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 bmr15814_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.21 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.54 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 2.57 _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 11 HIS -3.10 2.21 0 10 GLU 2.65 2.66 1 12 SER 3.54 3.91 1 13 TYR -3.56 -1.18 1 14 ALA -7.00 -1.90 1 15 GLU -6.19 -0.16 1 17 GLU 3.71 3.54 1 19 LEU -0.66 -0.86 1 20 VAL 0.58 2.94 1 21 LYS 0.20 1.22 1 22 VAL -4.71 -2.22 1 23 PHE -5.64 -1.43 1 24 ASP 1.34 0.61 1 25 ASN -1.11 -1.39 1 26 ALA -3.30 0.17 1 28 ALA -3.87 -1.55 1 29 GLU -6.44 -1.73 1 30 PHE -0.82 0.21 1 31 THR -2.57 -0.08 1 32 ILE -0.93 0.57 1 33 PHE 0.90 0.20 1 34 ALA -3.17 -0.60 1 35 VAL -2.99 -0.18 1 36 ASP -2.16 0.10 1 37 THR 2.98 2.66 1 38 LYS -0.08 -0.82 1 40 VAL 0.58 0.09 1 41 ALA 2.54 2.10 1 42 ARG 0.94 -0.34 1 43 THR -0.15 -0.12 1 44 ASP -2.07 -1.23 1 47 ASP -0.87 0.10 1 49 PHE 0.84 2.27 1 50 GLU -4.72 -1.28 1 51 VAL -1.95 -0.42 1 52 ALA -3.60 -1.16 1 53 ILE -2.33 -0.33 1 54 ASN -4.25 -0.50 1 57 ASP 2.08 1.34 1 59 LEU -0.18 1.29 1 60 VAL 0.98 1.20 1 61 VAL -1.64 -0.46 1 62 ASP -0.81 -0.13 1 63 ALA -2.73 -0.96 1 64 LYS -0.31 0.08 1 65 VAL -1.34 -0.54 1 66 THR -0.94 0.43 1 67 ASP -0.84 -0.51 1 68 ASN 2.30 1.41 1 69 ASN 2.92 1.67 1 70 ASP -1.51 -1.02 1 72 THR -5.50 -1.95 1 73 TYR -3.17 -1.33 1 75 VAL -1.37 -0.89 1 76 VAL -4.74 -1.72 1 77 TYR -4.36 -1.34 1 78 ASP -3.02 -0.54 1 79 ALA -0.67 0.83 1 81 VAL -5.84 -2.53 1 82 GLU 0.68 1.25 1 84 ASN -0.85 1.59 1 85 TYR -1.46 -0.43 1 86 ASN -3.04 0.58 1 87 VAL -0.51 0.18 1 88 ASN -4.77 -1.76 1 89 VAL -1.08 -0.72 1 90 THR -6.27 -2.49 1 91 LEU -3.58 -1.14 1 92 ARG 3.82 1.36 1 94 ASN -2.39 -0.81 1 96 ILE 1.70 -0.48 1 98 ASN 2.68 1.63 1 99 MET -1.57 -0.44 1 101 ILE -5.11 -0.70 1 102 ASP -1.62 0.41 1 103 VAL -3.39 -0.75 1 104 LYS -0.99 -0.11 1 106 ILE -4.24 -1.37 1 107 GLU 0.11 0.95 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15814_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 4.79 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.46 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 -1.24 _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 11 HIS -3.10 5.31 0 10 GLU 2.65 0.01 1 12 SER 3.54 0.37 1 13 TYR -3.56 2.38 1 14 ALA -7.00 5.10 1 15 GLU -6.19 6.03 1 17 GLU 3.71 -0.17 1 19 LEU -0.66 -0.20 1 20 VAL 0.58 2.36 1 21 LYS 0.20 1.02 1 22 VAL -4.71 2.49 1 23 PHE -5.64 4.21 1 24 ASP 1.34 -0.73 1 25 ASN -1.11 -0.28 1 26 ALA -3.30 3.47 1 28 ALA -3.87 2.32 1 29 GLU -6.44 4.71 1 30 PHE -0.82 1.03 1 31 THR -2.57 2.49 1 32 ILE -0.93 1.50 1 33 PHE 0.90 -0.70 1 34 ALA -3.17 2.57 1 35 VAL -2.99 2.81 1 36 ASP -2.16 2.26 1 37 THR 2.98 -0.32 1 38 LYS -0.08 -0.74 1 40 VAL 0.58 -0.49 1 41 ALA 2.54 -0.44 1 42 ARG 0.94 -1.28 1 43 THR -0.15 0.03 1 44 ASP -2.07 0.84 1 47 ASP -0.87 0.97 1 49 PHE 0.84 1.43 1 50 GLU -4.72 3.44 1 51 VAL -1.95 1.53 1 52 ALA -3.60 2.44 1 53 ILE -2.33 2.00 1 54 ASN -4.25 3.75 1 57 ASP 2.08 -0.74 1 59 LEU -0.18 1.47 1 60 VAL 0.98 0.22 1 61 VAL -1.64 1.18 1 62 ASP -0.81 0.68 1 63 ALA -2.73 1.77 1 64 LYS -0.31 0.39 1 65 VAL -1.34 0.80 1 66 THR -0.94 1.37 1 67 ASP -0.84 0.33 1 68 ASN 2.30 -0.89 1 69 ASN 2.92 -1.25 1 70 ASP -1.51 0.49 1 72 THR -5.50 3.55 1 73 TYR -3.17 1.84 1 75 VAL -1.37 0.48 1 76 VAL -4.74 3.02 1 77 TYR -4.36 3.02 1 78 ASP -3.02 2.48 1 79 ALA -0.67 1.50 1 81 VAL -5.84 3.31 1 82 GLU 0.68 0.57 1 84 ASN -0.85 2.44 1 85 TYR -1.46 1.03 1 86 ASN -3.04 3.62 1 87 VAL -0.51 0.69 1 88 ASN -4.77 3.01 1 89 VAL -1.08 0.36 1 90 THR -6.27 3.78 1 91 LEU -3.58 2.44 1 92 ARG 3.82 -2.46 1 94 ASN -2.39 1.58 1 96 ILE 1.70 -2.18 1 98 ASN 2.68 -1.05 1 99 MET -1.57 1.13 1 101 ILE -5.11 4.41 1 102 ASP -1.62 2.03 1 103 VAL -3.39 2.64 1 104 LYS -0.99 0.88 1 106 ILE -4.24 2.87 1 107 GLU 0.11 0.84 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15814_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 0.85 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 -0.32 _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 14 ALA -7.00 1.46 0 79 ALA -0.67 -0.85 0 12 SER 3.54 0.46 0 10 GLU 2.65 -0.37 1 11 HIS -3.10 0.07 1 13 TYR -3.56 0.48 1 15 GLU -6.19 0.47 1 17 GLU 3.71 -0.18 1 19 LEU -0.66 0.10 1 20 VAL 0.58 0.01 1 21 LYS 0.20 0.20 1 22 VAL -4.71 0.21 1 23 PHE -5.64 1.17 1 24 ASP 1.34 0.10 1 25 ASN -1.11 0.02 1 26 ALA -3.30 0.26 1 28 ALA -3.87 0.24 1 29 GLU -6.44 1.38 1 30 PHE -0.82 0.50 1 31 THR -2.57 0.86 1 32 ILE -0.93 -0.05 1 33 PHE 0.90 -0.35 1 34 ALA -3.17 0.30 1 35 VAL -2.99 0.24 1 36 ASP -2.16 0.50 1 37 THR 2.98 -0.30 1 38 LYS -0.08 0.15 1 40 VAL 0.58 -0.10 1 41 ALA 2.54 0.23 1 42 ARG 0.94 0.11 1 43 THR -0.15 0.02 1 44 ASP -2.07 -0.37 1 47 ASP -0.87 0.24 1 49 PHE 0.84 0.08 1 50 GLU -4.72 0.24 1 51 VAL -1.95 0.53 1 52 ALA -3.60 0.56 1 53 ILE -2.33 0.98 1 54 ASN -4.25 0.69 1 57 ASP 2.08 -0.38 1 59 LEU -0.18 -0.22 1 60 VAL 0.98 0.23 1 61 VAL -1.64 0.09 1 62 ASP -0.81 0.18 1 63 ALA -2.73 0.36 1 64 LYS -0.31 0.26 1 65 VAL -1.34 0.74 1 66 THR -0.94 0.06 