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 bmr25171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.30 _LACS_plot.Line_1_terminator_val_y_1 -1.41 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.11 _LACS_plot.Line_2_terminator_val_x_2 8.42 _LACS_plot.Line_2_terminator_val_y_2 6.51 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 85 MET 4.97 6.05 0 77 ARG -0.41 -2.17 0 35 LEU -0.58 -2.34 0 10 LYS 0.09 0.08 1 11 LYS 0.29 0.26 1 12 VAL 0.22 0.13 1 13 GLU -0.95 -0.27 1 14 LYS 0.64 0.45 1 21 ASP 4.23 4.20 1 22 SER 4.27 3.30 1 23 ARG 4.32 3.87 1 24 LEU 4.86 3.05 1 25 GLN 4.86 3.87 1 26 ARG 6.04 3.84 1 27 ILE 4.76 4.73 1 28 HIS 2.35 3.14 1 29 ALA 3.98 2.79 1 30 GLU 1.78 2.59 1 31 ILE 5.49 5.43 1 32 LYS 5.26 3.88 1 33 ASN 2.60 2.61 1 34 SER 4.22 3.49 1 36 LYS 0.50 0.60 1 37 ILE 3.27 3.35 1 39 ASN -0.56 0.09 1 40 LEU 0.41 1.17 1 41 ASP -1.79 -1.92 1 42 VAL 5.23 4.51 1 43 ASN 4.93 3.70 1 44 ARG 2.77 2.82 1 46 ILE 6.72 5.96 1 47 GLU 3.90 3.46 1 48 ALA 3.44 2.88 1 49 LEU 3.92 2.88 1 50 ASP 4.93 3.16 1 51 GLU 4.46 3.26 1 52 LEU 4.41 3.04 1 53 ALA 2.25 1.97 1 54 SER 0.40 1.13 1 55 LEU -1.34 -0.47 1 56 GLN 1.20 -0.70 1 57 VAL -1.65 -0.64 1 58 THR -3.30 -1.48 1 59 MET 4.63 4.12 1 60 GLN 5.35 3.89 1 61 GLN 3.48 2.75 1 62 ALA 3.32 2.89 1 63 GLN 3.63 2.83 1 64 LYS 1.24 0.94 1 65 HIS -0.33 0.72 1 66 THR 5.63 4.19 1 67 GLU 4.88 3.24 1 68 MET 3.07 2.70 1 69 ILE 6.49 4.46 1 70 THR 6.66 5.19 1 71 THR 8.42 5.50 1 72 LEU 3.06 2.89 1 73 LYS 2.93 3.07 1 74 LYS 3.14 2.74 1 75 ILE 5.05 3.13 1 76 ARG 2.79 2.87 1 78 PHE -0.10 -1.05 1 79 LYS 2.61 2.04 1 80 VAL 2.27 1.40 1 81 SER -2.98 -2.40 1 82 GLN 4.54 3.41 1 83 VAL 4.74 3.95 1 84 ILE 6.18 5.18 1 86 GLU 3.58 3.60 1 87 LYS 3.05 4.33 1 89 THR 8.22 6.98 1 90 MET 4.90 4.01 1 91 LEU 1.41 2.94 1 92 TYR 5.21 5.25 1 93 ASN 4.09 2.83 1 94 LYS 4.43 3.58 1 95 PHE 4.47 3.75 1 96 LYS 4.91 3.68 1 97 ASN 3.22 2.67 1 98 MET 2.78 3.24 1 99 PHE 1.41 1.55 1 100 LEU 1.37 1.06 1 101 VAL 1.24 0.92 1 103 GLU -0.46 0.16 1 105 ASP 0.06 0.39 1 106 SER 0.31 0.45 1 107 VAL 0.94 0.61 1 108 ILE 0.56 0.27 1 109 THR 0.46 0.42 1 110 GLN -0.00 0.30 1 111 VAL 0.69 0.45 1 112 LEU -0.22 -0.02 1 113 ASN 0.17 0.32 1 114 LYS 1.01 1.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.30 _LACS_plot.Line_1_terminator_val_y_1 1.89 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 8.42 _LACS_plot.Line_2_terminator_val_y_2 -1.91 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 85 MET 4.97 1.08 0 77 ARG -0.41 -1.76 0 35 LEU -0.58 -1.76 0 10 LYS 0.09 -0.01 1 11 LYS 0.29 -0.03 1 12 VAL 0.22 -0.09 1 13 GLU -0.95 0.68 1 14 LYS 0.64 -0.19 1 21 ASP 4.23 -0.03 1 22 SER 4.27 -0.97 1 23 ARG 4.32 -0.45 1 24 LEU 4.86 -1.81 1 25 GLN 4.86 -0.99 1 26 ARG 6.04 -2.20 1 27 ILE 4.76 -0.03 1 