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 bmr6331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.06 _LACS_plot.Line_1_terminator_val_y_1 -5.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.55 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 1.97 _LACS_plot.Y_axis_chem_shift_offset 2.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 ASP 3.76 2.85 0 16 GLN 2.69 -3.35 0 18 TRP -4.09 -6.80 0 10 GLN 0.45 -2.29 1 11 LYS 2.15 -1.30 1 13 LEU 3.95 0.96 1 14 HIS 2.64 0.64 1 15 GLU -2.16 -3.50 1 17 LEU 2.81 0.39 1 19 TYR -0.88 -2.62 1 20 HIS -3.16 -1.16 1 22 ALA 0.53 -3.76 1 23 ILE 0.19 -2.18 1 25 ARG 4.93 1.85 1 26 ALA 2.66 -0.01 1 27 GLU 1.30 -1.16 1 28 VAL 5.94 1.98 1 29 ALA 3.15 0.06 1 30 GLU 0.47 -1.79 1 31 LEU -1.15 -1.90 1 32 LEU -1.29 -3.48 1 33 VAL -0.46 -0.55 1 34 HIS -5.56 -3.91 1 35 SER 3.43 -0.18 1 37 ASP -0.84 -2.01 1 38 PHE -8.06 -4.35 1 39 LEU -3.08 -3.22 1 40 VAL -2.90 -3.51 1 41 ARG -5.49 -4.97 1 42 GLU -4.42 -4.30 1 43 SER -0.21 -2.54 1 44 GLN -3.08 -0.45 1 46 LYS -1.34 -2.73 1 47 GLN 2.42 -1.87 1 48 GLU -4.44 -3.95 1 49 TYR -2.11 -2.35 1 50 VAL -4.32 -3.60 1 51 LEU -3.67 -3.74 1 52 SER -1.62 -1.75 1 53 VAL -7.22 -5.96 1 54 LEU 0.01 -2.88 1 55 TRP -3.76 -1.36 1 56 ASP 2.41 -1.35 1 58 LEU -5.06 -3.39 1 60 ARG -4.10 -5.91 1 61 HIS -3.60 -2.41 1 62 PHE -2.40 -3.40 1 63 ILE 1.78 -1.24 1 64 ILE 2.16 -1.16 1 65 GLN -0.95 -2.28 1 66 SER -2.74 -4.55 1 67 LEU -2.19 -2.49 1 68 ASP 3.33 -0.78 1 69 ASN 2.95 -0.69 1 70 LEU -4.59 -4.19 1 71 TYR -2.29 -2.99 1 72 ARG -5.13 -3.39 1 73 LEU 1.77 -1.44 1 74 GLU -2.37 -2.91 1 76 GLU -0.16 -2.01 1 78 PHE -4.15 -1.97 1 80 SER -5.27 -4.53 1 81 ILE 3.38 0.85 1 83 LEU 3.75 0.72 1 84 LEU 4.57 -1.70 1 85 ILE 2.10 1.20 1 87 HIS 4.20 0.95 1 88 LEU 2.26 0.41 1 89 LEU 3.95 1.08 1 90 SER 0.25 -1.12 1 91 THR 4.11 -1.11 1 92 GLN -1.19 -2.54 1 93 GLN 3.82 0.98 1 95 LEU -6.46 -5.96 1 96 THR 4.15 0.80 1 97 LYS 2.10 -0.41 1 98 LYS 1.80 -0.44 1 99 SER 2.47 -1.50 1 101 VAL -4.65 -4.27 1 102 VAL 0.60 -2.65 1 103 LEU -2.71 -0.73 1 104 HIS -2.80 -1.66 1 105 ARG -3.10 -4.25 1 106 ALA 1.03 -1.50 1 107 VAL -0.54 -2.86 1 109 SER -0.05 -2.25 1 112 SER -0.26 -2.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.06 _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 -3.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.55 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 -3.97 _LACS_plot.Y_axis_chem_shift_offset 2.