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 bmr11092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.39 _LACS_plot.Line_1_terminator_val_y_1 -2.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 5.44 _LACS_plot.Line_2_terminator_val_y_2 3.74 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ILE -4.03 -4.00 0 11 LYS 0.16 0.10 1 12 GLN -1.18 -0.54 1 13 ASP 1.36 0.78 1 15 LYS -1.38 -1.22 1 17 LYS 0.79 1.61 1 18 PHE -3.21 -1.90 1 19 GLN -5.89 -2.43 1 20 GLU 3.23 2.47 1 22 GLU -1.21 0.99 1 23 ARG 0.66 0.12 1 24 VAL -5.34 -2.46 1 25 LEU -4.77 -1.83 1 27 PHE 0.80 1.93 1 28 HIS 1.81 3.02 1 31 LEU -3.29 -1.12 1 32 LEU -5.96 -1.87 1 33 TYR -4.21 -0.59 1 34 GLU 1.82 1.31 1 35 ALA -6.39 -1.38 1 36 LYS -5.16 -1.84 1 38 VAL 2.27 2.54 1 39 LYS -6.18 -1.60 1 40 VAL -2.47 -0.73 1 41 ALA -5.29 -0.92 1 42 ILE -0.76 -1.01 1 43 LYS -3.09 -1.21 1 44 ASP 3.46 1.73 1 45 LYS 4.35 1.41 1 46 GLN -3.83 -1.38 1 47 VAL 0.98 0.34 1 48 LYS -6.25 -1.87 1 49 TYR -5.21 -1.57 1 50 PHE 0.42 -0.67 1 52 HIS -4.09 -1.94 1 53 TYR 2.04 0.72 1 54 SER 2.40 1.44 1 56 TRP -3.14 -2.38 1 57 ASN 0.69 0.74 1 58 LYS 2.49 1.53 1 59 ASN 3.30 1.82 1 60 TRP -1.92 -1.17 1 61 ASP 2.31 1.53 1 62 GLU -4.22 -1.86 1 63 TRP -1.46 -0.72 1 64 VAL -3.77 -2.03 1 66 GLU 2.22 3.77 1 67 SER 3.32 2.04 1 68 ARG 0.46 0.78 1 69 VAL 0.05 -0.18 1 70 LEU -5.77 -2.04 1 71 LYS -1.91 -1.07 1 72 TYR 2.30 1.03 1 73 VAL -6.29 -3.27 1 74 ASP 5.37 4.51 1 75 THR 5.32 3.99 1 76 ASN 1.64 1.33 1 77 LEU 4.10 2.67 1 78 GLN 5.45 3.30 1 79 LYS 4.39 2.73 1 80 GLN 5.18 3.69 1 81 ARG 4.16 3.32 1 82 GLU 3.33 2.82 1 83 LEU 2.94 2.71 1 84 GLN 4.74 3.16 1 85 LYS 3.14 2.49 1 86 ALA 0.78 0.95 1 87 ASN -0.84 0.34 1 88 GLN 3.22 2.87 1 89 GLU 2.51 2.05 1 90 GLN 2.72 1.96 1 91 TYR 1.33 0.89 1 92 ALA 1.73 1.30 1 93 GLU 1.64 1.42 1 95 LYS 1.65 1.11 1 96 MET 1.52 0.86 1 97 ARG 1.79 0.93 1 99 ALA -0.65 -0.11 1 100 ALA 0.42 1.40 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.39 _LACS_plot.Line_1_terminator_val_y_1 3.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.84 _LACS_plot.Line_2_terminator_val_x_2 5.44 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ILE -4.03 0.03 0 11 LYS 0.16 -0.06 1 12 GLN -1.18 0.64 1 13 ASP 1.36 -0.58 1 15 LYS -1.38 0.16 1 17 LYS 0.79 0.82 1 18 PHE -3.21 1.31 1 19 GLN -5.89 3.46 1 20 GLU 3.23 -0.76 1 22 GLU -1.21 2.20 1 23 ARG 0.66 -0.54 1 24 VAL -5.34 2.88 1 25 LEU -4.77 2.94 1 27 PHE 0.80 1.13 1 28 HIS 1.81 1.21 1 31 LEU -3.29 2.17 1 