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 bmr5912_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 -2.78 _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 -1.38 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 5.47 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 GLU -5.29 -1.76 0 94 ILE -6.21 -4.61 0 10 ARG 4.51 4.36 1 11 VAL 5.50 4.33 1 12 LEU 3.30 3.41 1 13 VAL 4.14 2.19 1 14 LYS 3.68 3.04 1 15 GLN 1.19 0.27 1 16 LYS 4.41 1.10 1 17 LYS 0.44 0.72 1 18 ALA -4.59 -1.55 1 19 SER -1.60 -1.00 1 20 PHE 5.42 4.61 1 21 GLU 3.90 4.04 1 22 GLU 2.91 2.79 1 23 ALA 2.65 2.35 1 24 SER 5.03 3.62 1 25 ASN 4.61 2.95 1 26 GLN 3.68 2.89 1 27 LEU 3.13 3.04 1 28 ILE 5.45 5.04 1 29 ASN 4.34 3.56 1 30 HIS 4.47 5.00 1 31 ILE 6.00 5.37 1 32 GLU 4.60 3.95 1 33 GLN 4.48 3.40 1 34 PHE 1.81 -0.22 1 35 LEU 4.43 3.11 1 36 ASP 2.25 2.10 1 37 THR 1.99 2.37 1 38 ASN 1.39 1.53 1 40 THR 4.33 3.58 1 42 TYR 2.86 0.10 1 43 PHE 5.69 2.36 1 44 MET 3.78 3.47 1 45 LYS 6.42 6.08 1 46 SER 5.91 2.88 1 47 ILE 4.45 3.95 1 48 ASP 6.16 5.88 1 50 ILE 4.92 4.62 1 51 ARG 3.70 3.16 1 52 ALA 1.16 -0.26 1 53 PHE 4.47 4.52 1 54 ARG 2.19 2.75 1 55 GLU 2.03 1.06 1 56 GLU 4.37 3.45 1 57 ALA 5.25 5.08 1 58 ILE 3.76 3.28 1 59 LYS 2.27 1.12 1 60 PHE 4.18 1.38 1 61 SER -1.80 -2.17 1 62 GLU 5.01 3.50 1 63 GLU 4.63 3.47 1 64 GLN 3.59 3.48 1 65 ARG 5.14 4.46 1 66 PHE 4.52 2.54 1 67 ASN 4.02 2.69 1 68 ASN 4.00 2.40 1 69 PHE 3.96 2.60 1 70 LEU 4.31 3.88 1 71 LYS 3.43 2.21 1 72 ALA 3.55 2.38 1 73 LEU 5.18 3.89 1 74 GLN 3.02 2.78 1 75 GLU 3.29 2.76 1 76 LYS 6.11 4.32 1 77 VAL 3.25 2.64 1 78 GLU 3.73 3.29 1 79 ILE 0.48 0.00 1 80 LYS 4.59 1.10 1 81 GLN -1.65 -2.04 1 82 LEU 5.18 4.32 1 83 ASN 3.50 3.39 1 84 HIS 3.73 2.50 1 85 PHE 1.62 1.88 1 86 TRP 2.87 2.56 1 87 GLU 4.69 3.78 1 88 ILE 6.90 4.99 1 89 VAL 4.74 3.77 1 90 VAL 4.10 3.02 1 91 GLN 0.81 1.17 1 92 ASP 2.67 1.22 1 95 THR -1.37 -0.24 1 96 LEU 0.33 0.92 1 97 ILE -3.85 -0.76 1 98 THR 2.00 1.56 1 99 LYS 2.50 1.99 1 100 GLU -2.02 0.77 1 101 GLU -2.69 -0.26 1 102 ALA 3.21 2.86 1 103 SER -2.34 -1.99 1 105 SER -0.72 -0.36 1 106 SER 0.62 0.46 1 107 VAL -3.16 -1.19 1 108 THR 4.26 3.22 1 109 ALA 3.65 3.10 1 110 GLU 2.36 2.60 1 111 GLU 2.85 2.36 1 112 ALA 3.55 2.76 1 113 LYS 3.06 2.27 1 114 LYS 3.39 3.23 1 115 PHE -1.49 -0.61 1 116 LEU -0.17 0.12 1 117 ALA 0.06 -0.01 1 119 LYS 0.41 1.65 