1 67 ASP -0.84 -0.37 1 68 ASN 2.30 -0.23 1 69 ASN 2.92 -0.70 1 70 ASP -1.51 0.02 1 72 THR -5.50 1.22 1 73 TYR -3.17 0.48 1 75 VAL -1.37 0.75 1 76 VAL -4.74 1.22 1 77 TYR -4.36 0.49 1 78 ASP -3.02 0.05 1 81 VAL -5.84 0.55 1 82 GLU 0.68 -0.21 1 84 ASN -0.85 0.34 1 85 TYR -1.46 0.17 1 86 ASN -3.04 0.60 1 87 VAL -0.51 0.09 1 88 ASN -4.77 0.52 1 89 VAL -1.08 0.96 1 90 THR -6.27 0.73 1 91 LEU -3.58 0.01 1 92 ARG 3.82 -0.49 1 94 ASN -2.39 0.24 1 96 ILE 1.70 0.57 1 98 ASN 2.68 -0.38 1 99 MET -1.57 0.08 1 101 ILE -5.11 0.38 1 102 ASP -1.62 0.91 1 103 VAL -3.39 0.00 1 104 LYS -0.99 0.41 1 106 ILE -4.24 0.56 1 107 GLU 0.11 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15814_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -1.69 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _LACS_plot.Y_axis_chem_shift_offset 1.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 SER 3.54 -4.10 0 11 HIS -3.10 3.00 0 10 GLU 2.65 0.80 1 13 TYR -3.56 -4.90 1 14 ALA -7.00 -2.00 1 17 GLU 3.71 -1.40 1 19 LEU -0.66 -1.40 1 20 VAL 0.58 -1.10 1 21 LYS 0.20 -3.80 1 22 VAL -4.71 -3.60 1 23 PHE -5.64 1.00 1 24 ASP 1.34 0.90 1 25 ASN -1.11 0.00 1 26 ALA -3.30 -1.40 1 28 ALA -3.87 -1.90 1 29 GLU -6.44 0.40 1 30 PHE -0.82 -4.40 1 31 THR -2.57 -1.70 1 32 ILE -0.93 -3.00 1 33 PHE 0.90 -2.10 1 34 ALA -3.17 -0.20 1 35 VAL -2.99 -2.10 1 36 ASP -2.16 1.60 1 37 THR 2.98 0.90 1 38 LYS -0.08 0.30 1 40 VAL 0.58 -0.50 1 41 ALA 2.54 1.90 1 42 ARG 0.94 0.70 1 43 THR -0.15 -0.70 1 44 ASP -2.07 -1.90 1 47 ASP -0.87 1.20 1 49 PHE 0.84 0.10 1 50 GLU -4.72 -2.10 1 51 VAL -1.95 -2.40 1 52 ALA -3.60 -1.60 1 53 ILE -2.33 -2.30 1 54 ASN -4.25 0.00 1 57 ASP 2.08 -0.20 1 59 LEU -0.18 -1.40 1 60 VAL 0.98 -0.30 1 61 VAL -1.64 -1.70 1 62 ASP -0.81 -1.20 1 63 ALA -2.73 -1.40 1 64 LYS -0.31 -0.80 1 65 VAL -1.34 0.00 1 66 THR -0.94 -1.80 1 67 ASP -0.84 -0.10 1 68 ASN 2.30 -0.60 1 69 ASN 2.92 -2.00 1 70 ASP -1.51 -0.70 1 72 THR -5.50 0.50 1 73 TYR -3.17 -0.20 1 75 VAL -1.37 -1.10 1 76 VAL -4.74 -1.50 1 77 TYR -4.36 -4.90 1 78 ASP -3.02 -2.60 1 79 ALA -0.67 -1.10 1 81 VAL -5.84 -1.10 1 82 GLU 0.68 -2.50 1 84 ASN -0.85 -0.70 1 85 TYR -1.46 -2.30 1 86 ASN -3.04 -1.70 1 87 VAL -0.51 -3.30 1 88 ASN -4.77 -0.30 1 89 VAL -1.08 -1.70 1 90 THR -6.27 -1.70 1 91 LEU -3.58 -1.50 1 92 ARG 3.82 -0.30 1 94 ASN -2.39 -1.30 1 96 ILE 1.70 -2.10 1 98 ASN 2.68 -3.00 1 101 ILE -5.11 -3.10 1 102 ASP -1.62 -0.90 1 103 VAL -3.39 -2.70 1 104 LYS -0.99 -1.80 1 106 ILE -4.24 -2.00 1 107 GLU 0.11 0.40 1 stop_ save_