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 bmr6800_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 5.03 _LACS_plot.Line_2_terminator_val_y_2 3.42 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 HIS -3.52 2.00 0 10 THR -0.15 -0.25 1 11 TYR -2.88 -2.06 1 12 THR -0.68 -0.35 1 13 VAL 1.57 0.80 1 15 ASP 0.09 0.96 1 16 LYS 3.10 2.54 1 17 THR 0.77 1.38 1 18 LYS -0.33 -0.72 1 19 PHE -1.36 0.92 1 20 THR -4.20 -1.79 1 21 TRP -0.21 -0.05 1 22 LYS 1.67 1.89 1 23 ARG -1.87 0.23 1 24 ALA 2.68 0.46 1 26 THR -3.21 -1.03 1 27 ASP -0.49 0.57 1 28 SER -1.82 0.24 1 30 HIS 1.52 -0.72 1 31 ASP 4.06 1.74 1 32 THR -4.89 -2.62 1 33 VAL -1.68 -1.26 1 34 VAL -6.51 -4.17 1 35 MET -2.84 -1.00 1 36 GLU -6.24 -1.80 1 37 VAL -4.42 -2.91 1 39 PHE -5.32 -0.86 1 42 THR 3.13 2.50 1 43 ARG -2.44 -0.56 1 46 ARG -1.24 -0.51 1 47 ILE 0.92 2.14 1 49 VAL -4.14 -3.32 1 50 ARG -3.27 -1.26 1 51 ALA -6.28 -0.61 1 52 VAL -5.22 -3.29 1 53 ALA -1.92 -1.09 1 54 HIS 2.84 2.90 1 56 VAL 0.25 -0.03 1 58 GLU 2.15 1.57 1 59 VAL -1.28 -0.26 1 60 ASN -0.32 -0.58 1 61 VAL -1.09 -1.89 1 62 ALA 0.63 0.79 1 63 MET -1.00 -1.20 1 64 LEU 2.21 0.95 1 65 ILE 1.26 0.12 1 66 THR -3.87 -2.97 1 68 ASN 0.85 1.55 1 70 THR -4.02 -1.17 1 71 MET 0.91 -2.09 1 72 GLU -4.53 -2.57 1 73 ASN 5.04 3.84 1 74 ASN -0.69 -0.55 1 78 PHE 0.09 0.47 1 79 ILE -4.33 -0.90 1 80 GLU -5.76 -2.94 1 81 MET -6.20 -1.23 1 82 GLN -3.93 -1.13 1 83 LEU -4.17 -1.62 1 87 ASP 0.28 0.74 1 88 ASN -6.17 -0.40 1 89 ILE -0.47 0.73 1 90 ILE -1.64 0.42 1 91 TYR -3.85 -1.17 1 92 VAL 0.91 -0.77 1 94 ASP 1.00 1.16 1 95 LEU 0.96 0.51 1 96 ASN -5.90 -1.41 1 98 GLN 1.30 1.10 1 99 TRP -3.79 -0.24 1 100 PHE -0.43 -1.08 1 101 GLN -3.26 -2.43 1 102 LYS 2.25 2.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6800_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 4.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.75 _LACS_plot.Line_2_terminator_val_x_2 5.03 _LACS_plot.Line_2_terminator_val_y_2 -1.61 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 HIS -3.52 5.52 0 10 THR -0.15 -0.10 1 11 TYR -2.88 0.82 1 12 THR -0.68 0.33 1 13 VAL 1.57 -0.77 1 15 ASP 0.09 0.87 1 16 LYS 3.10 -0.56 1 17 THR 0.77 0.61 1 18 LYS -0.33 -0.39 1 19 PHE -1.36 2.28 1 20 THR -4.20 2.41 1 21 TRP -0.21 0.16 1 22 LYS 1.67 