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 bmr16697_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 -2.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 4.51 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS -6.94 -1.59 0 10 MET 0.44 0.29 1 12 ARG -0.51 -0.33 1 13 ASP -1.85 -1.82 1 15 ASP 0.78 0.75 1 16 LYS 0.92 0.57 1 17 TRP 0.26 -0.11 1 18 GLN 0.85 0.52 1 19 HIS 0.59 1.17 1 20 ASP 0.48 0.46 1 21 LEU 0.65 0.48 1 22 PHE 0.25 0.09 1 23 ASP -0.33 0.01 1 24 SER 0.57 0.70 1 30 GLU 0.47 0.26 1 32 VAL -0.12 -0.14 1 33 GLU -0.70 -0.17 1 34 THR -0.26 0.21 1 36 ALA -4.25 -0.73 1 37 LYS -2.79 -1.07 1 38 LEU -3.87 -2.51 1 39 LEU -2.01 -1.08 1 40 VAL -1.44 -1.35 1 41 SER -2.70 -0.98 1 42 ASN 0.42 0.87 1 43 LEU -1.73 -1.23 1 44 ASP -1.83 0.42 1 45 PHE 3.30 1.71 1 47 VAL 3.52 1.91 1 48 SER -5.64 -1.52 1 49 ASP 4.79 4.02 1 50 ALA 3.45 2.58 1 51 ASP 2.68 3.08 1 52 ILE 3.29 0.64 1 53 GLN 5.89 4.17 1 54 GLU 2.89 2.40 1 55 LEU 1.68 2.34 1 56 PHE 3.61 3.81 1 57 ALA 3.31 2.32 1 58 GLU 1.47 1.15 1 59 PHE 1.78 2.17 1 61 THR 2.85 2.42 1 62 LEU -1.88 -1.32 1 63 LYS 0.48 0.32 1 64 LYS -1.98 0.48 1 65 ALA -1.26 -0.38 1 66 ALA -4.46 -1.20 1 67 VAL 0.53 0.47 1 68 ASP -0.59 0.12 1 69 TYR -4.49 -0.77 1 70 ASP -3.31 -1.89 1 71 ARG 3.80 2.48 1 72 SER -0.24 0.13 1 74 ARG -0.66 -0.75 1 75 SER -0.35 -0.14 1 76 LEU -0.06 -0.22 1 78 THR -5.79 -3.34 1 79 ALA -5.71 -1.61 1 80 ASP -3.68 -1.39 1 81 VAL -1.96 -1.04 1 83 PHE -1.23 0.57 1 84 GLU 2.25 2.74 1 85 ARG -2.42 -1.85 1 86 ARG 5.06 3.88 1 87 ALA 3.32 2.77 1 88 ASP 3.17 2.52 1 89 ALA 1.94 1.57 1 90 LEU 3.97 2.82 1 91 LYS 4.04 3.46 1 92 ALA 1.44 1.94 1 93 MET 3.91 4.15 1 94 LYS 3.63 2.65 1 95 GLN 3.21 2.35 1 96 TYR -0.52 0.78 1 97 LYS 4.80 4.02 1 99 VAL -1.35 -1.46 1 101 LEU -1.42 -0.86 1 102 ASP 3.20 1.13 1 104 ARG -4.18 -2.99 1 106 MET -0.17 2.21 1 107 ASP -2.18 -1.13 1 108 ILE -4.32 -0.24 1 109 GLN -5.29 -1.96 1 110 LEU -0.97 -0.19 1 111 VAL 0.27 0.18 1 112 ALA -0.85 -0.32 1 113 SER -0.21 0.08 1 114 GLN 0.60 0.51 1 115 ILE 0.41 0.41 1 116 ASP 0.08 0.10 1 117 LEU 0.71 0.59 1 118 GLU 0.35 0.38 1 119 HIS 0.34 0.89 1 124 HIS 1.09 2.26 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16697_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 4.