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 bmr10099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.04 _LACS_plot.Line_1_terminator_val_y_1 -2.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _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 4.11 _LACS_plot.Line_2_terminator_val_y_2 2.48 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 THR 1.52 -1.92 0 10 TYR 0.40 0.36 1 11 ASP -0.41 0.04 1 12 LEU 0.81 0.37 1 13 SER 0.36 0.45 1 14 ASP 0.04 0.39 1 15 LEU 0.95 0.17 1 20 SER -0.78 -0.02 1 21 LYS -1.97 0.22 1 23 GLN -3.16 -1.71 1 24 VAL 0.03 -0.31 1 25 THR -0.79 -0.67 1 26 ASP -0.74 0.66 1 27 VAL -0.55 0.64 1 28 THR -2.51 -1.15 1 29 LYS 2.66 2.12 1 30 ASN -3.03 -1.12 1 31 SER -5.04 -1.16 1 32 VAL -5.07 -1.27 1 33 THR 0.92 0.75 1 34 LEU -7.03 -2.28 1 35 SER -4.72 -2.45 1 36 TRP -1.68 -0.78 1 37 GLN -2.62 -1.65 1 40 THR 1.67 0.87 1 43 THR 3.57 2.90 1 44 LEU -2.02 -1.19 1 46 ALA 0.27 0.13 1 47 SER 0.13 0.63 1 48 ALA -3.99 -1.38 1 49 TYR -4.46 -0.85 1 50 ILE -4.84 -1.68 1 51 ILE -2.05 -0.87 1 52 GLU -6.60 -2.04 1 53 ALA -9.04 -2.18 1 54 PHE -3.19 -1.76 1 55 SER -2.26 -1.47 1 56 GLN 2.98 2.27 1 57 SER 2.13 1.47 1 58 VAL 1.58 1.66 1 59 SER -0.45 -0.63 1 60 ASN 1.06 0.57 1 61 SER -2.79 -1.14 1 62 TRP 2.09 1.71 1 63 GLN -4.58 -1.75 1 64 THR 4.12 2.91 1 65 VAL -0.85 -1.02 1 66 ALA -2.87 0.70 1 67 ASN -3.45 -1.58 1 68 HIS 3.39 2.17 1 69 VAL 1.66 1.24 1 70 LYS 0.70 0.61 1 71 THR -2.83 -2.24 1 73 LEU -3.72 -0.97 1 74 TYR -4.22 1.06 1 75 THR 0.79 0.37 1 76 VAL 0.80 0.15 1 77 ARG -2.55 -1.38 1 79 LEU -0.35 -1.56 1 80 ARG -0.95 0.20 1 82 ASN 1.12 0.57 1 83 THR -0.89 1.18 1 84 ILE 0.64 -0.31 1 85 TYR -6.77 -0.20 1 86 LEU -5.49 -0.90 1 87 PHE -5.49 -0.68 1 88 MET -3.41 0.46 1 89 VAL -4.72 -2.25 1 90 ARG -5.12 -1.73 1 91 ALA -4.80 -1.72 1 92 ILE -3.63 -1.05 1 93 ASN -1.23 0.22 1 95 GLN 0.42 0.61 1 97 LEU -4.49 -1.71 1 98 SER -3.22 0.00 1 99 ASP 3.52 1.71 1 101 SER 0.41 0.98 1 103 MET -0.58 0.98 1 104 SER -0.82 0.58 1 105 ASP 3.83 1.96 1 107 VAL -4.51 -2.15 1 108 ARG -4.45 -2.54 1 109 THR 0.97 -0.23 1 110 GLN -0.62 -0.06 1 111 ASP -1.31 -0.32 1 112 SER 0.01 0.34 1 115 SER 0.01 0.10 1 116 SER -0.53 0.06 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.04 _LACS_plot.Line_1_terminator_val_y_1 6.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.25 _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 4.11 _LACS_plot.Line_2_terminator_val_y_2 -1.63 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 THR 1.52 -3.44 0 10 TYR 0.40 -0.04 1 11 ASP -0.41 0.45 1 12 LEU 0.81 -0.44 1 13 SER 0.36 0.09 1 14 ASP 0.04 0.35 1 15 LEU 0.95 -0.78 1 20 SER -0.78 0.76 1 21 LYS -1.97 2.19 1 23 GLN -3.16 1.45 1 24 VAL 0.03 -0.34 1 25 THR -0.79 0.12 