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5912_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 3.43 _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 0.62 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -1.43 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 GLU -5.29 3.53 0 94 ILE -6.21 1.60 0 10 ARG 4.51 -0.15 1 11 VAL 5.50 -1.17 1 12 LEU 3.30 0.11 1 13 VAL 4.14 -1.95 1 14 LYS 3.68 -0.64 1 15 GLN 1.19 -0.92 1 16 LYS 4.41 -3.31 1 17 LYS 0.44 0.28 1 18 ALA -4.59 3.04 1 19 SER -1.60 0.60 1 20 PHE 5.42 -0.81 1 21 GLU 3.90 0.14 1 22 GLU 2.91 -0.12 1 23 ALA 2.65 -0.30 1 24 SER 5.03 -1.41 1 25 ASN 4.61 -1.66 1 26 GLN 3.68 -0.79 1 27 LEU 3.13 -0.09 1 28 ILE 5.45 -0.41 1 29 ASN 4.34 -0.78 1 30 HIS 4.47 0.53 1 31 ILE 6.00 -0.63 1 32 GLU 4.60 -0.65 1 33 GLN 4.48 -1.08 1 34 PHE 1.81 -2.03 1 35 LEU 4.43 -1.32 1 36 ASP 2.25 -0.15 1 37 THR 1.99 0.38 1 38 ASN 1.39 0.14 1 40 THR 4.33 -0.75 1 42 TYR 2.86 -2.76 1 43 PHE 5.69 -3.33 1 44 MET 3.78 -0.31 1 45 LYS 6.42 -0.34 1 46 SER 5.91 -3.03 1 47 ILE 4.45 -0.50 1 48 ASP 6.16 -0.28 1 50 ILE 4.92 -0.30 1 51 ARG 3.70 -0.54 1 52 ALA 1.16 -1.42 1 53 PHE 4.47 0.05 1 54 ARG 2.19 0.56 1 55 GLU 2.03 -0.97 1 56 GLU 4.37 -0.92 1 57 ALA 5.25 -0.17 1 58 ILE 3.76 -0.48 1 59 LYS 2.27 -1.15 1 60 PHE 4.18 -2.80 1 61 SER -1.80 -0.37 1 62 GLU 5.01 -1.51 1 63 GLU 4.63 -1.16 1 64 GLN 3.59 -0.11 1 65 ARG 5.14 -0.68 1 66 PHE 4.52 -1.98 1 67 ASN 4.02 -1.33 1 68 ASN 4.00 -1.60 1 69 PHE 3.96 -1.36 1 70 LEU 4.31 -0.43 1 71 LYS 3.43 -1.22 1 72 ALA 3.55 -1.17 1 73 LEU 5.18 -1.29 1 74 GLN 3.02 -0.24 1 75 GLU 3.29 -0.53 1 76 LYS 6.11 -1.79 1 77 VAL 3.25 -0.61 1 78 GLU 3.73 -0.44 1 79 ILE 0.48 -0.48 1 80 LYS 4.59 -3.49 1 81 GLN -1.65 -0.39 1 82 LEU 5.18 -0.86 1 83 ASN 3.50 -0.11 1 84 HIS 3.73 -1.23 1 85 PHE 1.62 0.26 1 86 TRP 2.87 -0.31 1 87 GLU 4.69 -0.91 1 88 ILE 6.90 -1.91 1 89 VAL 4.74 -0.97 1 90 VAL 4.10 -1.08 1 91 GLN 0.81 0.36 1 92 ASP 2.67 -1.45 1 95 THR -1.37 1.13 1 96 LEU 0.33 0.59 1 97 ILE -3.85 3.09 1 98 THR 2.00 -0.44 1 99 LYS 2.50 -0.51 1 100 GLU -2.02 2.79 1 101 GLU -2.69 2.43 1 102 ALA 3.21 -0.35 1 103 SER -2.34 0.35 1 105 SER -0.72 0.36 1 106 SER 0.62 -0.16 1 107 VAL -3.16 1.97 1 108 THR 4.26 -1.04 1 109 ALA 3.65 -0.55 1 110 GLU 2.36 0.24 1 111 GLU 2.85 -0.49 1 112 ALA 3.55 -0.79 1 113 LYS 3.06 -0.79 1 114 LYS 3.39 -0.16 1 115 PHE -1.49 0.88 1 116 LEU -0.17 0.29 1 117 ALA 0.06 -0.07 1 119 LYS 0.41 1.24 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5912_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 0.