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 bmr6267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.58 _LACS_plot.Line_2_terminator_val_x_2 9.16 _LACS_plot.Line_2_terminator_val_y_2 6.97 _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 55 ASP -1.61 2.58 0 76 HIS -3.42 1.49 0 10 ILE -2.62 -1.19 1 11 ILE -5.80 -2.09 1 12 VAL -0.21 -1.27 1 13 ALA -7.56 -2.42 1 14 SER -6.63 -2.17 1 15 ASP 4.61 5.41 1 16 ALA -0.57 -0.28 1 18 MET -3.51 -0.73 1 20 SER 5.14 4.04 1 21 SER 6.29 3.95 1 22 ALA 3.34 2.17 1 23 MET 3.26 2.61 1 25 ALA 3.87 2.74 1 27 VAL 4.89 3.71 1 28 LEU 5.31 2.59 1 29 ARG 4.59 4.20 1 30 LYS 4.03 2.74 1 31 LYS 4.46 3.57 1 32 ILE 4.71 3.26 1 33 GLN 4.81 3.30 1 34 ASP 4.12 2.73 1 35 ALA 0.02 -0.25 1 37 LEU 0.79 -1.90 1 38 SER 1.99 1.79 1 39 GLN 2.05 0.53 1 40 ILE 0.14 -0.23 1 41 SER -2.69 -1.72 1 42 VAL -2.38 -1.34 1 43 THR -4.18 -2.12 1 44 ASN -4.46 -1.79 1 45 SER -4.03 -0.76 1 46 ALA -0.67 -0.73 1 47 ILE 4.55 3.17 1 48 ASN 2.89 1.34 1 49 ASN -2.23 -1.50 1 50 LEU 0.23 0.29 1 53 ASP -0.54 -1.97 1 54 VAL -0.21 -0.64 1 56 LEU -4.29 -1.06 1 57 VAL -2.26 -2.23 1 58 ILE -2.37 -1.25 1 59 THR -6.56 -3.11 1 60 HIS -0.25 2.57 1 61 ARG 3.32 2.80 1 62 ASP 4.28 2.94 1 63 LEU -1.60 -0.46 1 64 THR 5.61 4.90 1 65 GLU 5.17 3.73 1 66 ARG 3.77 3.27 1 67 ALA 3.72 3.07 1 68 MET 3.94 3.41 1 69 ARG 2.82 2.12 1 70 GLN 2.76 2.17 1 71 VAL -1.48 -1.62 1 73 GLN 2.21 0.59 1 74 ALA -2.01 -1.12 1 75 GLN -0.94 -0.14 1 77 ILE -3.70 -0.95 1 78 SER -3.51 -1.65 1 79 LEU -3.51 -2.09 1 80 THR 0.34 0.16 1 81 ASN -2.69 -1.40 1 82 PHE 3.43 3.57 1 83 LEU 0.77 -1.68 1 84 ASP 0.41 -0.65 1 85 SER 4.10 3.48 1 87 LEU 4.12 2.54 1 88 TYR 2.89 1.18 1 89 THR 7.71 5.72 1 90 SER 4.72 3.41 1 91 LEU 3.29 2.94 1 92 THR 9.16 7.20 1 93 GLU 3.96 3.21 1 94 ARG 3.60 3.28 1 95 LEU 3.70 3.23 1 96 VAL 5.50 4.72 1 97 ALA 3.22 2.19 1 98 ALA 0.81 0.88 1 99 GLN 1.68 0.81 1 100 ARG 0.98 0.69 1 101 HIS 0.30 0.93 1 102 THR 0.09 0.22 1 103 ALA 0.46 0.43 1 104 ASN 0.78 0.58 1 105 GLU 0.04 0.25 1 106 GLU 0.04 0.20 1 107 LYS 0.45 0.21 1 108 VAL 0.71 0.34 1 109 LYS 0.73 0.50 1 110 ASP 0.34 0.40 1 111 SER 0.55 0.44 1 112 LEU 0.65 0.27 1 113 LYS 0.23 0.20 1 114 ASP 0.00 0.19 1 115 SER -0.51 -0.25 1 116 PHE -0.13 -0.18 1 117 ASP 0.54 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 4.