1 26 ASP -0.74 1.40 1 27 VAL -0.55 1.19 1 28 THR -2.51 1.36 1 29 LYS 2.66 -0.54 1 30 ASN -3.03 1.91 1 31 SER -5.04 3.88 1 32 VAL -5.07 3.80 1 33 THR 0.92 -0.17 1 34 LEU -7.03 4.75 1 35 SER -4.72 2.27 1 36 TRP -1.68 0.90 1 37 GLN -2.62 0.97 1 40 THR 1.67 -0.80 1 43 THR 3.57 -0.67 1 44 LEU -2.02 0.83 1 46 ALA 0.27 -0.14 1 47 SER 0.13 0.50 1 48 ALA -3.99 2.61 1 49 TYR -4.46 3.61 1 50 ILE -4.84 3.16 1 51 ILE -2.05 1.18 1 52 GLU -6.60 4.56 1 53 ALA -9.04 6.86 1 54 PHE -3.19 1.43 1 55 SER -2.26 0.79 1 56 GLN 2.98 -0.71 1 57 SER 2.13 -0.66 1 58 VAL 1.58 0.08 1 59 SER -0.45 -0.18 1 60 ASN 1.06 -0.49 1 61 SER -2.79 1.65 1 62 TRP 2.09 -0.38 1 63 GLN -4.58 2.83 1 64 THR 4.12 -1.21 1 65 VAL -0.85 -0.17 1 66 ALA -2.87 3.57 1 67 ASN -3.45 1.87 1 68 HIS 3.39 -1.22 1 69 VAL 1.66 -0.42 1 70 LYS 0.70 -0.09 1 71 THR -2.83 0.59 1 73 LEU -3.72 2.75 1 74 TYR -4.22 5.28 1 75 THR 0.79 -0.42 1 76 VAL 0.80 -0.65 1 77 ARG -2.55 1.17 1 79 LEU -0.35 -1.21 1 80 ARG -0.95 1.15 1 82 ASN 1.12 -0.55 1 83 THR -0.89 2.07 1 84 ILE 0.64 -0.95 1 85 TYR -6.77 6.57 1 86 LEU -5.49 4.59 1 87 PHE -5.49 4.81 1 88 MET -3.41 3.87 1 89 VAL -4.72 2.47 1 90 ARG -5.12 3.39 1 91 ALA -4.80 3.08 1 92 ILE -3.63 2.58 1 93 ASN -1.23 1.45 1 95 GLN 0.42 0.19 1 97 LEU -4.49 2.78 1 98 SER -3.22 3.22 1 99 ASP 3.52 -1.81 1 101 SER 0.41 0.57 1 103 MET -0.58 1.56 1 104 SER -0.82 1.40 1 105 ASP 3.83 -1.87 1 107 VAL -4.51 2.36 1 108 ARG -4.45 1.91 1 109 THR 0.97 -1.20 1 110 GLN -0.62 0.56 1 111 ASP -1.31 0.99 1 112 SER 0.01 0.33 1 115 SER 0.01 0.09 1 116 SER -0.53 0.59 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.04 _LACS_plot.Line_1_terminator_val_y_1 1.03 _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 0.21 _LACS_plot.Line_2_terminator_val_x_2 4.11 _LACS_plot.Line_2_terminator_val_y_2 -0.38 _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 72 THR 1.52 -1.39 0 10 TYR 0.40 0.01 1 11 ASP -0.41 -0.02 1 12 LEU 0.81 -0.02 1 13 SER 0.36 -0.07 1 14 ASP 0.04 0.06 1 15 LEU 0.95 -0.31 1 20 SER -0.78 0.03 1 21 LYS -1.97 -0.34 1 23 GLN -3.16 0.14 1 24 VAL 0.03 0.59 1 25 THR -0.79 0.21 1 26 ASP -0.74 -0.06 1 27 VAL -0.55 0.45 1 28 THR -2.51 0.59 1 29 LYS 2.66 0.00 1 30 ASN -3.03 0.05 1 31 SER -5.04 1.08 1 32 VAL -5.07 0.50 1 33 THR 0.92 0.62 1 34 LEU -7.03 1.20 1 35 SER -4.72 0.79 1 36 TRP -1.68 0.31 1 37 GLN -2.62 0.25 1 40 THR 1.67 -0.25 1 43 THR 3.57 -0.32 1 44 LEU -2.02 0.11 1 46 ALA 0.27 -0.02 1 47 SER 0.13 0.03 1 48 ALA -3.99 0.28 1 49 TYR -4.46 0.88 1 50 ILE -4.84 0.49 1 51 ILE -2.05 0.53 1 52 GLU -6.60 1.25 1 53 ALA -9.04 1.49 1 54 PHE -3.19 -0.43 1 55 SER -2.26 -0.33 1 56 GLN 2.98 -0.50 1 57 SER 2.13 -0.27 1 58 VAL 1.58 -0.21 1 59 SER -0.45 -0.01 1 60 ASN 1.06 -0.17 1 61 SER -2.79 0.38 