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _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 53 PHE 4.47 -1.84 0 10 ARG 4.51 -0.96 1 11 VAL 5.50 -0.54 1 12 LEU 3.30 -0.53 1 13 VAL 4.14 -0.33 1 14 LYS 3.68 -0.11 1 15 GLN 1.19 -0.03 1 16 LYS 4.41 -0.23 1 17 LYS 0.44 -0.12 1 18 ALA -4.59 0.13 1 19 SER -1.60 -0.05 1 20 PHE 5.42 -0.97 1 21 GLU 3.90 -0.69 1 22 GLU 2.91 -0.36 1 23 ALA 2.65 -0.37 1 24 SER 5.03 -1.10 1 25 ASN 4.61 -0.34 1 26 GLN 3.68 -0.37 1 27 LEU 3.13 -0.33 1 28 ILE 5.45 -0.90 1 29 ASN 4.34 -0.36 1 30 HIS 4.47 -0.70 1 31 ILE 6.00 -0.51 1 32 GLU 4.60 -0.56 1 33 GLN 4.48 -0.29 1 34 PHE 1.81 -0.01 1 35 LEU 4.43 -0.21 1 36 ASP 2.25 -0.08 1 37 THR 1.99 -0.30 1 38 ASN 1.39 -0.12 1 39 GLU -5.29 0.27 1 40 THR 4.33 -0.54 1 42 TYR 2.86 0.12 1 43 PHE 5.69 0.01 1 44 MET 3.78 -0.05 1 45 LYS 6.42 -0.04 1 46 SER 5.91 -0.28 1 47 ILE 4.45 -0.14 1 48 ASP 6.16 -0.38 1 50 ILE 4.92 -0.43 1 51 ARG 3.70 -0.02 1 52 ALA 1.16 -0.09 1 54 ARG 2.19 -0.44 1 55 GLU 2.03 0.44 1 56 GLU 4.37 -0.34 1 57 ALA 5.25 -0.57 1 58 ILE 3.76 -0.38 1 59 LYS 2.27 -0.09 1 60 PHE 4.18 -0.02 1 61 SER -1.80 0.28 1 62 GLU 5.01 -0.54 1 63 GLU 4.63 -0.24 1 64 GLN 3.59 -0.12 1 65 ARG 5.14 -1.04 1 66 PHE 4.52 -0.56 1 67 ASN 4.02 -0.34 1 68 ASN 4.00 -0.13 1 69 PHE 3.96 -0.99 1 70 LEU 4.31 -0.19 1 71 LYS 3.43 -0.17 1 72 ALA 3.55 -0.44 1 73 LEU 5.18 -1.63 1 74 GLN 3.02 -0.48 1 75 GLU 3.29 -0.27 1 76 LYS 6.11 -0.65 1 77 VAL 3.25 -0.31 1 78 GLU 3.73 -0.29 1 79 ILE 0.48 -0.04 1 80 LYS 4.59 -0.32 1 81 GLN -1.65 0.62 1 82 LEU 5.18 -0.45 1 83 ASN 3.50 -0.06 1 84 HIS 3.73 -0.69 1 85 PHE 1.62 -0.81 1 86 TRP 2.87 -0.48 1 87 GLU 4.69 -0.62 1 88 ILE 6.90 -1.22 1 89 VAL 4.74 -0.77 1 90 VAL 4.10 -0.41 1 91 GLN 0.81 -0.10 1 92 ASP 2.67 -0.50 1 94 ILE -6.21 0.48 1 95 THR -1.37 -0.37 1 96 LEU 0.33 0.00 1 97 ILE -3.85 0.19 1 98 THR 2.00 0.19 1 99 LYS 2.50 -0.30 1 100 GLU -2.02 -0.21 1 101 GLU -2.69 0.22 1 102 ALA 3.21 -0.15 1 103 SER -2.34 0.04 1 105 SER -0.72 0.15 1 106 SER 0.62 -0.07 1 107 VAL -3.16 0.27 1 108 THR 4.26 -0.19 1 109 ALA 3.65 -0.32 1 110 GLU 2.36 -0.36 1 111 GLU 2.85 -0.34 1 112 ALA 3.55 -0.11 1 113 LYS 3.06 -0.26 1 114 LYS 3.39 -0.35 1 115 PHE -1.49 0.03 1 116 LEU -0.17 -0.03 1 117 ALA 0.06 -0.03 1 119 LYS 0.41 -0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5912_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.21 _LACS_plot.Line_1_terminator_val_y_1 -0.