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.76 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 -1.37 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS -6.94 5.35 0 10 MET 0.44 -0.15 1 12 ARG -0.51 0.18 1 13 ASP -1.85 0.03 1 15 ASP 0.78 -0.03 1 16 LYS 0.92 -0.35 1 17 TRP 0.26 -0.37 1 18 GLN 0.85 -0.33 1 19 HIS 0.59 0.58 1 20 ASP 0.48 -0.02 1 21 LEU 0.65 -0.17 1 22 PHE 0.25 -0.16 1 23 ASP -0.33 0.34 1 24 SER 0.57 0.13 1 30 GLU 0.47 -0.21 1 32 VAL -0.12 -0.02 1 33 GLU -0.70 0.53 1 34 THR -0.26 0.47 1 36 ALA -4.25 3.52 1 37 LYS -2.79 1.72 1 38 LEU -3.87 1.36 1 39 LEU -2.01 0.93 1 40 VAL -1.44 0.09 1 41 SER -2.70 1.72 1 42 ASN 0.42 0.45 1 43 LEU -1.73 0.50 1 44 ASP -1.83 2.25 1 45 PHE 3.30 -1.59 1 47 VAL 3.52 -1.61 1 48 SER -5.64 4.12 1 49 ASP 4.79 -0.77 1 50 ALA 3.45 -0.87 1 51 ASP 2.68 0.40 1 52 ILE 3.29 -2.65 1 53 GLN 5.89 -1.72 1 54 GLU 2.89 -0.49 1 55 LEU 1.68 0.66 1 56 PHE 3.61 0.20 1 57 ALA 3.31 -0.99 1 58 GLU 1.47 -0.32 1 59 PHE 1.78 0.39 1 61 THR 2.85 -0.43 1 62 LEU -1.88 0.56 1 63 LYS 0.48 -0.16 1 64 LYS -1.98 2.46 1 65 ALA -1.26 0.88 1 66 ALA -4.46 3.26 1 67 VAL 0.53 -0.06 1 68 ASP -0.59 0.71 1 69 TYR -4.49 3.72 1 70 ASP -3.31 1.42 1 71 ARG 3.80 -1.32 1 72 SER -0.24 0.37 1 74 ARG -0.66 -0.09 1 75 SER -0.35 0.21 1 76 LEU -0.06 -0.16 1 78 THR -5.79 2.45 1 79 ALA -5.71 4.10 1 80 ASP -3.68 2.29 1 81 VAL -1.96 0.92 1 83 PHE -1.23 1.80 1 84 GLU 2.25 0.49 1 85 ARG -2.42 0.57 1 86 ARG 5.06 -1.18 1 87 ALA 3.32 -0.55 1 88 ASP 3.17 -0.65 1 89 ALA 1.94 -0.37 1 90 LEU 3.97 -1.15 1 91 LYS 4.04 -0.58 1 92 ALA 1.44 0.50 1 93 MET 3.91 0.24 1 94 LYS 3.63 -0.98 1 95 GLN 3.21 -0.86 1 96 TYR -0.52 1.30 1 97 LYS 4.80 -0.78 1 99 VAL -1.35 -0.11 1 101 LEU -1.42 0.56 1 102 ASP 3.20 -2.07 1 104 ARG -4.18 1.19 1 106 MET -0.17 2.38 1 107 ASP -2.18 1.05 1 108 ILE -4.32 4.08 1 109 GLN -5.29 3.33 1 110 LEU -0.97 0.78 1 111 VAL 0.27 -0.09 1 112 ALA -0.85 0.53 1 113 SER -0.21 0.29 1 114 GLN 0.60 -0.09 1 115 ILE 0.41 0.00 1 116 ASP 0.08 0.02 1 117 LEU 0.71 -0.12 1 118 GLU 0.35 0.03 1 119 HIS 0.34 0.55 1 124 HIS 1.09 1.