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.42 _LACS_plot.Line_2_terminator_val_x_2 9.16 _LACS_plot.Line_2_terminator_val_y_2 -2.19 _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 55 ASP -1.61 4.19 0 76 HIS -3.42 4.91 0 10 ILE -2.62 1.43 1 11 ILE -5.80 3.71 1 12 VAL -0.21 -1.06 1 13 ALA -7.56 5.14 1 14 SER -6.63 4.46 1 15 ASP 4.61 0.80 1 16 ALA -0.57 0.29 1 18 MET -3.51 2.78 1 20 SER 5.14 -1.10 1 21 SER 6.29 -2.34 1 22 ALA 3.34 -1.17 1 23 MET 3.26 -0.65 1 25 ALA 3.87 -1.13 1 27 VAL 4.89 -1.18 1 28 LEU 5.31 -2.72 1 29 ARG 4.59 -0.39 1 30 LYS 4.03 -1.29 1 31 LYS 4.46 -0.89 1 32 ILE 4.71 -1.45 1 33 GLN 4.81 -1.51 1 34 ASP 4.12 -1.39 1 35 ALA 0.02 -0.27 1 37 LEU 0.79 -2.69 1 38 SER 1.99 -0.20 1 39 GLN 2.05 -1.52 1 40 ILE 0.14 -0.37 1 41 SER -2.69 0.97 1 42 VAL -2.38 1.04 1 43 THR -4.18 2.06 1 44 ASN -4.46 2.67 1 45 SER -4.03 3.27 1 46 ALA -0.67 -0.06 1 47 ILE 4.55 -1.38 1 48 ASN 2.89 -1.55 1 49 ASN -2.23 0.73 1 50 LEU 0.23 0.06 1 53 ASP -0.54 -1.43 1 54 VAL -0.21 -0.43 1 56 LEU -4.29 3.23 1 57 VAL -2.26 0.03 1 58 ILE -2.37 1.12 1 59 THR -6.56 3.45 1 60 HIS -0.25 2.82 1 61 ARG 3.32 -0.52 1 62 ASP 4.28 -1.34 1 63 LEU -1.60 1.14 1 64 THR 5.61 -0.71 1 65 GLU 5.17 -1.44 1 66 ARG 3.77 -0.50 1 67 ALA 3.72 -0.65 1 68 MET 3.94 -0.53 1 69 ARG 2.82 -0.70 1 70 GLN 2.76 -0.59 1 71 VAL -1.48 -0.14 1 73 GLN 2.21 -1.62 1 74 ALA -2.01 0.89 1 75 GLN -0.94 0.80 1 77 ILE -3.70 2.75 1 78 SER -3.51 1.86 1 79 LEU -3.51 1.42 1 80 THR 0.34 -0.18 1 81 ASN -2.69 1.29 1 82 PHE 3.43 0.14 1 83 LEU 0.77 -2.45 1 84 ASP 0.41 -1.06 1 85 SER 4.10 -0.62 1 87 LEU 4.12 -1.58 1 88 TYR 2.89 -1.71 1 89 THR 7.71 -1.99 1 90 SER 4.72 -1.31 1 91 LEU 3.29 -0.35 1 92 THR 9.16 -1.96 1 93 GLU 3.96 -0.75 1 94 ARG 3.60 -0.32 1 95 LEU 3.70 -0.47 1 96 VAL 5.50 -0.78 1 97 ALA 3.22 -1.03 1 98 ALA 0.81 0.07 1 99 GLN 1.68 -0.87 1 100 ARG 0.98 -0.29 1 101 HIS 0.30 0.63 1 102 THR 0.09 0.13 1 103 ALA 0.46 -0.03 1 104 ASN 0.78 -0.20 1 105 GLU 0.04 0.21 1 106 GLU 0.04 0.16 1 107 LYS 0.45 -0.24 1 108 VAL 0.71 -0.37 1 109 LYS 0.73 -0.23 1 110 ASP 0.34 0.06 1 111 SER 0.55 -0.11 1 112 LEU 0.65 -0.38 1 113 LYS 0.23 -0.03 1 114 ASP 0.00 0.19 1 115 SER -0.51 0.26 1 116 PHE -0.13 -0.05 1 117 ASP 0.54 1.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 0.