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 bmr19988_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -3.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 4.30 _LACS_plot.Line_2_terminator_val_y_2 2.79 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 TRP -2.84 0.50 0 127 ALA -1.21 -2.17 0 10 LEU -2.24 -2.67 0 57 MET 0.94 -1.12 0 11 ALA -4.89 -2.01 1 12 LEU -2.73 -1.11 1 13 GLN -2.10 -0.48 1 14 ASP 2.76 1.43 1 16 GLN -3.57 -1.92 1 17 ARG 1.17 0.62 1 19 VAL -0.88 -0.49 1 20 ARG -6.83 -2.70 1 21 ALA 0.37 0.02 1 22 ARG 1.72 1.95 1 23 LEU -3.11 -1.94 1 24 SER 1.19 0.41 1 25 LEU -2.61 -1.96 1 26 THR -2.10 -1.37 1 27 GLU 2.30 1.66 1 29 LEU 2.26 1.64 1 30 SER -5.02 -1.62 1 34 PHE -3.48 -2.05 1 35 TYR 1.04 0.39 1 37 SER -3.10 -1.02 1 38 ILE -0.88 -0.31 1 39 GLN -3.37 -1.31 1 40 THR -0.61 -0.53 1 41 ARG -0.36 0.13 1 42 ALA 0.08 0.05 1 43 LEU -0.29 -0.11 1 44 SER -1.22 -0.47 1 46 GLU 0.84 0.50 1 47 ARG 2.87 1.96 1 53 ALA 0.80 1.03 1 54 VAL -3.05 -1.88 1 55 THR -3.31 -1.23 1 56 LEU -1.84 -0.90 1 58 VAL -7.15 -3.78 1 59 ASP -0.41 0.97 1 60 GLU 3.26 2.87 1 61 SER 0.19 0.19 1 63 TRP 3.91 2.07 1 64 LEU 2.40 1.70 1 65 ARG 2.65 2.04 1 66 MET -0.33 -0.19 1 67 LEU -0.96 -0.53 1 69 GLN -1.97 -1.60 1 70 VAL -4.97 -3.26 1 71 LEU -0.74 0.79 1 72 THR -4.28 -2.86 1 73 GLU 3.09 2.95 1 74 GLU 3.76 2.94 1 75 ALA -0.54 -0.09 1 76 ALA -3.14 -0.53 1 77 ASN -1.29 -1.28 1 78 SER -3.19 -0.57 1 79 GLU -5.89 -2.29 1 80 ILE -3.51 -1.46 1 81 TYR -5.84 -3.26 1 82 ARG -3.00 -1.36 1 83 LYS -1.58 0.57 1 84 ASP 4.31 2.28 1 85 ASP 1.81 0.88 1 86 ALA -5.74 -1.55 1 87 LEU -3.92 -2.10 1 88 TRP -4.58 -1.88 1 90 ARG -6.93 -2.41 1 91 VAL 1.78 1.42 1 92 THR 1.19 0.24 1 93 LYS -4.69 -1.51 1 94 VAL 2.89 1.71 1 95 VAL -3.06 -1.05 1 97 SER 3.17 2.10 1 100 LEU 0.08 -0.07 1 101 LEU -2.20 -0.33 1 102 TYR -3.85 -0.23 1 103 VAL -7.24 -3.30 1 104 ARG -6.29 -2.33 1 105 LEU 0.79 -0.83 1 106 VAL 1.42 0.90 1 107 THR -0.50 -0.42 1 108 GLU -1.61 -2.04 1 112 ALA -0.08 -0.06 1 121 VAL -0.11 -0.17 1 122 GLU -0.30 -0.01 1 126 LEU -0.42 -0.33 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19988_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 4.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.77 _LACS_plot.Line_2_terminator_val_x_2 4.30 _LACS_plot.Line_2_terminator_val_y_2 -1.51 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 TRP -2.84 3.34 0 127 ALA -1.21 -0.96 0 10 LEU -2.24 -0.43 0 57 MET 0.94 -2.06 0 11 ALA -4.89 2.88 1 12 LEU -2.73 1.62 1 13 GLN -2.10 1.62 1 14 ASP 2.76 -1.33 1 16 GLN -3.57 1.65 1 17 ARG 1.17 -0.55 1 19 VAL -0.88 0.39 1 20 ARG -6.83 4.13 1 21 ALA 0.37 -0.35 1 22 ARG 1.72 0.23 1 23 LEU -3.11 1.17 1 24 SER 1.19 -0.78 1 25 LEU -2.61 0.65 1 26 THR -2.10 0.73 