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16697_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 -2.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 5.88 _LACS_plot.Line_2_terminator_val_y_2 2.04 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS -6.94 0.80 0 124 HIS 1.09 4.92 0 10 MET 0.44 0.34 1 12 ARG -0.51 -0.62 1 13 ASP -1.85 -1.54 1 15 ASP 0.78 0.41 1 16 LYS 0.92 -0.15 1 17 TRP 0.26 0.15 1 18 GLN 0.85 -0.26 1 19 HIS 0.59 0.57 1 20 ASP 0.48 -0.14 1 21 LEU 0.65 -0.38 1 22 PHE 0.25 -0.28 1 23 ASP -0.33 -0.01 1 24 SER 0.57 0.76 1 30 GLU 0.47 0.52 1 32 VAL -0.12 -0.33 1 33 GLU -0.70 -0.10 1 34 THR -0.26 0.89 1 36 ALA -4.25 -3.47 1 37 LYS -2.79 -2.30 1 38 LEU -3.87 -1.66 1 39 LEU -2.01 -1.16 1 40 VAL -1.44 -1.67 1 41 SER -2.70 -1.49 1 42 ASN 0.42 1.43 1 43 LEU -1.73 0.13 1 44 ASP -1.83 1.57 1 45 PHE 3.30 -0.16 1 47 VAL 3.52 -0.31 1 48 SER -5.64 0.51 1 49 ASP 4.79 1.67 1 50 ALA 3.45 2.41 1 51 ASP 2.68 2.35 1 52 ILE 3.29 1.32 1 53 GLN 5.89 1.32 1 54 GLU 2.89 2.40 1 55 LEU 1.68 1.96 1 56 PHE 3.61 1.03 1 57 ALA 3.31 1.26 1 58 GLU 1.47 0.45 1 59 PHE 1.78 -1.03 1 61 THR 2.85 0.37 1 62 LEU -1.88 -0.29 1 63 LYS 0.48 -0.24 1 64 LYS -1.98 -2.59 1 65 ALA -1.26 -4.06 1 66 ALA -4.46 -1.42 1 67 VAL 0.53 -1.30 1 68 ASP -0.59 -3.02 1 69 TYR -4.49 0.93 1 70 ASP -3.31 2.06 1 71 ARG 3.80 1.04 1 72 SER -0.24 -0.09 1 74 ARG -0.66 -0.08 1 75 SER -0.35 1.35 1 76 LEU -0.06 1.24 1 78 THR -5.79 -2.21 1 79 ALA -5.71 -3.35 1 80 ASP -3.68 -1.11 1 81 VAL -1.96 -2.40 1 83 PHE -1.23 -0.24 1 84 GLU 2.25 -0.16 1 85 ARG -2.42 0.59 1 86 ARG 5.06 1.00 1 87 ALA 3.32 2.20 1 88 ASP 3.17 0.00 1 89 ALA 1.94 1.24 1 90 LEU 3.97 2.03 1 91 LYS 4.04 1.69 1 92 ALA 1.44 0.99 1 93 MET 3.91 0.73 1 94 LYS 3.63 1.97 1 95 GLN 3.21 1.38 1 96 TYR -0.52 0.65 1 97 LYS 4.80 1.24 1 99 VAL -1.35 -1.30 1 101 LEU -1.42 -0.98 1 102 ASP 3.20 -0.43 1 104 ARG -4.18 -1.39 1 106 MET -0.17 -0.24 1 107 ASP -2.18 -0.76 1 108 ILE -4.32 -2.77 1 109 GLN -5.29 -2.26 1 110 LEU -0.97 -0.96 1 111 VAL 0.27 -1.13 1 112 ALA -0.85 -0.62 1 113 SER -0.21 -0.24 1 114 GLN 0.60 -0.05 1 115 ILE 0.41 -0.71 1 116 ASP 0.08 0.06 1 117 LEU 0.71 0.13 1 118 GLU 0.35 -0.11 1 119 HIS 0.34 0.61 1 stop_ save_