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 9.16 _LACS_plot.Line_2_terminator_val_y_2 -0.87 _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 44 ASN -4.46 1.52 0 13 ALA -7.56 1.72 0 68 MET 3.94 -1.39 0 10 ILE -2.62 0.89 1 11 ILE -5.80 0.88 1 12 VAL -0.21 0.75 1 14 SER -6.63 0.38 1 15 ASP 4.61 -0.19 1 16 ALA -0.57 0.30 1 18 MET -3.51 0.27 1 20 SER 5.14 -0.44 1 21 SER 6.29 -0.99 1 22 ALA 3.34 -0.56 1 23 MET 3.26 -0.29 1 25 ALA 3.87 -0.68 1 27 VAL 4.89 -0.48 1 28 LEU 5.31 -0.73 1 29 ARG 4.59 -0.80 1 30 LYS 4.03 -0.23 1 31 LYS 4.46 -0.25 1 32 ILE 4.71 -0.53 1 33 GLN 4.81 -0.41 1 34 ASP 4.12 -0.29 1 35 ALA 0.02 -0.01 1 37 LEU 0.79 0.37 1 38 SER 1.99 -0.29 1 39 GLN 2.05 0.00 1 40 ILE 0.14 0.37 1 41 SER -2.69 0.25 1 42 VAL -2.38 1.00 1 43 THR -4.18 0.35 1 45 SER -4.03 0.20 1 46 ALA -0.67 0.39 1 47 ILE 4.55 -0.73 1 48 ASN 2.89 -0.36 1 49 ASN -2.23 0.28 1 50 LEU 0.23 -0.45 1 53 ASP -0.54 -0.05 1 54 VAL -0.21 -0.33 1 55 ASP -1.61 0.28 1 56 LEU -4.29 0.87 1 57 VAL -2.26 0.91 1 58 ILE -2.37 1.09 1 59 THR -6.56 0.69 1 60 HIS -0.25 -0.33 1 61 ARG 3.32 -0.11 1 62 ASP 4.28 -0.03 1 63 LEU -1.60 0.44 1 64 THR 5.61 -0.39 1 65 GLU 5.17 -0.48 1 66 ARG 3.77 -0.42 1 67 ALA 3.72 -0.45 1 69 ARG 2.82 -0.36 1 70 GLN 2.76 -0.28 1 71 VAL -1.48 0.24 1 73 GLN 2.21 0.03 1 74 ALA -2.01 0.05 1 75 GLN -0.94 0.13 1 76 HIS -3.42 0.47 1 77 ILE -3.70 0.18 1 78 SER -3.51 1.16 1 79 LEU -3.51 0.32 1 80 THR 0.34 -0.35 1 81 ASN -2.69 0.19 1 82 PHE 3.43 -0.40 1 83 LEU 0.77 0.34 1 84 ASP 0.41 -0.21 1 85 SER 4.10 -0.39 1 87 LEU 4.12 -0.26 1 88 TYR 2.89 -0.18 1 89 THR 7.71 -0.43 1 90 SER 4.72 -0.21 1 91 LEU 3.29 -0.30 1 92 THR 9.16 -0.81 1 93 GLU 3.96 -0.44 1 94 ARG 3.60 -0.24 1 95 LEU 3.70 -0.42 1 96 VAL 5.50 -0.63 1 97 ALA 3.22 -0.25 1 98 ALA 0.81 -0.07 1 99 GLN 1.68 -0.03 1 100 ARG 0.98 -0.05 1 101 HIS 0.30 0.02 1 102 THR 0.09 -0.05 1 103 ALA 0.46 -0.02 1 104 ASN 0.78 -0.11 1 105 GLU 0.04 -0.13 1 106 GLU 0.04 -0.14 1 107 LYS 0.45 -0.04 1 108 VAL 0.71 -0.08 1 109 LYS 0.73 -0.07 1 110 ASP 0.34 -0.07 1 111 SER 0.55 -0.10 1 112 LEU 0.65 -0.01 1 113 LYS 0.23 -0.05 1 114 ASP 0.00 -0.09 1 115 SER -0.51 -0.10 1 116 PHE -0.13 0.04 1 117 ASP 0.54 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.56 _LACS_plot.Line_1_terminator_val_y_1 -2.