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 ASP 3.76 -0.91 0 16 GLN 2.69 -6.04 0 18 TRP -4.09 -2.71 0 10 GLN 0.45 -2.74 1 11 LYS 2.15 -3.45 1 13 LEU 3.95 -2.99 1 14 HIS 2.64 -2.00 1 15 GLU -2.16 -1.34 1 17 LEU 2.81 -2.42 1 19 TYR -0.88 -1.74 1 20 HIS -3.16 2.00 1 22 ALA 0.53 -4.29 1 23 ILE 0.19 -2.37 1 25 ARG 4.93 -3.08 1 26 ALA 2.66 -2.67 1 27 GLU 1.30 -2.46 1 28 VAL 5.94 -3.96 1 29 ALA 3.15 -3.09 1 30 GLU 0.47 -2.26 1 31 LEU -1.15 -0.75 1 32 LEU -1.29 -2.19 1 33 VAL -0.46 -0.09 1 34 HIS -5.56 1.65 1 35 SER 3.43 -3.61 1 37 ASP -0.84 -1.17 1 38 PHE -8.06 3.71 1 39 LEU -3.08 -0.14 1 40 VAL -2.90 -0.61 1 41 ARG -5.49 0.52 1 42 GLU -4.42 0.12 1 43 SER -0.21 -2.33 1 44 GLN -3.08 2.63 1 46 LYS -1.34 -1.39 1 47 GLN 2.42 -4.29 1 48 GLU -4.44 0.49 1 49 TYR -2.11 -0.24 1 50 VAL -4.32 0.72 1 51 LEU -3.67 -0.07 1 52 SER -1.62 -0.13 1 53 VAL -7.22 1.26 1 54 LEU 0.01 -2.89 1 55 TRP -3.76 2.40 1 56 ASP 2.41 -3.76 1 58 LEU -5.06 1.67 1 60 ARG -4.10 -1.81 1 61 HIS -3.60 1.19 1 62 PHE -2.40 -1.00 1 63 ILE 1.78 -3.02 1 64 ILE 2.16 -3.32 1 65 GLN -0.95 -1.33 1 66 SER -2.74 -1.81 1 67 LEU -2.19 -0.30 1 68 ASP 3.33 -4.11 1 69 ASN 2.95 -3.64 1 70 LEU -4.59 0.40 1 71 TYR -2.29 -0.70 1 72 ARG -5.13 1.74 1 73 LEU 1.77 -3.21 1 74 GLU -2.37 -0.54 1 76 GLU -0.16 -1.85 1 78 PHE -4.15 2.18 1 80 SER -5.27 0.74 1 81 ILE 3.38 -2.53 1 83 LEU 3.75 -3.03 1 84 LEU 4.57 -6.27 1 85 ILE 2.10 -0.90 1 87 HIS 4.20 -3.25 1 88 LEU 2.26 -1.85 1 89 LEU 3.95 -2.87 1 90 SER 0.25 -1.37 1 91 THR 4.11 -5.22 1 92 GLN -1.19 -1.35 1 93 GLN 3.82 -2.84 1 95 LEU -6.46 0.50 1 96 THR 4.15 -3.35 1 97 LYS 2.10 -2.51 1 98 LYS 1.80 -2.24 1 99 SER 2.47 -3.97 1 101 VAL -4.65 0.38 1 102 VAL 0.60 -3.25 1 103 LEU -2.71 1.98 1 104 HIS -2.80 1.14 1 105 ARG -3.10 -1.15 1 106 ALA 1.03 -2.53 1 107 VAL -0.54 -2.32 1 109 SER -0.05 -2.20 1 112 SER -0.26 -1.96 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.06 _LACS_plot.Line_1_terminator_val_y_1 0.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.04 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 -0.88 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 99 SER 2.47 -3.15 0 10 GLN 0.45 -0.28 1 11 LYS 2.15 -0.37 1 13 LEU 3.95 -1.02 1 14 HIS 2.64 -0.83 1 15 GLU -2.16 -0.16 1 16 GLN 2.69 -0.81 1 17 LEU 2.81 -0.43 1 18 TRP -4.09 0.31 1 19 TYR -0.88 0.84 1 20 HIS -3.16 -0.36 1 22 ALA 0.53 0.75 1 23 ILE 0.19 0.09 1 25 ARG 4.93 -0.86 1 26 ALA 2.66 -0.27 1 27 GLU 1.30 -0.26 1 28 VAL 5.94 -0.83 1 29 ALA 3.15 -0.47 1 30 GLU 0.47 -0.25 1 31 LEU -1.15 -0.22 1 32 LEU -1.29 0.00 1 33 VAL -0.46 -0.24 1 34 HIS -5.56 0.03 1 35 SER 3.43 -0.48 1 37 ASP -0.84 1.16 1 38 PHE -8.06 1.49 1 39 LEU -3.08 0.53 1 40 VAL -2.90 1.50 1 41 ARG -5.49 0.77 1 42 GLU -4.42 0.62 1 43 SER -0.21 -0.23 1 44 GLN -3.08 -0.29 1 46 LYS -1.34 -0.10 1 47 GLN 2.42 -0.27 1 48 GLU -4.44 0.04 1 49 TYR -2.11 0.72 1 50 VAL -4.32 0.56 1 51 LEU -3.67 0.76 1 52 SER -1.62 1.30 1 53 VAL -7.22 1.39 1 54 LEU 0.01 0.09 1 55 TRP -3.76 0.11 1 56 ASP 2.41 -0.66 1 58 LEU -5.06 0.32 1 60 ARG -4.10 -0.07 1 61 HIS -3.60 0.43 1 62 PHE -2.40 -0.02 1 63 ILE 1.78 -0.06 1 64 ILE 2.16 -0.18 1 65 GLN -0.95 0.12 1 66 SER -2.74 0.52 1 67 LEU -2.19 0.07 1 68 ASP 3.33 -0.54 1 69 ASN 2.95 -0.76 1 70 LEU -4.59 0.18 1 71 TYR -2.29 0.89 1 72 ARG -5.13 0.55 1 73 LEU 1.77 0.42 1 74 GLU -2.37 0.05 1 76 GLU -0.16 -0.45 1 78 PHE -4.15 -0.00 1 80 SER -5.27 0.34 1 81 ILE 3.38 -0.42 1 83 LEU 3.75 -1.20 1 84 LEU 4.57 -1.16 1 85 ILE 2.10 -0.39 1 86 ASP 3.76 -0.64 1 87 HIS 4.20 -0.88 1 88 LEU 2.26 -0.59 1 89 LEU 3.95 -0.39 1 90 SER 0.25 -0.24 1 91 THR 4.11 -0.64 1 92 GLN -1.19 -0.41 1 93 GLN 3.82 -1.04 1 95 LEU -6.46 -0.05 1 96 THR 4.15 -0.51 1 97 LYS 2.10 -0.31 1 98 LYS 1.80 -0.24 1 101 VAL -4.65 -0.43 1 102 VAL 0.60 -0.44 1 103 LEU -2.71 0.24 1 104 HIS -2.80 0.09 1 105 ARG -3.10 -1.54 1 106 ALA 1.03 -0.22 1 107 VAL -0.54 -0.87 1 109 SER -0.05 -0.05 1 112 SER -0.26 -0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.06 _LACS_plot.Line_1_terminator_val_y_1 -4.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.19 _LACS_plot.Line_2_terminator_val_x_2 5.94 _LACS_plot.Line_2_terminator_val_y_2 -1.11 _LACS_plot.Y_axis_chem_shift_offset 2.66 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 HIS -5.56 -1.04 0 99 SER 2.47 -5.76 0 86 ASP 3.76 1.91 0 38 PHE -8.06 -7.14 0 10 GLN 0.45 -1.97 1 11 LYS 2.15 -2.41 1 13 LEU 3.95 -3.33 1 14 HIS 2.64 -0.60 1 15 GLU -2.16 -2.49 1 16 GLN 2.69 -0.19 1 17 LEU 2.81 -3.85 1 18 TRP -4.09 -2.58 1 19 TYR -0.88 -2.52 1 20 HIS -3.16 -1.31 1 22 ALA 0.53 -2.91 1 23 ILE 0.19 -3.71 1 25 ARG 4.93 0.21 1 26 ALA 2.66 -0.83 1 27 GLU 1.30 -0.77 1 28 VAL 5.94 -1.60 1 29 ALA 3.15 -1.63 1 30 GLU 0.47 -1.64 1 31 LEU -1.15 -3.76 1 32 LEU -1.29 -5.25 1 33 VAL -0.46 -3.36 1 35 SER 3.43 0.28 1 37 ASP -0.84 -2.44 1 39 LEU -3.08 -4.82 1 40 VAL -2.90 -5.73 1 41 ARG -5.49 -5.45 1 42 GLU -4.42 -1.95 1 43 SER -0.21 -2.81 1 44 GLN -3.08 -0.95 1 46 LYS -1.34 -3.68 1 47 GLN 2.42 -3.93 1 48 GLU -4.44 -5.10 1 49 TYR -2.11 -3.94 1 50 VAL -4.32 -4.57 1 51 LEU -3.67 -4.72 1 52 SER -1.62 -4.60 1 53 VAL -7.22 -3.46 1 54 LEU 0.01 -4.15 1 55 TRP -3.76 -2.97 1 56 ASP 2.41 -3.06 1 58 LEU -5.06 -4.31 1 60 ARG -4.10 -4.25 1 61 HIS -3.60 -1.54 1 62 PHE -2.40 -3.76 1 63 ILE 1.78 -2.52 1 64 ILE 2.16 -3.22 1 65 GLN -0.95 -2.94 1 66 SER -2.74 -2.77 1 67 LEU -2.19 -3.62 1 68 ASP 3.33 -4.01 1 69 ASN 2.95 -4.08 1 70 LEU -4.59 -4.33 1 71 TYR -2.29 -2.32 1 72 ARG -5.13 -4.75 1 73 LEU 1.77 -3.76 1 74 GLU -2.37 -3.54 1 76 GLU -0.16 -3.62 1 78 PHE -4.15 -1.04 1 80 SER -5.27 -3.92 1 81 ILE 3.38 -1.36 1 83 LEU 3.75 -2.94 1 84 LEU 4.57 -1.61 1 85 ILE 2.10 0.21 1 87 HIS 4.20 0.45 1 88 LEU 2.26 -0.39 1 89 LEU 3.95 -0.16 1 90 SER 0.25 -1.20 1 91 THR 4.11 -4.66 1 92 GLN -1.19 -3.58 1 93 GLN 3.82 -2.13 1 95 LEU -6.46 -2.55 1 96 THR 4.15 0.43 1 97 LYS 2.10 -1.12 1 98 LYS 1.80 -0.93 1 101 VAL -4.65 -4.11 1 102 VAL 0.60 -3.76 1 103 LEU -2.71 -1.56 1 104 HIS -2.80 -6.20 1 105 ARG -3.10 -3.40 1 106 ALA 1.03 -2.64 1 107 VAL -0.54 -2.05 1 109 SER -0.05 -2.13 1 112 SER -0.26 -3.00 1 stop_ save_