1 27 GLU 2.30 -0.64 1 29 LEU 2.26 -0.62 1 30 SER -5.02 3.40 1 34 PHE -3.48 1.43 1 35 TYR 1.04 -0.65 1 37 SER -3.10 2.08 1 38 ILE -0.88 0.57 1 39 GLN -3.37 2.06 1 40 THR -0.61 0.08 1 41 ARG -0.36 0.49 1 42 ALA 0.08 -0.03 1 43 LEU -0.29 0.18 1 44 SER -1.22 0.75 1 46 GLU 0.84 -0.34 1 47 ARG 2.87 -0.91 1 53 ALA 0.80 0.23 1 54 VAL -3.05 1.17 1 55 THR -3.31 2.08 1 56 LEU -1.84 0.94 1 58 VAL -7.15 3.37 1 59 ASP -0.41 1.38 1 60 GLU 3.26 -0.39 1 61 SER 0.19 0.00 1 63 TRP 3.91 -1.84 1 64 LEU 2.40 -0.70 1 65 ARG 2.65 -0.61 1 66 MET -0.33 0.14 1 67 LEU -0.96 0.43 1 69 GLN -1.97 0.37 1 70 VAL -4.97 1.71 1 71 LEU -0.74 1.53 1 72 THR -4.28 1.42 1 73 GLU 3.09 -0.14 1 74 GLU 3.76 -0.82 1 75 ALA -0.54 0.45 1 76 ALA -3.14 2.61 1 77 ASN -1.29 0.01 1 78 SER -3.19 2.62 1 79 GLU -5.89 3.60 1 80 ILE -3.51 2.05 1 81 TYR -5.84 2.58 1 82 ARG -3.00 1.64 1 83 LYS -1.58 2.15 1 84 ASP 4.31 -2.03 1 85 ASP 1.81 -0.93 1 86 ALA -5.74 4.19 1 87 LEU -3.92 1.82 1 88 TRP -4.58 2.70 1 90 ARG -6.93 4.52 1 91 VAL 1.78 -0.36 1 92 THR 1.19 -0.95 1 93 LYS -4.69 3.18 1 94 VAL 2.89 -1.18 1 95 VAL -3.06 2.01 1 97 SER 3.17 -1.07 1 100 LEU 0.08 -0.15 1 101 LEU -2.20 1.87 1 102 TYR -3.85 3.62 1 103 VAL -7.24 3.94 1 104 ARG -6.29 3.96 1 105 LEU 0.79 -1.62 1 106 VAL 1.42 -0.52 1 107 THR -0.50 0.08 1 108 GLU -1.61 -0.43 1 112 ALA -0.08 0.02 1 121 VAL -0.11 -0.06 1 122 GLU -0.30 0.29 1 126 LEU -0.42 0.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19988_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 0.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 4.30 _LACS_plot.Line_2_terminator_val_y_2 -0.45 _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 80 ILE -3.51 1.40 0 64 LEU 2.40 -1.18 0 10 LEU -2.24 0.05 1 11 ALA -4.89 0.18 1 12 LEU -2.73 0.57 1 13 GLN -2.10 0.18 1 14 ASP 2.76 -0.34 1 16 GLN -3.57 0.31 1 17 ARG 1.17 0.38 1 19 VAL -0.88 0.44 1 20 ARG -6.83 0.84 1 21 ALA 0.37 0.23 1 22 ARG 1.72 -0.17 1 23 LEU -3.11 0.24 1 24 SER 1.19 0.29 1 25 LEU -2.61 0.40 1 26 THR -2.10 -0.12 1 27 GLU 2.30 -0.90 1 29 LEU 2.26 -0.34 1 30 SER -5.02 1.16 1 31 TRP -2.84 0.62 1 34 PHE -3.48 -0.06 1 35 TYR 1.04 0.20 1 37 SER -3.10 0.13 1 38 ILE -0.88 0.39 1 39 GLN -3.37 0.35 1 40 THR -0.61 0.47 1 41 ARG -0.36 0.03 1 42 ALA 0.08 0.00 1 43 LEU -0.29 0.03 1 44 SER -1.22 0.06 1 46 GLU 0.84 -0.09 1 47 ARG 2.87 -0.29 1 53 ALA 0.80 -0.07 1 54 VAL -3.05 0.79 1 55 THR -3.31 0.20 1 56 LEU -1.84 0.09 1 57 MET 0.94 0.35 1 58 VAL -7.15 0.66 1 59 ASP -0.41 -0.15 1 60 GLU 3.26 -0.48 1 61 SER 0.19 -0.10 1 63 TRP 3.91 -0.40 1 65 ARG 2.65 -0.50 1 66 MET -0.33 -0.09 1 67 LEU -0.96 -0.25 1 69 GLN -1.97 1.17 1 70 VAL -4.97 0.74 1 71 LEU -0.74 0.25 1 72 THR -4.28 0.44 1 73 GLU 3.09 -0.51 1 74 GLU 3.76 -0.37 1 75 ALA -0.54 -0.17 1 76 ALA -3.14 -0.04 1 77 ASN -1.29 0.09 1 78 SER -3.19 1.30 1 79 GLU -5.89 1.43 1 81 TYR -5.84 0.60 1 82 ARG -3.00 0.90 1 83 LYS -1.58 0.21 1 84 ASP 4.31 -0.36 1 85 ASP 1.81 -0.19 1 86 ALA -5.74 0.42 1 87 LEU -3.92 0.86 1 88 TRP -4.58 0.24 1 90 ARG -6.93 1.42 1 91 VAL 1.78 0.26 1 92 THR 1.19 0.06 1 93 LYS -4.69 0.29 1 94 VAL 2.89 -0.05 1 95 VAL -3.06 0.21 1 97 SER 3.17 -1.03 1 100 LEU 0.08 0.36 1 101 LEU -2.20 0.59 1 102 TYR -3.85 0.21 1 103 VAL -7.24 1.17 1 104 ARG -6.29 0.84 1 105 LEU 0.79 0.26 1 106 VAL 1.42 -0.02 1 107 THR -0.50 0.01 1 108 GLU -1.61 0.08 1 112 ALA -0.08 -0.03 1 121 VAL -0.11 -0.01 1 122 GLU -0.30 -0.01 1 126 LEU -0.42 0.02 1 127 ALA -1.21 0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19988_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -2.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 4.30 _LACS_plot.Line_2_terminator_val_y_2 0.94 _LACS_plot.Y_axis_chem_shift_offset 0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 GLN -1.97 1.67 0 84 ASP 4.31 -1.23 0 103 VAL -7.24 -4.30 0 29 LEU 2.26 -2.50 0 10 LEU -2.24 -1.76 1 11 ALA -4.89 -2.68 1 12 LEU -2.73 -0.94 1 13 GLN -2.10 -0.57 1 14 ASP 2.76 -0.23 1 16 GLN -3.57 -0.91 1 17 ARG 1.17 -0.60 1 19 VAL -0.88 -1.93 1 20 ARG -6.83 -1.85 1 21 ALA 0.37 1.10 1 22 ARG 1.72 -1.05 1 23 LEU -3.11 -3.49 1 24 SER 1.19 0.20 1 25 LEU -2.61 -1.29 1 26 THR -2.10 -1.47 1 27 GLU 2.30 0.94 1 30 SER -5.02 -2.14 1 31 TRP -2.84 -2.15 1 34 PHE -3.48 -1.24 1 35 TYR 1.04 -0.64 1 37 SER -3.10 -2.71 1 38 ILE -0.88 -0.65 1 39 GLN -3.37 -0.78 1 40 THR -0.61 -0.25 1 41 ARG -0.36 -0.51 1 42 ALA 0.08 -0.36 1 43 LEU -0.29 -0.51 1 44 SER -1.22 0.39 1 46 GLU 0.84 -0.34 1 47 ARG 2.87 1.04 1 53 ALA 0.80 -0.56 1 54 VAL -3.05 -1.06 1 55 THR -3.31 -2.50 1 56 LEU -1.84 -2.68 1 57 MET 0.94 -1.97 1 58 VAL -7.15 -1.15 1 59 ASP -0.41 1.09 1 60 GLU 3.26 0.41 1 61 SER 0.19 -0.34 1 63 TRP 3.91 0.56 1 64 LEU 2.40 1.45 1 65 ARG 2.65 0.21 1 66 MET -0.33 0.03 1 67 LEU -0.96 -1.28 1 70 VAL -4.97 0.04 1 71 LEU -0.74 0.51 1 72 THR -4.28 -0.41 1 73 GLU 3.09 2.30 1 74 GLU 3.76 0.64 1 75 ALA -0.54 -0.61 1 76 ALA -3.14 -0.87 1 77 ASN -1.29 1.77 1 78 SER -3.19 -0.60 1 79 GLU -5.89 -1.74 1 80 ILE -3.51 -3.28 1 81 TYR -5.84 -3.94 1 82 ARG -3.00 -0.05 1 83 LYS -1.58 -1.03 1 85 ASP 1.81 -2.14 1 86 ALA -5.74 -3.03 1 87 LEU -3.92 -1.87 1 88 TRP -4.58 -2.39 1 90 ARG -6.93 -1.39 1 91 VAL 1.78 1.93 1 92 THR 1.19 -0.42 1 93 LYS -4.69 -3.94 1 94 VAL 2.89 0.74 1 95 VAL -3.06 -1.64 1 97 SER 3.17 1.70 1 100 LEU 0.08 0.03 1 101 LEU -2.20 -2.31 1 102 TYR -3.85 -0.45 1 104 ARG -6.29 -0.90 1 105 LEU 0.79 -1.90 1 106 VAL 1.42 -0.58 1 107 THR -0.50 -0.15 1 121 VAL -0.11 -0.41 1 122 GLU -0.30 -0.25 1 126 LEU -0.42 -0.72 1 stop_ save_