32 LEU -5.96 4.09 1 33 TYR -4.21 3.62 1 34 GLU 1.82 -0.51 1 35 ALA -6.39 5.01 1 36 LYS -5.16 3.32 1 38 VAL 2.27 0.27 1 39 LYS -6.18 4.58 1 40 VAL -2.47 1.74 1 41 ALA -5.29 4.37 1 42 ILE -0.76 -0.25 1 43 LYS -3.09 1.88 1 44 ASP 3.46 -1.73 1 45 LYS 4.35 -2.94 1 46 GLN -3.83 2.45 1 47 VAL 0.98 -0.64 1 48 LYS -6.25 4.38 1 49 TYR -5.21 3.64 1 50 PHE 0.42 -1.09 1 52 HIS -4.09 2.15 1 53 TYR 2.04 -1.32 1 54 SER 2.40 -0.96 1 56 TRP -3.14 0.76 1 57 ASN 0.69 0.05 1 58 LYS 2.49 -0.96 1 59 ASN 3.30 -1.48 1 60 TRP -1.92 0.75 1 61 ASP 2.31 -0.78 1 62 GLU -4.22 2.36 1 63 TRP -1.46 0.74 1 64 VAL -3.77 1.74 1 66 GLU 2.22 1.55 1 67 SER 3.32 -1.28 1 68 ARG 0.46 0.32 1 69 VAL 0.05 -0.23 1 70 LEU -5.77 3.73 1 71 LYS -1.91 0.84 1 72 TYR 2.30 -1.27 1 73 VAL -6.29 3.02 1 74 ASP 5.37 -0.86 1 75 THR 5.32 -1.33 1 76 ASN 1.64 -0.31 1 77 LEU 4.10 -1.43 1 78 GLN 5.45 -2.15 1 79 LYS 4.39 -1.66 1 80 GLN 5.18 -1.49 1 81 ARG 4.16 -0.84 1 82 GLU 3.33 -0.51 1 83 LEU 2.94 -0.23 1 84 GLN 4.74 -1.58 1 85 LYS 3.14 -0.65 1 86 ALA 0.78 0.17 1 87 ASN -0.84 1.18 1 88 GLN 3.22 -0.35 1 89 GLU 2.51 -0.46 1 90 GLN 2.72 -0.76 1 91 TYR 1.33 -0.44 1 92 ALA 1.73 -0.43 1 93 GLU 1.64 -0.22 1 95 LYS 1.65 -0.54 1 96 MET 1.52 -0.66 1 97 ARG 1.79 -0.86 1 99 ALA -0.65 0.54 1 100 ALA 0.42 0.98 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.39 _LACS_plot.Line_1_terminator_val_y_1 0.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 5.44 _LACS_plot.Line_2_terminator_val_y_2 -0.48 _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 63 TRP -1.46 0.85 0 32 LEU -5.96 -0.03 0 11 LYS 0.16 -0.06 1 12 GLN -1.18 0.02 1 13 ASP 1.36 -0.14 1 15 LYS -1.38 0.08 1 17 LYS 0.79 -0.41 1 18 PHE -3.21 0.23 1 19 GLN -5.89 0.41 1 20 GLU 3.23 -0.64 1 22 GLU -1.21 -0.30 1 23 ARG 0.66 0.33 1 24 VAL -5.34 0.73 1 25 LEU -4.77 0.68 1 27 PHE 0.80 0.59 1 28 HIS 1.81 -0.10 1 31 LEU -3.29 0.25 1 33 TYR -4.21 0.03 1 34 GLU 1.82 0.11 1 35 ALA -6.39 0.47 1 36 LYS -5.16 0.72 1 38 VAL 2.27 -0.13 1 39 LYS -6.18 0.57 1 40 VAL -2.47 0.64 1 41 ALA -5.29 0.43 1 42 ILE -0.76 0.51 1 43 LYS -3.09 0.14 1 44 ASP 3.46 -0.41 1 45 LYS 4.35 -0.76 1 46 GLN -3.83 0.32 1 47 VAL 0.98 0.22 1 48 LYS -6.25 0.85 1 49 TYR -5.21 0.94 1 50 PHE 0.42 -0.38 1 51 ILE -4.03 0.17 1 52 HIS -4.09 0.21 1 53 TYR 2.04 -0.71 1 54 SER 2.40 -0.44 1 56 TRP -3.14 0.22 1 57 ASN 0.69 -0.15 1 58 LYS 2.49 0.09 1 59 ASN 3.30 -0.23 1 60 TRP -1.92 0.01 1 61 ASP 2.31 0.13 1 62 GLU -4.22 0.47 1 64 VAL -3.77 0.69 1 66 GLU 2.22 -0.18 1 67 SER 3.32 -0.09 1 68 ARG 0.46 0.25 1 69 VAL 0.05 0.10 1 70 LEU -5.77 0.61 1 71 LYS -1.91 0.29 1 72 TYR 2.30 -0.49 1 73 VAL -6.29 0.63 1 74 ASP 5.37 -0.41 1 75 THR 5.32 -0.37 1 76 ASN 1.64 0.04 1 77 LEU 4.10 -0.40 1 78 GLN 5.45 -0.36 1 79 LYS 4.39 -0.24 1 80 GLN 5.18 -0.57 1 81 ARG 4.16 -0.36 1 82 GLU 3.33 -0.37 1 83 LEU 2.94 -0.24 1 84 GLN 4.74 -0.55 1 85 LYS 3.14 -0.27 1 86 ALA 0.78 0.00 1 87 ASN -0.84 0.23 1 88 GLN 3.22 -0.10 1 89 GLU 2.51 -0.18 1 90 GLN 2.72 -0.15 1 91 TYR 1.33 0.00 1 92 ALA 1.73 -0.24 1 93 GLU 1.64 -0.29 1 95 LYS 1.65 -0.14 1 96 MET 1.52 -0.18 1 97 ARG 1.79 -0.25 1 99 ALA -0.65 0.01 1 100 ALA 0.42 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.39 _LACS_plot.Line_1_terminator_val_y_1 -2.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.82 _LACS_plot.Line_2_terminator_val_x_2 5.44 _LACS_plot.Line_2_terminator_val_y_2 1.81 _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 100 ALA 0.42 4.91 0 11 LYS 0.16 -0.07 1 12 GLN -1.18 -0.58 1 13 ASP 1.36 -0.87 1 17 LYS 0.79 -1.14 1 18 PHE -3.21 -1.95 1 19 GLN -5.89 -0.42 1 20 GLU 3.23 1.11 1 22 GLU -1.21 -0.95 1 23 ARG 0.66 -1.40 1 24 VAL -5.34 -1.95 1 25 LEU -4.77 -2.96 1 27 PHE 0.80 1.32 1 28 HIS 1.81 1.77 1 31 LEU -3.29 -3.32 1 32 LEU -5.96 -0.76 1 33 TYR -4.21 -0.69 1 34 GLU 1.82 -1.05 1 35 ALA -6.39 -2.83 1 36 LYS -5.16 -1.08 1 38 VAL 2.27 -0.25 1 39 LYS -6.18 -2.27 1 40 VAL -2.47 -1.45 1 41 ALA -5.29 -3.12 1 42 ILE -0.76 -0.54 1 43 LYS -3.09 -0.92 1 44 ASP 3.46 -1.15 1 45 LYS 4.35 -2.07 1 46 GLN -3.83 -1.90 1 47 VAL 0.98 -0.74 1 48 LYS -6.25 -2.93 1 49 TYR -5.21 -1.57 1 50 PHE 0.42 -2.21 1 51 ILE -4.03 -2.71 1 52 HIS -4.09 0.56 1 53 TYR 2.04 -0.49 1 54 SER 2.40 0.89 1 58 LYS 2.49 0.67 1 59 ASN 3.30 0.80 1 60 TRP -1.92 -0.86 1 61 ASP 2.31 0.52 1 62 GLU -4.22 -2.14 1 63 TRP -1.46 1.58 1 64 VAL -3.77 -1.72 1 66 GLU 2.22 -0.24 1 67 SER 3.32 1.59 1 68 ARG 0.46 -3.53 1 69 VAL 0.05 -3.09 1 70 LEU -5.77 -1.19 1 71 LYS -1.91 0.85 1 72 TYR 2.30 -2.71 1 73 VAL -6.29 0.06 1 75 THR 5.32 2.15 1 76 ASN 1.64 1.54 1 77 LEU 4.10 2.34 1 78 GLN 5.45 2.37 1 79 LYS 4.39 1.30 1 80 GLN 5.18 2.38 1 81 ARG 4.16 2.60 1 82 GLU 3.33 3.66 1 83 LEU 2.94 2.32 1 84 GLN 4.74 2.16 1 85 LYS 3.14 1.57 1 86 ALA 0.78 0.31 1 87 ASN -0.84 0.02 1 88 GLN 3.22 1.97 1 89 GLU 2.51 1.46 1 90 GLN 2.72 1.44 1 91 TYR 1.33 0.69 1 92 ALA 1.73 1.08 1 93 GLU 1.64 1.47 1 95 LYS 1.65 1.21 1 96 MET 1.52 0.60 1 97 ARG 1.79 0.29 1 99 ALA -0.65 -1.41 1 stop_ save_