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 bmr34249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.84 _LACS_plot.Line_1_terminator_val_y_1 -2.54 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.62 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 4.91 _LACS_plot.Line_2_terminator_val_y_2 3.07 _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 17 HIS -3.18 1.73 0 15 ALA 3.94 2.81 1 16 GLU 2.53 2.09 1 18 SER 2.84 3.58 1 19 TYR -3.61 -1.60 1 20 ALA -6.84 -2.15 1 21 GLU -6.29 -0.63 1 23 GLU 3.87 3.26 1 25 LEU -0.62 -1.34 1 26 VAL 0.58 2.63 1 27 LYS 0.56 1.08 1 28 VAL -4.80 -2.71 1 29 PHE -5.82 -1.83 1 30 ASP 1.24 0.12 1 31 ASN 0.65 0.11 1 34 ALA -3.65 -1.98 1 35 GLU -6.37 -2.08 1 36 PHE -0.80 -0.19 1 37 THR -2.64 -0.54 1 38 ILE -1.18 -0.20 1 39 PHE 1.09 -0.14 1 40 ALA -2.70 -0.57 1 41 VAL -2.90 -0.50 1 42 ASP -2.19 -0.35 1 43 THR 3.11 2.32 1 44 LYS -0.02 -1.22 1 46 VAL 0.66 -0.32 1 47 ALA 2.68 1.74 1 48 ARG 1.17 -0.59 1 49 THR 0.19 -0.23 1 50 ASP -2.08 -1.80 1 55 PHE 1.23 2.11 1 56 GLU -4.86 -1.63 1 57 VAL -1.92 -0.73 1 58 ALA -4.12 -1.79 1 59 ILE -2.39 -0.73 1 63 ASP 1.79 0.61 1 66 VAL 1.33 0.95 1 67 VAL -1.61 -0.82 1 68 ASP -0.80 -0.70 1 69 ALA -2.53 -1.40 1 70 LYS -0.59 -0.56 1 71 VAL -1.07 -0.71 1 72 THR -0.93 0.00 1 73 ASP -0.62 -0.76 1 74 ASN 2.43 1.05 1 75 ASN 3.46 1.60 1 76 ASP -1.44 -1.37 1 78 THR -5.47 -2.38 1 79 TYR -3.10 -1.65 1 81 VAL -1.26 -1.25 1 82 VAL -4.72 -2.08 1 83 TYR -4.29 -1.80 1 84 ASP -0.99 1.31 1 87 VAL -5.50 -2.75 1 88 GLU 0.66 0.88 1 90 ASN -0.88 1.34 1 91 TYR -1.23 -0.76 1 92 ASN -2.92 0.33 1 93 VAL -0.43 -0.34 1 94 ASN -4.01 -1.37 1 95 VAL -1.10 -1.18 1 96 THR -6.47 -2.98 1 97 LEU -3.50 -1.53 1 98 ARG 3.96 1.05 1 102 ILE 1.82 -0.78 1 104 ASN 4.92 3.63 1 107 ILE -5.10 -1.15 1 108 ASP -1.59 0.08 1 109 VAL -3.19 -1.04 1 110 LYS -0.85 -0.46 1 112 ILE -4.27 -1.87 1 113 GLU 0.39 0.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.84 _LACS_plot.Line_1_terminator_val_y_1 4.30 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.79 _LACS_plot.Line_2_terminator_val_x_2 4.91 _LACS_plot.Line_2_terminator_val_y_2 -1.84 _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 17 HIS -3.18 4.91 0 15 ALA 3.94 -1.13 1 16 GLU 2.53 -0.44 1 18 SER 2.84 0.74 1 19 TYR -3.61 2.01 1 20 ALA -6.84 4.69 1 21 GLU -6.29 5.66 1 23 GLU 3.87 -0.61 1 25 LEU -0.62 -0.72 1 26 VAL 0.58 2.05 1 27 LYS 0.56 0.52 1 28 VAL -4.80 2.09 1 29 PHE -5.82 3.99 1 30 ASP 1.24 -1.12 1 31 ASN 0.65 -0.54 1 34 ALA -3.65 1.67 1 35 GLU -6.37 4.29 1 36 PHE -0.80 0.61 1 37 THR -2.64 2.10 1 38 ILE -1.18 0.98 1 39 PHE 1.09 -1.23 1 40 ALA -2.70 2.13 1 41 VAL -2.90 2.40 1 42 ASP -2.19 1.84 1 43 THR 3.11 -0.79 1 44 LYS -0.02 -1.20 1 46 VAL 0.66 -0.98 1 47 ALA 2.68 -0.94 1 48 ARG 1.17 -1.76 1 49 THR 0.19 -0.42 1 50 ASP -2.08 0.28 1 55 PHE 1.23 0.88 1 56 GLU -4.86 3.23 1 57 VAL -1.92 1.19 1 58 ALA -4.12 2.33 1 59 ILE -2.39 1.66 1 63 ASP 1.79 -1.18 1 66 VAL 1.33 -0.38 1 67 VAL -1.61 0.79 1 68 ASP -0.80 0.10 1 69 ALA -2.53 1.13 1 70 LYS -0.59 0.03 1 71 VAL -1.07 0.36 1 72 THR -0.93 0.93 1 73 ASP -0.62 -0.14 1 74 ASN 2.43 -1.38 1 75 ASN 3.46 -1.86 1 76 ASP -1.44 0.07 1 78 THR -5.47 3.09 1 79 TYR -3.10 1.45 1 81 VAL -1.26 0.01 1 82 VAL -4.72 2.64 1 83 TYR -4.29 2.49 1 84 ASP -0.99 2.30 1 87 VAL -5.50 2.75 1 88 GLU 0.66 0.22 1 90 ASN -0.88 2.22 1 91 TYR -1.23 0.47 1 92 ASN -2.92 3.25 1 93 VAL -0.43 0.09 1 94 ASN -4.01 2.64 1 95 VAL -1.10 -0.08 1 96 THR -6.47 3.49 1 97 LEU -3.50 1.97 1 98 ARG 3.96 -2.91 1 102 ILE 1.82 -2.60 1 104 ASN 4.92 -1.29 1 107 ILE -5.10 3.95 1 108 ASP -1.59 1.67 1 109 VAL -3.19 2.15 1 110 LYS -0.85 0.39 1 112 ILE -4.27 2.40 1 113 GLU 0.39 0.34 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.84 _LACS_plot.Line_1_terminator_val_y_1 0.89 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.31 _LACS_plot.Line_2_terminator_val_x_2 4.91 _LACS_plot.Line_2_terminator_val_y_2 -0.45 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 ILE 1.82 1.00 0 15 ALA 3.94 -0.19 1 16 GLU 2.53 -0.38 1 17 HIS -3.18 0.08 1 18 SER 2.84 0.47 1 19 TYR -3.61 0.46 1 20 ALA -6.84 1.47 1 21 GLU -6.29 0.49 1 23 GLU 3.87 -0.17 1 25 LEU -0.62 0.12 1 26 VAL 0.58 0.00 1 27 LYS 0.56 0.19 1 28 VAL -4.80 0.22 1 29 PHE -5.82 1.19 1 30 ASP 1.24 0.15 1 31 ASN 0.65 -0.26 1 34 ALA -3.65 0.23 1 35 GLU -6.37 1.37 1 36 PHE -0.80 0.51 1 37 THR -2.64 0.87 1 38 ILE -1.18 -0.05 1 39 PHE 1.09 -0.38 1 40 ALA -2.70 0.29 1 41 VAL -2.90 0.24 1 42 ASP -2.19 0.55 1 43 THR 3.11 -0.27 1 44 LYS -0.02 0.17 1 46 VAL 0.66 -0.11 1 47 ALA 2.68 0.00 1 48 ARG 1.17 0.09 1 49 THR 0.19 0.01 1 50 ASP -2.08 -0.37 1 55 PHE 1.23 0.09 1 56 GLU -4.86 0.26 1 57 VAL -1.92 0.52 1 58 ALA -4.12 0.59 1 59 ILE -2.39 1.03 1 63 ASP 1.79 -0.35 1 66 VAL 1.33 0.22 1 67 VAL -1.61 0.09 1 68 ASP -0.80 0.21 1 69 ALA -2.53 0.30 1 70 LYS -0.59 0.28 1 71 VAL -1.07 0.75 1 72 THR -0.93 0.08 1 73 