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _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 9.16 _LACS_plot.Line_2_terminator_val_y_2 3.07 _LACS_plot.Y_axis_chem_shift_offset 0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 GLN 4.81 5.40 0 117 ASP 0.54 4.50 0 46 ALA -0.67 4.20 0 10 ILE -2.62 -1.20 1 11 ILE -5.80 -2.10 1 12 VAL -0.21 -1.20 1 13 ALA -7.56 -1.20 1 14 SER -6.63 -2.20 1 15 ASP 4.61 0.40 1 16 ALA -0.57 1.10 1 18 MET -3.51 -0.20 1 20 SER 5.14 0.70 1 21 SER 6.29 2.10 1 22 ALA 3.34 2.90 1 23 MET 3.26 3.40 1 25 ALA 3.87 0.80 1 27 VAL 4.89 2.30 1 28 LEU 5.31 -0.60 1 29 ARG 4.59 1.50 1 30 LYS 4.03 1.30 1 31 LYS 4.46 3.30 1 32 ILE 4.71 1.50 1 34 ASP 4.12 1.40 1 35 ALA 0.02 -0.30 1 37 LEU 0.79 -0.50 1 38 SER 1.99 0.50 1 39 GLN 2.05 -0.90 1 40 ILE 0.14 -1.20 1 41 SER -2.69 -1.20 1 42 VAL -2.38 -0.50 1 43 THR -4.18 -3.00 1 44 ASN -4.46 -1.30 1 45 SER -4.03 -1.60 1 47 ILE 4.55 0.20 1 48 ASN 2.89 -0.10 1 49 ASN -2.23 -0.30 1 50 LEU 0.23 -1.60 1 53 ASP -0.54 -0.90 1 54 VAL -0.21 -3.40 1 55 ASP -1.61 0.30 1 56 LEU -4.29 -4.60 1 57 VAL -2.26 -1.20 1 58 ILE -2.37 -1.50 1 59 THR -6.56 -0.80 1 60 HIS -0.25 3.40 1 61 ARG 3.32 1.10 1 62 ASP 4.28 0.80 1 63 LEU -1.60 0.20 1 64 THR 5.61 0.60 1 65 GLU 5.17 2.40 1 66 ARG 3.77 3.30 1 67 ALA 3.72 0.80 1 68 MET 3.94 0.90 1 69 ARG 2.82 1.70 1 70 GLN 2.76 0.80 1 71 VAL -1.48 -1.10 1 73 GLN 2.21 0.40 1 74 ALA -2.01 -1.60 1 75 GLN -0.94 -1.10 1 76 HIS -3.42 1.40 1 77 ILE -3.70 -2.70 1 78 SER -3.51 -1.60 1 79 LEU -3.51 -1.00 1 80 THR 0.34 -1.10 1 81 ASN -2.69 0.20 1 82 PHE 3.43 0.70 1 83 LEU 0.77 -1.20 1 84 ASP 0.41 -2.00 1 85 SER 4.10 2.50 1 87 LEU 4.12 2.00 1 88 TYR 2.89 3.20 1 89 THR 7.71 0.90 1 90 SER 4.72 2.50 1 91 LEU 3.29 0.30 1 92 THR 9.16 1.10 1 93 GLU 3.96 3.40 1 94 ARG 3.60 3.50 1 95 LEU 3.70 1.50 1 96 VAL 5.50 2.60 1 97 ALA 3.22 1.80 1 98 ALA 0.81 0.90 1 99 GLN 1.68 0.60 1 100 ARG 0.98 -0.10 1 101 HIS 0.30 1.10 1 102 THR 0.09 -0.20 1 103 ALA 0.46 0.00 1 104 ASN 0.78 0.30 1 105 GLU 0.04 0.00 1 106 GLU 0.04 0.00 1 107 LYS 0.45 0.20 1 108 VAL 0.71 0.10 1 109 LYS 0.73 -0.20 1 110 ASP 0.34 0.10 1 111 SER 0.55 0.10 1 112 LEU 0.65 -0.10 1 113 LYS 0.23 -0.40 1 114 ASP 0.00 -0.50 1 115 SER -0.51 -0.70 1 116 PHE -0.13 -1.10 1 stop_ save_