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.37 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 2.91 _LACS_plot.Y_axis_chem_shift_offset -0.95 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 92 ASP 2.67 -4.50 0 10 ARG 4.51 2.64 1 11 VAL 5.50 2.00 1 12 LEU 3.30 2.75 1 13 VAL 4.14 2.70 1 14 LYS 3.68 2.28 1 15 GLN 1.19 -0.17 1 16 LYS 4.41 0.07 1 17 LYS 0.44 -0.14 1 18 ALA -4.59 -1.21 1 19 SER -1.60 -0.11 1 20 PHE 5.42 3.98 1 21 GLU 3.90 0.21 1 22 GLU 2.91 3.18 1 23 ALA 2.65 3.68 1 24 SER 5.03 0.87 1 25 ASN 4.61 3.45 1 26 GLN 3.68 2.04 1 27 LEU 3.13 1.19 1 28 ILE 5.45 1.18 1 29 ASN 4.34 3.15 1 30 HIS 4.47 3.00 1 31 ILE 6.00 1.41 1 32 GLU 4.60 2.46 1 33 GLN 4.48 4.15 1 34 PHE 1.81 4.10 1 35 LEU 4.43 2.10 1 36 ASP 2.25 1.67 1 37 THR 1.99 1.97 1 38 ASN 1.39 -0.77 1 39 GLU -5.29 0.25 1 40 THR 4.33 3.84 1 42 TYR 2.86 3.73 1 43 PHE 5.69 3.73 1 44 MET 3.78 3.77 1 45 LYS 6.42 2.13 1 46 SER 5.91 1.59 1 47 ILE 4.45 3.97 1 48 ASP 6.16 1.34 1 50 ILE 4.92 2.51 1 51 ARG 3.70 1.52 1 52 ALA 1.16 1.72 1 53 PHE 4.47 1.27 1 54 ARG 2.19 4.89 1 55 GLU 2.03 2.72 1 56 GLU 4.37 2.74 1 57 ALA 5.25 2.90 1 58 ILE 3.76 2.14 1 59 LYS 2.27 -1.25 1 60 PHE 4.18 0.85 1 61 SER -1.80 0.68 1 62 GLU 5.01 1.47 1 63 GLU 4.63 0.46 1 64 GLN 3.59 4.11 1 65 ARG 5.14 0.14 1 66 PHE 4.52 2.78 1 67 ASN 4.02 3.62 1 68 ASN 4.00 0.44 1 69 PHE 3.96 1.89 1 70 LEU 4.31 2.62 1 71 LYS 3.43 3.10 1 72 ALA 3.55 0.48 1 73 LEU 5.18 1.95 1 74 GLN 3.02 1.52 1 75 GLU 3.29 1.90 1 76 LYS 6.11 1.86 1 77 VAL 3.25 3.75 1 78 GLU 3.73 2.25 1 79 ILE 0.48 -1.34 1 80 LYS 4.59 1.08 1 81 GLN -1.65 0.82 1 82 LEU 5.18 2.41 1 83 ASN 3.50 3.35 1 84 HIS 3.73 0.59 1 85 PHE 1.62 0.63 1 86 TRP 2.87 2.48 1 87 GLU 4.69 1.50 1 88 ILE 6.90 1.49 1 89 VAL 4.74 4.35 1 90 VAL 4.10 2.16 1 91 GLN 0.81 0.03 1 94 ILE -6.21 0.11 1 95 THR -1.37 -1.13 1 96 LEU 0.33 2.58 1 97 ILE -3.85 1.17 1 98 THR 2.00 1.00 1 99 LYS 2.50 1.43 1 100 GLU -2.02 0.16 1 101 GLU -2.69 -0.98 1 102 ALA 3.21 0.99 1 103 SER -2.34 0.24 1 105 SER -0.72 0.32 1 106 SER 0.62 0.21 1 107 VAL -3.16 1.28 1 108 THR 4.26 3.18 1 109 ALA 3.65 2.72 1 110 GLU 2.36 3.26 1 111 GLU 2.85 2.34 1 112 ALA 3.55 3.03 1 113 LYS 3.06 1.86 1 114 LYS -1.49 -0.89 1 116 LEU -0.17 -0.69 1 117 ALA 0.06 -0.70 1 119 LYS 0.41 4.59 1 stop_ save_