0.22 1 23 ARG -1.87 2.10 1 24 ALA 2.68 -2.22 1 26 THR -3.21 2.18 1 27 ASP -0.49 1.06 1 28 SER -1.82 2.06 1 30 HIS 1.52 -2.24 1 31 ASP 4.06 -2.32 1 32 THR -4.89 2.27 1 33 VAL -1.68 0.42 1 34 VAL -6.51 2.34 1 35 MET -2.84 1.84 1 36 GLU -6.24 4.44 1 37 VAL -4.42 1.51 1 39 PHE -5.32 4.46 1 42 THR 3.13 -0.63 1 43 ARG -2.44 1.88 1 46 ARG -1.24 0.73 1 47 ILE 0.92 1.22 1 49 VAL -4.14 0.82 1 50 ARG -3.27 2.01 1 51 ALA -6.28 5.67 1 52 VAL -5.22 1.93 1 53 ALA -1.92 0.83 1 54 HIS 2.84 0.06 1 56 VAL 0.25 -0.28 1 58 GLU 2.15 -0.58 1 59 VAL -1.28 1.02 1 60 ASN -0.32 -0.26 1 61 VAL -1.09 -0.80 1 62 ALA 0.63 0.16 1 63 MET -1.00 -0.20 1 64 LEU 2.21 -1.26 1 65 ILE 1.26 -1.14 1 66 THR -3.87 0.90 1 68 ASN 0.85 0.70 1 70 THR -4.02 2.85 1 71 MET 0.91 -3.00 1 72 GLU -4.53 1.96 1 73 ASN 5.04 -1.20 1 74 ASN -0.69 0.14 1 78 PHE 0.09 0.38 1 79 ILE -4.33 3.43 1 80 GLU -5.76 2.82 1 81 MET -6.20 4.97 1 82 GLN -3.93 2.80 1 83 LEU -4.17 2.55 1 87 ASP 0.28 0.46 1 88 ASN -6.17 5.77 1 89 ILE -0.47 1.20 1 90 ILE -1.64 2.06 1 91 TYR -3.85 2.68 1 92 VAL 0.91 -1.68 1 94 ASP 1.00 0.16 1 95 LEU 0.96 -0.45 1 96 ASN -5.90 4.49 1 98 GLN 1.30 -0.20 1 99 TRP -3.79 3.55 1 100 PHE -0.43 -0.65 1 101 GLN -3.26 0.83 1 102 LYS 2.25 -0.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6800_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 0.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 5.03 _LACS_plot.Line_2_terminator_val_y_2 -0.37 _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 97 HIS -3.52 -0.23 0 28 SER -1.82 -0.48 0 51 ALA -6.28 1.31 0 73 ASN 5.04 -0.43 0 96 ASN -5.90 1.40 0 43 ARG -2.44 -0.48 0 10 THR -0.15 -0.07 1 11 TYR -2.88 0.24 1 12 THR -0.68 0.02 1 13 VAL 1.57 0.16 1 15 ASP 0.09 -0.24 1 16 LYS 3.10 -0.11 1 17 THR 0.77 0.30 1 18 LYS -0.33 0.17 1 19 PHE -1.36 0.95 1 20 THR -4.20 0.02 1 21 TRP -0.21 0.26 1 22 LYS 1.67 0.16 1 23 ARG -1.87 0.15 1 26 THR -3.21 0.26 1 27 ASP -0.49 0.06 1 30 HIS 1.52 0.28 1 31 ASP 4.06 -0.19 1 32 THR -4.89 0.51 1 33 VAL -1.68 0.26 1 34 VAL -6.51 1.06 1 35 MET -2.84 -0.16 1 36 GLU -6.24 1.27 1 37 VAL -4.42 1.21 1 39 PHE -5.32 0.63 1 42 THR 3.13 -0.31 1 46 ARG -1.24 0.13 1 49 VAL -4.14 1.10 1 50 ARG -3.27 0.26 1 52 VAL -5.22 1.03 1 53 ALA -1.92 0.56 1 54 HIS 2.84 -0.62 1 56 VAL 0.25 0.18 1 58 GLU 2.15 -0.19 1 59 VAL -1.28 0.07 1 60 ASN -0.32 0.69 1 61 VAL -1.09 0.35 1 62 ALA 0.63 -0.19 1 63 MET -1.00 0.21 1 64 LEU 2.21 -0.18 1 65 ILE 1.26 -0.18 1 66 THR -3.87 0.05 1 68 ASN 0.85 -0.52 1 70 THR -4.02 0.61 1 71 MET 0.91 0.58 1 72 GLU -4.53 0.34 1 74 ASN -0.69 0.09 1 78 PHE 0.09 0.47 1 79 ILE -4.33 0.13 1 80 GLU -5.76 0.94 1 81 MET -6.20 0.87 1 82 GLN -3.93 0.60 1 87 ASP 0.28 0.05 1 88 ASN -6.17 1.05 1 89 ILE -0.47 0.27 1 90 ILE -1.64 -0.05 1 91 TYR -3.85 0.94 1 92 VAL 0.91 -0.20 1 94 ASP 1.00 0.05 1 95 LEU 0.96 -0.15 1 98 GLN 1.30 0.28 1 99 TRP -3.79 0.10 1 100 PHE -0.43 0.15 1 101 GLN -3.26 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6800_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 -1.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.85 _LACS_plot.Line_2_terminator_val_x_2 5.03 _LACS_plot.Line_2_terminator_val_y_2 0.57 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 ILE -4.33 -4.11 0 73 ASN 5.04 0.89 0 35 MET -2.84 -4.14 0 81 MET -6.20 -4.31 0 10 THR -0.15 -0.42 1 11 TYR -2.88 0.52 1 12 THR -0.68 -0.67 1 13 VAL 1.57 0.34 1 15 ASP 0.09 1.14 1 16 LYS 3.10 0.96 1 17 THR 0.77 2.15 1 18 LYS -0.33 -1.38 1 19 PHE -1.36 -0.33 1 20 THR -4.20 -0.07 1 21 TRP -0.21 0.74 1 22 LYS 1.67 0.53 1 23 ARG -1.87 -1.80 1 26 THR -3.21 -2.85 1 27 ASP -0.49 1.38 1 28 SER -1.82 0.83 1 30 HIS 1.52 -0.48 1 31 ASP 4.06 -0.90 1 32 THR -4.89 -2.53 1 33 VAL -1.68 -1.11 1 34 VAL -6.51 -1.77 1 36 GLU -6.24 -0.01 1 37 VAL -4.42 -0.59 1 39 PHE -5.32 -0.65 1 42 THR 3.13 -1.24 1 46 ARG -1.24 -1.48 1 49 VAL -4.14 -2.71 1 50 ARG -3.27 -3.79 1 51 ALA -6.28 -2.60 1 52 VAL -5.22 -1.68 1 53 ALA -1.92 0.90 1 54 HIS 2.84 1.97 1 58 GLU 2.15 -0.23 1 59 VAL -1.28 -1.26 1 60 ASN -0.32 1.51 1 61 VAL -1.09 -0.26 1 62 ALA 0.63 -0.52 1 63 MET -1.00 -0.46 1 64 LEU 2.21 -1.09 1 65 ILE 1.26 1.16 1 70 THR -4.02 -0.42 1 71 MET 0.91 -0.68 1 72 GLU -4.53 0.20 1 74 ASN -0.69 -0.48 1 78 PHE 0.09 -0.96 1 80 GLU -5.76 -1.04 1 82 GLN -3.93 -1.72 1 87 ASP 0.28 -1.25 1 88 ASN -6.17 -0.50 1 89 ILE -0.47 -1.53 1 90 ILE -1.64 -2.16 1 91 TYR -3.85 -0.23 1 92 VAL 0.91 -1.11 1 94 ASP 1.00 1.35 1 95 LEU 0.96 -1.74 1 96 ASN -5.90 0.13 1 97 HIS -3.52 -0.07 1 98 GLN 1.30 -0.44 1 99 TRP -3.79 -2.97 1 100 PHE -0.43 -2.75 1 101 GLN -3.26 -1.96 1 stop_ save_