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 bmr34229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.71 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 4.35 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 THR 6.70 5.13 0 11 PHE -6.04 -0.70 1 12 SER -3.64 -1.53 1 13 TYR -3.06 1.12 1 14 ASP -5.38 -1.60 1 16 ALA -2.13 -1.08 1 18 GLU -4.20 -2.55 1 19 TYR -5.62 -1.48 1 20 TYR -0.82 -1.24 1 21 TRP -6.10 -2.43 1 22 LYS -6.37 -2.32 1 23 THR -0.89 -1.68 1 24 ASP 0.82 -1.00 1 25 GLN 0.11 0.26 1 26 PHE 1.71 -1.07 1 27 SER -0.80 -0.51 1 28 THR -1.40 -1.75 1 29 ASP -2.32 -1.08 1 31 ASN -1.19 -0.68 1 32 ASP -1.47 -0.79 1 33 TRP -0.03 -0.85 1 34 SER 1.25 1.86 1 35 ARG 3.53 0.26 1 36 TYR -5.94 -3.18 1 37 VAL -2.00 -1.07 1 38 ASN -5.10 -1.65 1 39 SER -4.98 -1.20 1 40 TRP -0.82 -0.46 1 41 ASN 3.05 1.91 1 42 LEU -0.25 -0.50 1 43 ASP 1.47 1.77 1 44 LEU -4.35 -0.22 1 45 LEU -1.54 -0.37 1 46 GLU -7.12 -3.19 1 47 ILE -1.13 -0.45 1 48 ASN 3.55 1.08 1 50 THR 0.01 0.18 1 51 ASP 1.05 1.55 1 52 TYR -0.88 -0.66 1 54 ASN 3.68 1.35 1 55 VAL -5.59 -2.42 1 56 TRP -1.51 0.62 1 57 VAL -4.11 -2.01 1 58 ALA 0.85 -0.49 1 59 GLN 5.36 3.75 1 60 HIS 4.40 2.87 1 61 GLN 0.29 0.51 1 62 ILE -0.43 0.01 1 64 ALA 0.19 -0.65 1 65 ALA -0.07 -0.68 1 66 SER 4.16 3.15 1 67 ASP -0.64 -1.48 1 69 TYR -3.03 -0.03 1 70 TRP 0.95 2.10 1 71 TYR 1.18 0.54 1 72 ILE -2.44 0.20 1 73 HIS -5.68 -3.43 1 74 TYR -7.60 -1.96 1 75 LYS -3.53 0.23 1 76 SER -4.02 -1.88 1 78 VAL -6.48 -3.63 1 79 SER 3.58 2.51 1 80 TRP 1.25 -1.54 1 82 HIS -3.05 0.20 1 83 VAL -5.94 -3.18 1 84 GLU -5.97 -2.07 1 85 ILE -1.46 -0.12 1 86 LYS -0.62 -0.11 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 4.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -2.35 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 THR 6.70 -1.57 0 11 PHE -6.04 5.34 1 12 SER -3.64 2.11 1 13 TYR -3.06 4.18 1 14 ASP -5.38 3.78 1 16 ALA -2.13 1.05 1 18 GLU -4.20 1.65 1 19 TYR -5.62 4.14 1 20 TYR -0.82 -0.42 1 21 TRP -6.10 3.67 1 22 LYS -6.37 4.05 1 23 THR -0.89 -0.79 1 24 ASP 0.82 -1.82 1 25 GLN 0.11 0.15 1 26 PHE 1.71 -2.78 1 27 SER -0.80 0.29 1 28 THR -1.40 -0.35 1 29 ASP -2.32 1.24 1 31 ASN -1.19 0.51 1 32 ASP -1.47 0.68 1 33 TRP -0.03 -0.82 1 34 SER 1.25 0.61 1 35 ARG 3.53 -3.27 1 36 TYR -5.94 2.76 1 37 VAL -2.00 0.93 1 38 ASN -5.10 3.45 1 39 SER -4.98 3.78 1 40 TRP -0.82 0.36 1 41 ASN 3.05 -1.14 1 42 LEU -0.25 -0.25 1 43 ASP 1.47 0.30 1 44 LEU -4.35 4.13 1 45 LEU -1.54 1.17 1 46 GLU -7.12 3.93 1 47 ILE -1.13 0.68 1 48 ASN 3.55 -2.47 1 50 THR 0.01 0.17 1 51 ASP 1.05 0.50 1 52 TYR -0.88 0.22 1 54 ASN 3.68 -2.33 1 55 VAL -5.59 3.17 1 56 TRP -1.51 2.13 1 57 VAL -4.11 2.10 1 58 ALA 0.85 -1.34 1 59 GLN 5.36 -1.61 1 60 HIS 4.40 -1.53 1 61 GLN 0.29 0.22 1 62 ILE -0.43 0.44 1 64 ALA 0.19 -0.84 1 65 ALA -0.07 -0.61 1 66 SER 4.16 -1.01 1 67 ASP -0.64 -0.84 1 69 TYR -3.03 3.00 1 70 TRP 0.95 1.15 1 71 TYR 1.18 -0.64 1 72 ILE -2.44 2.64 1 73 HIS -5.68 2.25 1 74 TYR -7.60 5.64 1 75 LYS -3.53 3.76 1 76 SER -4.02 2.14 1 78 VAL -6.48 2.85 1 79 SER 3.58 -1.07 1 80 TRP 1.25 -2.79 1 82 HIS -3.05 3.25 1 83 VAL -5.94 2.76 1 84 GLU -5.97 3.90 1 85 ILE -1.46 1.34 1 86 LYS -0.62 0.51 