ASP -0.62 -0.36 1 74 ASN 2.43 -0.21 1 75 ASN 3.46 -0.68 1 76 ASP -1.44 -0.02 1 78 THR -5.47 1.24 1 79 TYR -3.10 0.50 1 81 VAL -1.26 0.76 1 82 VAL -4.72 1.23 1 83 TYR -4.29 0.50 1 84 ASP -0.99 -0.24 1 87 VAL -5.50 0.53 1 88 GLU 0.66 -0.19 1 90 ASN -0.88 0.29 1 91 TYR -1.23 0.16 1 92 ASN -2.92 0.60 1 93 VAL -0.43 0.09 1 94 ASN -4.01 0.52 1 95 VAL -1.10 0.98 1 96 THR -6.47 0.75 1 97 LEU -3.50 0.01 1 98 ARG 3.96 -0.49 1 104 ASN 4.92 -0.68 1 107 ILE -5.10 0.40 1 108 ASP -1.59 0.92 1 109 VAL -3.19 -0.01 1 110 LYS -0.85 0.39 1 112 ILE -4.27 0.63 1 113 GLU 0.39 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.84 _LACS_plot.Line_1_terminator_val_y_1 -2.03 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.38 _LACS_plot.Line_2_terminator_val_x_2 4.91 _LACS_plot.Line_2_terminator_val_y_2 0.05 _LACS_plot.Y_axis_chem_shift_offset 0.96 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 SER 2.84 -4.28 0 17 HIS -3.18 3.03 0 15 ALA 3.94 -0.81 1 16 GLU 2.53 0.86 1 19 TYR -3.61 -5.02 1 20 ALA -6.84 -2.14 1 21 GLU -6.29 -0.72 1 23 GLU 3.87 2.41 1 25 LEU -0.62 -1.13 1 26 VAL 0.58 -1.14 1 27 LYS 0.56 -3.74 1 28 VAL -4.80 -3.62 1 29 PHE -5.82 1.11 1 30 ASP 1.24 0.96 1 31 ASN 0.65 1.62 1 34 ALA -3.65 -1.90 1 35 GLU -6.37 0.30 1 36 PHE -0.80 -4.45 1 37 THR -2.64 -1.76 1 38 ILE -1.18 -3.09 1 39 PHE 1.09 -2.20 1 40 ALA -2.70 -0.13 1 41 VAL -2.90 -2.24 1 42 ASP -2.19 1.62 1 43 THR 3.11 0.94 1 44 LYS -0.02 0.33 1 46 VAL 0.66 -0.50 1 47 ALA 2.68 2.04 1 48 ARG 1.17 0.68 1 49 THR 0.19 -0.63 1 50 ASP -2.08 -1.99 1 55 PHE 1.23 0.17 1 56 GLU -4.86 -2.16 1 57 VAL -1.92 -2.40 1 58 ALA -4.12 -1.60 1 59 ILE -2.39 -2.49 1 63 ASP 1.79 -0.18 1 66 VAL 1.33 -0.20 1 67 VAL -1.61 -1.77 1 68 ASP -0.80 -1.39 1 69 ALA -2.53 -1.42 1 70 LYS -0.59 -0.75 1 71 VAL -1.07 -0.10 1 72 THR -0.93 -1.84 1 73 ASP -0.62 -0.20 1 74 ASN 2.43 -0.67 1 75 ASN 3.46 -2.13 1 76 ASP -1.44 -0.69 1 78 THR -5.47 0.52 1 79 TYR -3.10 -0.19 1 81 VAL -1.26 -1.03 1 82 VAL -4.72 -1.49 1 83 TYR -4.29 -5.06 1 84 ASP -0.99 -1.35 1 87 VAL -5.50 -1.09 1 88 GLU 0.66 -2.58 1 90 ASN -0.88 -0.73 1 91 TYR -1.23 -2.47 1 92 ASN -2.92 -1.90 1 93 VAL -0.43 -3.36 1 94 ASN -4.01 -0.27 1 95 VAL -1.10 -1.80 1 96 THR -6.47 -1.71 1 97 LEU -3.50 -1.52 1 98 ARG 3.96 -0.36 1 102 ILE 1.82 -2.35 1 104 ASN 4.92 -0.06 1 107 ILE -5.10 -3.41 1 108 ASP -1.59 -0.79 1 109 VAL -3.19 -2.82 1 110 LYS -0.85 -1.77 1 112 ILE -4.27 -1.98 1 113 GLU 0.39 0.51 1 stop_ save_