1 62 TRP 2.09 -0.18 1 63 GLN -4.58 0.51 1 64 THR 4.12 0.14 1 65 VAL -0.85 0.55 1 66 ALA -2.87 0.28 1 67 ASN -3.45 0.25 1 68 HIS 3.39 -0.74 1 69 VAL 1.66 -0.14 1 70 LYS 0.70 0.42 1 71 THR -2.83 0.35 1 73 LEU -3.72 0.57 1 74 TYR -4.22 0.04 1 75 THR 0.79 0.37 1 76 VAL 0.80 -0.19 1 77 ARG -2.55 0.47 1 79 LEU -0.35 -0.07 1 80 ARG -0.95 -0.03 1 82 ASN 1.12 -0.34 1 83 THR -0.89 -0.06 1 84 ILE 0.64 0.60 1 85 TYR -6.77 0.56 1 86 LEU -5.49 0.18 1 87 PHE -5.49 1.54 1 88 MET -3.41 -0.12 1 89 VAL -4.72 0.85 1 90 ARG -5.12 0.12 1 91 ALA -4.80 0.49 1 92 ILE -3.63 0.57 1 93 ASN -1.23 -0.09 1 95 GLN 0.42 -0.05 1 97 LEU -4.49 0.74 1 98 SER -3.22 -0.09 1 99 ASP 3.52 -0.23 1 101 SER 0.41 -0.21 1 103 MET -0.58 0.19 1 104 SER -0.82 -0.22 1 105 ASP 3.83 -0.04 1 107 VAL -4.51 0.46 1 108 ARG -4.45 0.95 1 109 THR 0.97 -0.20 1 110 GLN -0.62 -0.05 1 111 ASP -1.31 0.10 1 112 SER 0.01 -0.07 1 115 SER 0.01 0.06 1 116 SER -0.53 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10099_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.04 _LACS_plot.Line_1_terminator_val_y_1 -2.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.96 _LACS_plot.Line_2_terminator_val_x_2 3.82 _LACS_plot.Line_2_terminator_val_y_2 0.29 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 ALA -9.04 -1.57 0 10 TYR 0.40 -0.31 1 11 ASP -0.41 -0.07 1 12 LEU 0.81 0.03 1 13 SER 0.36 -0.44 1 14 ASP 0.04 -0.10 1 15 LEU 0.95 -1.25 1 23 GLN -3.16 -0.62 1 24 VAL 0.03 0.85 1 25 THR -0.79 -0.68 1 27 VAL -0.55 -0.66 1 28 THR -2.51 0.43 1 29 LYS 2.66 -2.22 1 31 SER -5.04 -3.35 1 32 VAL -5.07 -2.19 1 33 THR 0.92 -2.46 1 34 LEU -7.03 -2.39 1 35 SER -4.72 -0.83 1 36 TRP -1.68 -3.47 1 37 GLN -2.62 -0.38 1 40 THR 1.67 0.43 1 46 ALA 0.27 -0.04 1 50 ILE -4.84 -1.99 1 51 ILE -2.05 -1.34 1 52 GLU -6.60 -1.81 1 54 PHE -3.19 -1.59 1 55 SER -2.26 0.73 1 56 GLN 2.98 0.30 1 57 SER 2.13 -0.63 1 58 VAL 1.58 -0.71 1 59 SER -0.45 -1.19 1 61 SER -2.79 -0.73 1 62 TRP 2.09 0.54 1 63 GLN -4.58 0.06 1 66 ALA -2.87 -3.25 1 67 ASN -3.45 -1.55 1 69 VAL 1.66 1.19 1 70 LYS 0.70 -0.11 1 71 THR -2.83 -3.50 1 73 LEU -3.72 -1.13 1 74 TYR -4.22 -2.93 1 75 THR 0.79 -2.77 1 76 VAL 0.80 -1.77 1 77 ARG -2.55 -0.24 1 80 ARG -0.95 1.73 1 83 THR -0.89 -3.28 1 84 ILE 0.64 -0.46 1 85 TYR -6.77 -1.06 1 86 LEU -5.49 -2.35 1 87 PHE -5.49 -0.64 1 88 MET -3.41 -3.77 1 89 VAL -4.72 -1.39 1 90 ARG -5.12 -1.97 1 91 ALA -4.80 -2.25 1 92 ILE -3.63 -2.04 1 93 ASN -1.23 0.49 1 95 GLN 0.42 -0.11 1 97 LEU -4.49 -0.13 1 98 SER -3.22 0.12 1 104 SER -0.82 -1.04 1 105 ASP 3.83 -0.21 1 107 VAL -4.51 -4.06 1 108 ARG -4.45 0.68 1 109 THR 0.97 0.87 1 110 GLN -0.62 -1.30 1 111 ASP -1.31 -0.02 1 112 SER 0.01 0.15 1 115 SER 0.01 0.05 1 116 SER -0.53 -0.63 1 stop_ save_