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 0.79 _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 0.22 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 ALA 0.19 -2.42 0 11 PHE -6.04 0.22 1 12 SER -3.64 0.01 1 13 TYR -3.06 -0.63 1 14 ASP -5.38 1.02 1 16 ALA -2.13 -0.07 1 18 GLU -4.20 0.98 1 19 TYR -5.62 -0.19 1 20 TYR -0.82 0.34 1 21 TRP -6.10 1.60 1 22 LYS -6.37 1.60 1 23 THR -0.89 0.66 1 24 ASP 0.82 0.54 1 25 GLN 0.11 0.04 1 26 PHE 1.71 -1.00 1 27 SER -0.80 -0.30 1 28 THR -1.40 0.03 1 29 ASP -2.32 -0.18 1 31 ASN -1.19 -0.06 1 32 ASP -1.47 0.08 1 33 TRP -0.03 -0.06 1 34 SER 1.25 0.28 1 35 ARG 3.53 -0.14 1 36 TYR -5.94 -0.24 1 37 VAL -2.00 0.48 1 38 ASN -5.10 1.04 1 39 SER -4.98 0.35 1 40 TRP -0.82 0.22 1 41 ASN 3.05 -0.40 1 42 LEU -0.25 0.03 1 43 ASP 1.47 -0.08 1 44 LEU -4.35 0.29 1 45 LEU -1.54 0.72 1 46 GLU -7.12 1.19 1 47 ILE -1.13 1.21 1 48 ASN 3.55 -0.09 1 50 THR 0.01 0.03 1 51 ASP 1.05 -0.31 1 52 TYR -0.88 0.16 1 53 THR 6.70 -0.84 1 54 ASN 3.68 0.22 1 55 VAL -5.59 0.89 1 56 TRP -1.51 0.45 1 57 VAL -4.11 0.43 1 58 ALA 0.85 -0.80 1 59 GLN 5.36 -1.21 1 60 HIS 4.40 -0.35 1 61 GLN 0.29 -0.06 1 62 ILE -0.43 0.17 1 65 ALA -0.07 0.02 1 66 SER 4.16 -0.47 1 67 ASP -0.64 -0.13 1 69 TYR -3.03 -0.23 1 70 TRP 0.95 -0.12 1 71 TYR 1.18 -0.09 1 72 ILE -2.44 0.97 1 73 HIS -5.68 0.68 1 74 TYR -7.60 0.23 1 75 LYS -3.53 0.66 1 76 SER -4.02 0.00 1 78 VAL -6.48 0.39 1 79 SER 3.58 -0.38 1 80 TRP 1.25 0.30 1 82 HIS -3.05 0.96 1 83 VAL -5.94 0.61 1 84 GLU -5.97 0.51 1 85 ILE -1.46 0.08 1 86 LYS -0.62 -0.38 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34229_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 -2.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 1.59 _LACS_plot.Y_axis_chem_shift_offset 0.73 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 THR 6.70 0.05 0 83 VAL -5.94 -5.74 0 78 VAL -6.48 0.80 0 86 LYS -0.62 3.39 0 11 PHE -6.04 -2.10 1 12 SER -3.64 -4.15 1 13 TYR -3.06 -4.20 1 14 ASP -5.38 -1.90 1 16 ALA -2.13 -0.10 1 18 GLU -4.20 -2.79 1 19 TYR -5.62 -3.45 1 20 TYR -0.82 -0.89 1 21 TRP -6.10 -1.34 1 22 LYS -6.37 -3.00 1 23 THR -0.89 -3.27 1 24 ASP 0.82 2.35 1 25 GLN 0.11 -0.25 1 26 PHE 1.71 -0.51 1 27 SER -0.80 0.91 1 28 THR -1.40 -0.35 1 29 ASP -2.32 -0.22 1 31 ASN -1.19 -0.89 1 32 ASP -1.47 -0.16 1 33 TRP -0.03 -1.01 1 34 SER 1.25 0.05 1 36 TYR -5.94 -2.80 1 37 VAL -2.00 -2.77 1 38 ASN -5.10 -2.12 1 39 SER -4.98 -1.48 1 40 TRP -0.82 -1.36 1 41 ASN 3.05 -1.72 1 42 LEU -0.25 0.17 1 43 ASP 1.47 0.03 1 44 LEU -4.35 -3.68 1 45 LEU -1.54 -2.85 1 46 GLU -7.12 -0.15 1 47 ILE -1.13 -0.44 1 48 ASN 3.55 0.46 1 50 THR 0.01 -2.81 1 51 ASP 1.05 -1.15 1 52 TYR -0.88 -0.45 1 54 ASN 3.68 -0.37 1 55 VAL -5.59 -3.04 1 56 TRP -1.51 0.84 1 57 VAL -4.11 -3.79 1 58 ALA 0.85 0.06 1 59 GLN 5.36 2.10 1 60 HIS 4.40 1.56 1 61 GLN 0.29 -0.81 1 62 ILE -0.43 -1.03 1 64 ALA 0.19 0.10 1 65 ALA -0.07 1.80 1 66 SER 4.16 -0.43 1 67 ASP -0.64 0.59 1 69 TYR -3.03 -1.54 1 70 TRP 0.95 -1.91 1 71 TYR 1.18 -0.15 1 72 ILE -2.44 -3.07 1 73 HIS -5.68 -2.80 1 74 TYR -7.60 -1.57 1 75 LYS -3.53 -2.02 1 76 SER -4.02 0.84 1 79 SER 3.58 -1.01 1 80 TRP 1.25 0.13 1 82 HIS -3.05 -0.97 1 84 GLU -5.97 -3.77 1 85 ILE -1.46 -1.67 1 stop_ save_