28 HIS 2.35 0.79 1 29 ALA 3.98 -1.19 1 30 GLU 1.78 0.81 1 31 ILE 5.49 -0.06 1 32 LYS 5.26 -1.38 1 33 ASN 2.60 0.01 1 34 SER 4.22 -0.73 1 36 LYS 0.50 0.10 1 37 ILE 3.27 0.08 1 39 ASN -0.56 0.65 1 40 LEU 0.41 0.76 1 41 ASP -1.79 -0.13 1 42 VAL 5.23 -0.72 1 43 ASN 4.93 -1.23 1 44 ARG 2.77 0.05 1 46 ILE 6.72 -0.76 1 47 GLU 3.90 -0.44 1 48 ALA 3.44 -0.56 1 49 LEU 3.92 -1.04 1 50 ASP 4.93 -1.77 1 51 GLU 4.46 -1.20 1 52 LEU 4.41 -1.37 1 53 ALA 2.25 -0.28 1 54 SER 0.40 0.73 1 55 LEU -1.34 0.87 1 56 GLN 1.20 -1.90 1 57 VAL -1.65 1.01 1 58 THR -3.30 1.82 1 59 MET 4.63 -0.51 1 60 GLN 5.35 -1.46 1 61 GLN 3.48 -0.73 1 62 ALA 3.32 -0.43 1 63 GLN 3.63 -0.80 1 64 LYS 1.24 -0.30 1 65 HIS -0.33 1.05 1 66 THR 5.63 -1.44 1 67 GLU 4.88 -1.64 1 68 MET 3.07 -0.37 1 69 ILE 6.49 -2.03 1 70 THR 6.66 -1.47 1 71 THR 8.42 -2.92 1 72 LEU 3.06 -0.17 1 73 LYS 2.93 0.14 1 74 LYS 3.14 -0.40 1 75 ILE 5.05 -1.92 1 76 ARG 2.79 0.08 1 78 PHE -0.10 -0.95 1 79 LYS 2.61 -0.57 1 80 VAL 2.27 -0.87 1 81 SER -2.98 0.58 1 82 GLN 4.54 -1.13 1 83 VAL 4.74 -0.79 1 84 ILE 6.18 -1.00 1 86 GLU 3.58 0.02 1 87 LYS 3.05 1.28 1 89 THR 8.22 -1.24 1 90 MET 4.90 -0.89 1 91 LEU 1.41 1.53 1 92 TYR 5.21 0.04 1 93 ASN 4.09 -1.26 1 94 LYS 4.43 -0.85 1 95 PHE 4.47 -0.72 1 96 LYS 4.91 -1.23 1 97 ASN 3.22 -0.55 1 98 MET 2.78 0.46 1 99 PHE 1.41 0.14 1 100 LEU 1.37 -0.31 1 101 VAL 1.24 -0.32 1 103 GLU -0.46 0.62 1 105 ASP 0.06 0.33 1 106 SER 0.31 0.14 1 107 VAL 0.94 -0.33 1 108 ILE 0.56 -0.29 1 109 THR 0.46 -0.04 1 110 GLN -0.00 0.30 1 111 VAL 0.69 -0.24 1 112 LEU -0.22 0.20 1 113 ASN 0.17 0.15 1 114 LYS 1.01 0.72 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.30 _LACS_plot.Line_1_terminator_val_y_1 0.38 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 8.42 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 LYS 2.93 -1.38 0 10 LYS 0.09 0.00 1 21 ASP 4.23 -0.16 1 24 LEU 4.86 -0.46 1 27 ILE 4.76 -0.53 1 28 HIS 2.35 -0.42 1 29 ALA 3.98 -0.52 1 30 GLU 1.78 -0.37 1 31 ILE 5.49 -0.56 1 32 LYS 5.26 -0.69 1 33 ASN 2.60 -0.31 1 35 LEU -0.58 0.42 1 36 LYS 0.50 0.29 1 37 ILE 3.27 -0.44 1 39 ASN -0.56 0.12 1 40 LEU 0.41 0.04 1 41 ASP -1.79 0.29 1 42 VAL 5.23 -0.53 1 43 ASN 4.93 -0.25 1 44 ARG 2.77 -0.19 1 46 ILE 6.72 -0.76 1 47 GLU 3.90 -0.23 1 48 ALA 3.44 0.13 1 49 LEU 3.92 -0.38 1 50 ASP 4.93 -0.13 1 51 GLU 4.46 -0.33 1 52 LEU 4.41 -0.29 1 53 ALA 2.25 -0.27 1 54 SER 0.40 -0.21 1 55 LEU -1.34 0.09 1 56 GLN 1.20 0.13 1 57 VAL -1.65 0.37 1 58 THR -3.30 0.26 1 59 MET 4.63 -0.52 1 60 GLN 5.35 -0.33 1 61 GLN 3.48 -0.15 1 62 ALA 3.32 -0.49 1 63 GLN 3.63 -0.42 1 64 LYS 1.24 -0.06 1 65 HIS -0.33 0.22 1 66 THR 5.63 -0.54 1 67 GLU 4.88 -0.21 1 68 MET 3.07 -0.19 1 69 ILE 6.49 -0.65 1 70 THR 6.66 -0.45 1 71 THR 8.42 -0.47 1 72 LEU 3.06 -0.40 1 74 LYS 3.14 -0.44 1 75 ILE 5.05 -0.37 1 76 ARG 2.79 -0.08 1 77 ARG -0.41 0.25 1 78 PHE -0.10 0.79 1 79 LYS 2.61 -0.05 1 80 VAL 2.27 -0.51 1 81 SER -2.98 0.46 1 83 VAL 4.74 -0.15 1 84 ILE 6.18 -0.59 1 85 MET 4.97 -0.39 1 86 GLU 3.58 -0.22 1 87 LYS 3.05 -0.10 1 89 THR 8.22 -0.52 1 90 MET 4.90 -0.24 1 91 LEU 1.41 -0.31 1 92 TYR 5.21 -0.40 1 93 ASN 4.09 -0.48 1 94 LYS 4.43 -0.32 1 95 PHE 4.47 -0.16 1 97 ASN 3.22 -0.28 1 98 MET 2.78 -0.36 1 99 PHE 1.41 -0.15 1 100 LEU 1.37 -0.07 1 101 VAL 1.24 -0.03 1 103 GLU -0.46 -0.02 1 105 ASP 0.06 0.02 1 107 VAL 0.94 0.02 1 108 ILE 0.56 0.07 1 109 THR 0.46 -0.05 1 110 GLN -0.00 0.04 1 111 VAL 0.69 -0.03 1 112 LEU -0.22 0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.30 _LACS_plot.Line_1_terminator_val_y_1 -1.68 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.87 _LACS_plot.Line_2_terminator_val_x_2 8.22 _LACS_plot.Line_2_terminator_val_y_2 3.46 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 THR -3.30 0.98 0 114 LYS 1.01 4.55 0 10 LYS 0.09 -0.30 1 11 LYS 0.29 -0.26 1 12 VAL 0.22 -0.36 1 13 GLU -0.95 -0.31 1 14 LYS 0.64 0.04 1 21 ASP 4.23 1.88 1 22 SER 4.27 2.63 1 23 ARG 4.32 2.12 1 24 LEU 4.86 1.99 1 25 GLN 4.86 3.06 1 26 ARG 6.04 2.40 1 27 ILE 4.76 1.18 1 28 HIS 2.35 2.44 1 29 ALA 3.98 1.97 1 30 GLU 1.78 3.46 1 31 ILE 5.49 0.69 1 32 LYS 5.26 2.26 1 33 ASN 2.60 2.92 1 34 SER 4.22 -0.79 1 35 LEU -0.58 -2.03 1 36 LYS 0.50 1.26 1 39 ASN -0.56 -2.18 1 40 LEU 0.41 0.17 1 41 ASP -1.79 -0.65 1 42 VAL 5.23 1.62 1 43 ASN 4.93 2.55 1 44 ARG 2.77 2.23 1 46 ILE 6.72 0.54 1 47 GLU 3.90 3.22 1 48 ALA 3.44 1.74 1 49 LEU 3.92 2.32 1 50 ASP 4.93 3.23 1 51 GLU 4.46 3.91 1 52 LEU 4.41 1.17 1 53 ALA 2.25 0.02 1 54 SER 0.40 -0.38 1 55 LEU -1.34 -0.57 1 56 GLN 1.20 -1.56 1 57 VAL -1.65 -0.19 1 59 MET 4.63 1.40 1 60 GLN 5.35 3.19 1 61 GLN 3.48 2.75 1 62 ALA 3.32 0.97 1 63 GLN 3.63 1.06 1 64 LYS 1.24 0.10 1 65 HIS -0.33 1.91 1 66 THR 5.63 2.64 1 67 GLU 4.88 1.82 1 68 MET 3.07 1.03 1 69 ILE 6.49 1.11 1 72 LEU 3.06 -0.48 1 73 LYS 2.93 3.32 1 74 LYS 3.14 2.56 1 75 ILE 5.05 -0.64 1 76 ARG 2.79 0.62 1 77 ARG -0.41 0.32 1 78 PHE -0.10 -2.83 1 79 LYS 2.61 -0.10 1 80 VAL 2.27 -0.69 1 81 SER -2.98 -1.11 1 82 GLN 4.54 1.83 1 83 VAL 4.74 2.04 1 84 ILE 6.18 3.13 1 85 MET 4.97 2.66 1 86 GLU 3.58 3.41 1 87 LYS 3.05 3.23 1 89 THR 8.22 1.26 1 90 MET 4.90 3.38 1 91 LEU 1.41 0.07 1 92 TYR 5.21 0.77 1 93 ASN 4.09 2.16 1 94 LYS 4.43 2.94 1 95 PHE 4.47 1.49 1 96 LYS 4.91 1.85 1 97 ASN 3.22 1.97 1 98 MET 2.78 0.87 1 99 PHE 1.41 0.51 1 100 LEU 1.37 0.15 1 101 VAL 1.24 0.77 1 103 GLU -0.46 0.51 1 105 ASP 0.06 0.22 1 106 SER 0.31 -0.02 1 107 VAL 0.94 0.03 1 108 ILE 0.56 0.08 1 109 THR 0.46 -0.29 1 110 GLN -0.00 -0.32 1 111 VAL 0.69 -0.35 1 112 LEU -0.22 -0.78 1 113 ASN 0.17 -1.24 1 stop_ save_