ALA 3.97 -0.77 1 48 GLU 2.63 -0.13 1 49 PHE -1.99 2.10 1 50 ILE 3.91 -2.13 1 51 GLN 4.11 -0.95 1 52 SER 4.28 -1.18 1 53 LYS -1.09 -0.45 1 55 HIS -2.47 2.32 1 56 GLU -4.65 3.21 1 57 LEU -1.60 0.28 1 58 LEU 1.46 -0.03 1 59 ASN -3.70 2.99 1 60 SER -1.23 -0.15 1 61 LEU -2.17 2.18 1 62 ARG 1.36 -0.07 1 63 PHE 3.37 0.31 1 64 ASN 1.82 -1.45 1 65 GLN 4.18 -0.75 1 66 ALA -2.35 2.60 1 67 ASP -3.52 4.05 1 68 TRP -5.37 4.12 1 69 THR -5.90 2.95 1 70 ILE -4.35 2.89 1 71 VAL -0.13 -0.42 1 72 VAL -6.47 4.52 1 73 ARG -5.16 2.95 1 74 LYS -0.22 0.00 1 75 LYS 3.10 -3.37 1 76 ALA -1.36 0.65 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 0.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 8.17 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _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 30 VAL -2.16 1.17 0 14 PHE 8.17 -1.27 0 68 TRP -5.37 -0.18 0 10 LYS 0.47 -0.50 1 11 ALA 0.58 0.08 1 13 ILE 1.23 -0.02 1 15 GLU 5.72 -0.09 1 16 ARG 2.38 -0.24 1 17 LEU 3.63 -0.72 1 18 GLU 4.06 -0.46 1 19 GLU 2.47 -0.30 1 20 LEU 3.05 -0.58 1 21 ILE 4.45 -0.47 1 22 GLU 3.11 -0.46 1 23 LYS 0.19 0.07 1 24 GLU -1.12 0.38 1 25 MET -4.90 0.35 1 26 GLN -0.41 -0.31 1 28 ASN 2.20 -0.27 1 29 GLU -1.68 -0.06 1 31 ALA -6.70 0.60 1 32 ILE -4.12 0.93 1 33 PHE -3.05 0.79 1 34 MET -5.43 1.04 1 35 PHE -3.45 0.02 1 36 GLU -0.36 0.54 1 39 ASP 4.17 0.27 1 40 PHE 2.00 0.00 1 41 SER 1.94 0.02 1 42 ASN 1.17 0.17 1 43 ILE 1.67 -0.27 1 45 LYS 3.33 -0.19 1 46 SER 6.58 -0.39 1 47 ALA 3.97 -0.19 1 48 GLU 2.63 -0.29 1 49 PHE -1.99 -0.50 1 50 ILE 3.91 -0.64 1 51 GLN 4.11 -0.08 1 52 SER 4.28 -0.33 1 53 LYS -1.09 -0.15 1 55 HIS -2.47 0.22 1 56 GLU -4.65 0.32 1 57 LEU -1.60 0.45 1 58 LEU 1.46 0.06 1 59 ASN -3.70 0.18 1 60 SER -1.23 -0.43 1 61 LEU -2.17 -0.12 1 62 ARG 1.36 -0.03 1 63 PHE 3.37 -0.01 1 64 ASN 1.82 -0.36 1 65 GLN 4.18 -0.06 1 66 ALA -2.35 0.33 1 67 ASP -3.52 -0.03 1 69 THR -5.90 1.26 1 70 ILE -4.35 1.21 1 71 VAL -0.13 0.89 1 72 VAL -6.47 1.03 1 73 ARG -5.16 1.12 1 74 LYS -0.22 0.00 1 75 LYS 3.10 0.17 1 76 ALA -1.36 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -0.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.67 _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 8.17 _LACS_plot.Line_2_terminator_val_y_2 4.57 _LACS_plot.Y_axis_chem_shift_offset -1.87 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 GLN 4.11 6.63 0 10 LYS 0.47 2.21 1 11 ALA 0.58 1.08 1 13 ILE 1.23 0.83 1 14 PHE 8.17 3.50 1 15 GLU 5.72 4.83 1 16 ARG 2.38 3.12 1 17 LEU 3.63 1.54 1 18 GLU 4.06 3.04 1 19 GLU 2.47 3.77 1 20 LEU 3.05 4.07 1 21 ILE 4.45 5.30 1 22 GLU 3.11 3.82 1 23 LYS 0.19 4.04 1 24 GLU -1.12 0.81 1 25 MET -4.90 0.99 1 26 GLN -0.41 1.32 1 28 ASN 2.20 4.22 1 29 GLU -1.68 -0.72 1 30 VAL -2.16 0.90 1 31 ALA -6.70 -1.62 1 32 ILE -4.12 -0.10 1 33 PHE -3.05 0.89 1 34 MET -5.43 0.82 1 35 PHE -3.45 -0.61 1 36 GLU -0.36 2.66 1 39 ASP 4.17 1.25 1 41 SER 1.94 -0.05 1 45 LYS 3.33 4.87 1 46 SER 6.58 2.83 1 47 ALA 3.97 3.73 1 48 GLU 2.63 4.22 1 49 PHE -1.99 3.78 1 50 ILE 3.91 3.30 1 53 LYS -1.09 1.31 1 55 HIS -2.47 1.14 1 56 GLU -4.65 0.17 1 57 LEU -1.60 0.25 1 58 LEU 1.46 1.87 1 59 ASN -3.70 0.36 1 62 ARG 1.36 0.26 1 64 ASN 1.82 1.44 1 65 GLN 4.18 2.41 1 66 ALA -2.35 1.09 1 67 ASP -3.52 -0.66 1 69 THR -5.90 1.30 1 70 ILE -4.35 -0.65 1 71 VAL -0.13 1.32 1 72 VAL -6.47 -0.86 1 73 ARG -5.16 1.68 1 74 LYS -0.22 1.74 1 stop_ save_