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 bmr10006_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.62 _LACS_plot.Line_1_terminator_val_y_1 -3.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 4.58 _LACS_plot.Line_2_terminator_val_y_2 2.41 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 ILE -2.69 -3.76 0 75 THR -0.43 -2.93 0 77 HIS -3.49 1.70 0 11 HIS -0.45 1.36 1 12 LYS -0.22 -0.10 1 13 VAL 0.26 0.08 1 14 VAL -0.26 -0.13 1 16 LEU -0.88 -0.15 1 17 SER -1.06 -0.72 1 18 LYS 1.08 0.39 1 20 HIS 1.74 1.67 1 23 VAL -0.49 -0.61 1 24 VAL 0.83 0.37 1 26 LYS 1.83 1.51 1 27 VAL -2.24 -0.17 1 28 THR -2.48 -1.36 1 29 HIS 0.70 2.12 1 30 HIS -5.04 -1.22 1 31 SER -5.02 -1.87 1 32 ILE -5.95 0.09 1 33 GLU -3.21 -1.35 1 34 LEU -6.59 -2.34 1 35 TYR -2.88 -0.90 1 36 TRP 0.19 -0.88 1 37 ASP 0.04 0.99 1 38 LEU 1.74 1.38 1 39 GLU 0.46 0.18 1 40 GLN 0.94 0.13 1 41 LYS 1.65 1.40 1 42 GLU -0.63 -0.54 1 43 LYS 0.70 0.21 1 44 ARG 1.74 0.26 1 45 GLN -1.82 -0.51 1 48 GLN 2.60 1.35 1 49 GLU 3.27 2.08 1 50 GLN -0.02 -0.44 1 51 TRP -2.64 -1.98 1 52 LEU 0.88 0.57 1 53 ARG -4.11 -1.37 1 54 PHE -3.97 -1.29 1 55 SER -3.56 -1.80 1 57 GLU -7.46 -3.25 1 58 GLU -8.02 -2.98 1 59 GLU -1.70 -0.66 1 60 ASP -1.97 -0.78 1 62 LYS 1.58 1.33 1 63 MET -1.12 -1.14 1 64 HIS 4.58 1.88 1 65 SER -4.04 -2.35 1 66 TYR -1.99 0.43 1 68 VAL 2.57 1.95 1 69 ILE -0.85 -0.06 1 70 TYR -2.04 0.70 1 71 THR -2.51 -1.67 1 73 TYR -0.51 0.32 1 74 ALA -1.27 -0.39 1 76 ARG -3.87 -1.41 1 78 VAL 0.24 -0.86 1 79 VAL 1.86 0.26 1 80 GLU -4.82 -1.60 1 82 LEU -0.71 -1.76 1 85 ARG 1.63 0.28 1 86 THR -1.05 0.94 1 87 LEU -0.90 -0.18 1 88 TYR -4.77 0.25 1 89 LYS -4.12 -1.17 1 90 PHE -7.60 -2.59 1 91 ARG -4.32 -1.26 1 92 LEU -5.82 -2.03 1 93 LYS -6.77 -2.10 1 94 VAL -3.38 -1.96 1 95 THR -1.56 -0.56 1 96 SER -0.46 -0.12 1 98 SER 0.75 0.31 1 100 GLU 0.56 0.65 1 101 TYR -6.34 -2.45 1 102 GLU -8.62 -2.22 1 103 TYR -4.49 -0.84 1 104 SER 0.04 0.56 1 106 VAL -0.54 -0.06 1 107 VAL -3.95 -1.89 1 108 SER -2.45 -1.54 1 109 VAL -2.87 -1.59 1 110 ALA -4.78 -3.26 1 111 THR -1.47 -0.85 1 112 THR -0.61 -0.49 1 113 ARG -0.27 0.39 1 114 GLU 0.69 0.59 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10006_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.62 _LACS_plot.Line_1_terminator_val_y_1 5.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.08 _LACS_plot.Line_2_terminator_val_x_2 4.58 _LACS_plot.Line_2_terminator_val_y_2 -2.17 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 ILE -2.69 -1.07 0 75 THR -0.43 -2.50 0 77 HIS -3.49 5.19 0 11 HIS -0.45 1.81 1 12 LYS -0.22 0.12 1 13 VAL 0.26 -0.18 1 14 VAL -0.26 0.13 1 16 LEU -0.88 0.73 1 17 SER -1.06 0.34 1 18 LYS 1.08 -0.69 1 20 HIS 1.74 -0.07 1 23 VAL -0.49 -0.12 1 24 VAL 0.83 -0.46 1 26 LYS 1.83 -0.32 1 27 VAL -2.24 2.07 1 28 THR -2.48 1.12 1 29 HIS 0.70 1.42 1 30 HIS -5.04 3.82 1 31 SER -5.02 3.15 1 32 ILE -5.95 6.04 1 33 GLU -3.21 1.86 1 34 LEU -6.59 4.25 1 35 TYR -2.88 1.98 1 36 TRP 0.19 -1.07 1 37 ASP 0.04 0.95 1 38 LEU 1.74 -0.36 1 39 GLU 0.46 -0.28 1 40 GLN 0.94 -0.81 1 41 LYS 1.65 -0.25 1 42 GLU -0.63 0.09 1 43 LYS 0.70 -0.49 1 44 ARG 1.74 -1.48 1 45 GLN -1.82 1.31 1 48 GLN 2.60 -1.25 1 49 GLU 3.27 -1.19 1 50 GLN -0.02 -0.42 1 51 TRP -2.64 0.66 1 52 LEU 0.88 -0.31 1 53 ARG -4.11 2.74 1 54 PHE -3.97 2.68 1 55 SER -3.56 1.76 1 57 GLU -7.46 4.21 1 58 GLU -8.02 5.04 1 59 GLU -1.70 1.04 1 60 ASP -1.97 1.19 1 62 LYS 1.58 -0.25 1 63 MET -1.12 -0.02 1 64 HIS 4.58 -2.70 1 65 SER -4.04 1.69 1 66 TYR -1.99 2.42 1 68 VAL 2.57 -0.62 1 69 ILE -0.85 0.79 1 70 TYR -2.04 2.74 1 71 THR -2.51 0.84 1 73 TYR -0.51 0.83 1 74 ALA -1.27 0.88 1 76 ARG -3.87 2.46 1 78 VAL 0.24 -1.10 1 79 VAL 1.86 -1.60 1 80 GLU -4.82 3.22 1 82 LEU -0.71 -1.05 1 85 ARG 1.63 -1.35 1 86 THR -1.05 1.99 1 87 LEU -0.90 0.72 1 88 TYR -4.77 5.02 1 89 LYS -4.12 2.95 1 90 PHE -7.60 5.01 1 91 ARG -4.32 3.06 1 92 LEU -5.82 3.79 1 93 LYS -6.77 4.67 1 94 VAL -3.38 1.42 1 95 THR -1.56 1.00 1 96 SER -0.46 0.34 1 98 SER 0.75 -0.44 1 100 GLU 0.56 0.09 1 101 TYR -6.34 3.89 1 102 GLU -8.62 6.40 1 103 TYR -4.49 3.65 1 104 SER 0.04 0.52 1 106 VAL -0.54 0.48 1 107 VAL -3.95 2.06 1 108 SER -2.45 0.91 1 109 VAL -2.87 1.28 1 110 ALA -4.78 1.52 1 111 THR -1.47 0.62 1 112 THR -0.61 0.12 1 113 ARG -0.27 0.66 1 114 GLU 0.69 -0.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10006_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.62 _LACS_plot.Line_1_terminator_val_y_1 1.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 4.58 _LACS_plot.Line_2_terminator_val_y_2 -0.54 _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 48 GLN 2.60 -2.74 0 11 HIS -0.45 -0.19 1 12 LYS -0.22 -0.04 1 13 VAL 0.26 -0.08 1 14 VAL -0.26 -0.04 1 16 LEU -0.88 -0.07 1 17 SER -1.06 -0.05 1 18 LYS 1.08 -0.45 1 20 HIS 1.74 -0.35 1 23 VAL -0.49 -0.30 1 24 VAL 0.83 0.09 1 26 LYS 1.83 -0.19 1 27 VAL -2.24 0.48 1 28 THR -2.48 0.48 1 29 HIS 0.70 0.09 1 30 HIS -5.04 -0.02 1 31 SER -5.02 0.92 1 32 ILE -5.95 0.05 1 33 GLU -3.21 0.16 1 34 LEU -6.59 1.13 1 35 TYR -2.88 0.37 1 36 TRP 0.19 0.46 1 37 ASP 0.04 -0.21 1 38 LEU 1.74 -0.17 1 39 GLU 0.46 -0.16 1 40 GLN 0.94 -0.06 1 41 LYS 1.65 -0.20 1 42 GLU -0.63 -0.01 1 43 LYS 0.70 -0.15 1 44 ARG 1.74 -0.63 1 45 GLN -1.82 0.21 1 49 GLU 3.27 -0.35 1 50 GLN -0.02 0.08 1 51 TRP -2.64 0.21 1 52 LEU 0.88 -0.15 1 53 ARG -4.11 -0.18 1 54 PHE -3.97 0.97 1 55 SER -3.56 1.25 1 56 ILE -2.69 0.74 1 57 GLU -7.46 1.15 1 58 GLU -8.02 1.05 1 59 GLU -1.70 -0.82 1 60 ASP -1.97 -0.02 1 62 LYS 1.58 -0.20 1 63 MET -1.12 -0.06 1 64 HIS 4.58 -0.59 1 65 SER -4.04 0.16 1 66 TYR -1.99 0.33 1 68 VAL 2.57 0.03 1 69 ILE -0.85 0.57 1 70 TYR -2.04 -0.13 1 71 THR -2.51 0.57 1 73 TYR -0.51 0.64 1 74 ALA -1.27 0.26 1 75 THR -0.43 -1.47 1 76 ARG -3.87 -0.10 1 77 HIS -3.49 -0.28 1 78 VAL 0.24 0.02 1 79 VAL 1.86 -0.50 1 80 GLU -4.82 0.36 1 82 LEU -0.71 0.04 1 85 ARG 1.63 -0.51 1 86 THR -1.05 0.00 1 87 LEU -0.90 -0.04 1 88 TYR -4.77 -0.17 1 89 LYS -4.12 0.93 1 90 PHE -7.60 1.60 1 91 ARG -4.32 0.31 1 92 LEU -5.82 0.65 1 93 LYS -6.77 0.60 1 94 VAL -3.38 0.75 1 95 THR -1.56 0.79 1 96 SER -0.46 0.05 1 98 SER 0.75 -0.08 1 100 GLU 0.56 -0.17 1 101 TYR -6.34 1.29 1 102 GLU -8.62 0.17 1 103 TYR -4.49 1.02 1 104 SER 0.04 0.09 1 106 VAL -0.54 0.29 1 107 VAL -3.95 0.48 1 108 SER -2.45 1.14 1 109 VAL -2.87 0.33 1 110 ALA -4.78 1.64 1 111 THR -1.47 -0.04 1 112 THR -0.61 0.01 1 113 ARG -0.27 0.06 1 114 GLU 0.69 -0.58 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10006_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.62 _LACS_plot.Line_1_terminator_val_y_1 -2.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 4.58 _LACS_plot.Line_2_terminator_val_y_2 0.79 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 HIS 4.58 -0.95 0 109 VAL -2.87 -4.36 0 102 GLU -8.62 -2.14 0 58 GLU -8.02 -0.10 0 11 HIS -0.45 1.24 1 12 LYS -0.22 -0.71 1 13 VAL 0.26 -0.41 1 14 VAL -0.26 -0.85 1 16 LEU -0.88 -0.51 1 17 SER -1.06 -0.93 1 18 LYS 1.08 0.16 1 20 HIS 1.74 0.84 1 23 VAL -0.49 -1.60 1 24 VAL 0.83 1.00 1 26 LYS 1.83 0.14 1 27 VAL -2.24 -0.39 1 28 THR -2.48 -0.49 1 29 HIS 0.70 0.03 1 30 HIS -5.04 -0.66 1 31 SER -5.02 -2.99 1 32 ILE -5.95 -3.24 1 33 GLU -3.21 -2.80 1 34 LEU -6.59 -2.20 1 35 TYR -2.88 -1.20 1 36 TRP 0.19 -1.76 1 37 ASP 0.04 0.63 1 38 LEU 1.74 0.59 1 39 GLU 0.46 -0.17 1 40 GLN 0.94 -0.08 1 41 LYS 1.65 0.84 1 42 GLU -0.63 -0.18 1 43 LYS 0.70 0.15 1 44 ARG 1.74 -0.72 1 45 GLN -1.82 0.25 1 48 GLN 2.60 0.63 1 49 GLU 3.27 0.63 1 50 GLN -0.02 -0.31 1 51 TRP -2.64 1.10 1 52 LEU 0.88 -2.71 1 53 ARG -4.11 -1.36 1 54 PHE -3.97 -0.16 1 55 SER -3.56 -1.73 1 56 ILE -2.69 -1.10 1 57 GLU -7.46 -1.91 1 59 GLU -1.70 -0.85 1 60 ASP -1.97 0.81 1 62 LYS 1.58 0.83 1 63 MET -1.12 0.42 1 65 SER -4.04 -1.98 1 66 TYR -1.99 0.26 1 68 VAL 2.57 0.91 1 69 ILE -0.85 -1.25 1 70 TYR -2.04 -1.94 1 71 THR -2.51 -3.44 1 73 TYR -0.51 0.40 1 74 ALA -1.27 -2.46 1 75 THR -0.43 -2.96 1 76 ARG -3.87 -2.15 1 77 HIS -3.49 -1.81 1 78 VAL 0.24 -2.51 1 79 VAL 1.86 -1.55 1 80 GLU -4.82 -0.07 1 85 ARG 1.63 -1.51 1 86 THR -1.05 -4.01 1 87 LEU -0.90 -2.63 1 88 TYR -4.77 -2.24 1 89 LYS -4.12 -1.32 1 90 PHE -7.60 -0.90 1 91 ARG -4.32 -4.33 1 92 LEU -5.82 -4.17 1 93 LYS -6.77 -1.30 1 94 VAL -3.38 -1.86 1 95 THR -1.56 0.23 1 96 SER -0.46 1.78 1 98 SER 0.75 0.96 1 100 GLU 0.56 -2.20 1 101 TYR -6.34 -1.56 1 103 TYR -4.49 1.21 1 104 SER 0.04 -0.87 1 106 VAL -0.54 0.76 1 107 VAL -3.95 -2.84 1 108 SER -2.45 -0.79 1 110 ALA -4.78 1.07 1 111 THR -1.47 1.86 1 112 THR -0.61 0.10 1 113 ARG -0.27 0.15 1 114 GLU 0.69 -0.75 1 stop_ save_