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 bmr11405_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 -2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.45 _LACS_plot.Line_2_terminator_val_x_2 6.50 _LACS_plot.Line_2_terminator_val_y_2 5.07 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 MET 6.50 6.28 0 10 GLN 0.21 0.32 1 11 GLN 0.49 0.37 1 12 SER 0.21 0.10 1 13 ILE 0.77 0.60 1 15 ALA 0.03 0.95 1 16 ALA 1.48 0.42 1 18 SER -1.08 -0.65 1 19 GLN -1.39 -0.90 1 20 LYS 0.28 0.28 1 21 GLU -1.42 0.01 1 24 GLU 2.28 1.74 1 26 ALA -3.46 -1.70 1 27 ASN -2.68 0.28 1 28 LEU -4.93 -1.34 1 29 PHE -4.91 -1.19 1 30 ILE -3.49 -1.43 1 31 TYR -3.26 -1.17 1 32 HIS 3.33 0.91 1 33 LEU -0.92 -0.24 1 35 GLN 3.75 3.34 1 36 GLU 1.73 0.45 1 37 PHE 0.52 0.90 1 39 ASP 4.58 4.42 1 40 GLN 4.56 2.92 1 41 ASP 4.05 2.59 1 42 LEU 2.47 2.69 1 43 LEU 4.02 3.75 1 44 GLN 4.28 3.29 1 45 MET 1.32 2.81 1 46 PHE 3.33 2.59 1 49 PHE 1.68 0.53 1 51 ASN 1.30 0.00 1 52 VAL 1.05 0.40 1 53 VAL 3.01 1.96 1 54 SER -3.26 -0.57 1 55 ALA -3.25 -1.14 1 56 LYS -5.54 -2.02 1 57 VAL -0.20 0.12 1 58 PHE 1.97 1.40 1 59 ILE -3.89 -2.38 1 60 ASP -1.71 -0.19 1 61 LYS 2.80 2.04 1 62 GLN 2.51 2.40 1 63 THR -1.15 -0.19 1 64 ASN 2.72 1.91 1 65 LEU -3.09 -1.45 1 66 SER 0.38 0.31 1 67 LYS 0.75 0.68 1 69 PHE -5.71 -2.58 1 71 PHE -6.99 -2.37 1 72 VAL -6.19 -2.31 1 73 SER -6.86 -3.24 1 74 TYR -5.59 -0.98 1 75 ASP -0.53 -1.01 1 76 ASN -2.90 -0.06 1 78 VAL 5.82 4.26 1 79 SER 4.14 3.25 1 80 ALA 3.17 2.45 1 81 GLN 4.49 2.93 1 82 ALA 3.60 2.46 1 83 ALA 2.40 2.18 1 84 ILE 5.53 5.37 1 85 GLN 4.01 3.02 1 86 SER 2.24 3.29 1 87 MET -0.13 -1.56 1 88 ASN 3.57 3.42 1 90 PHE 0.12 1.62 1 91 GLN 0.37 0.10 1 92 ILE -1.93 -1.01 1 94 MET 0.72 0.05 1 95 LYS -3.33 -1.10 1 96 ARG -2.61 -1.58 1 97 LEU -0.20 0.77 1 98 LYS -3.29 -1.27 1 99 VAL -2.09 -0.86 1 100 GLN -6.64 -2.07 1 101 LEU 0.09 0.51 1 102 LYS -0.09 0.44 1 103 ARG -0.48 -0.02 1 104 SER -0.19 0.05 1 105 LYS 0.71 0.60 1 106 ASN 0.27 0.25 1 107 ASP -0.02 0.18 1 108 SER 0.64 0.51 1 109 LYS 0.64 0.28 1 110 SER -0.36 0.09 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11405_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 4.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.55 _LACS_plot.Line_2_terminator_val_x_2 6.50 _LACS_plot.Line_2_terminator_val_y_2 -1.43 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 MET 6.50 -0.22 0 10 GLN 0.21 0.11 1 11 GLN 0.49 -0.12 1 12 SER 0.21 -0.11 1 13 ILE 0.77 -0.17 1 15 ALA 0.03 0.92 1 16 ALA 1.48 -1.06 1 18 SER -1.08 0.43 1 19 GLN -1.39 0.49 1 20 LYS 0.28 0.00 1 21 GLU -1.42 1.43 1 24 GLU 2.28 -0.54 1 26 ALA -3.46 1.76 1 27 ASN -2.68 2.96 1 28 LEU -4.93 3.59 1 29 PHE -4.91 3.72 1 30 ILE -3.49 2.06 1 31 TYR -3.26 2.09 1 32 HIS 3.33 -2.42 1 33 LEU -0.92 0.68 1 35 GLN 3.75 -0.41 1 36 GLU 1.73 -1.28 1 37 PHE 0.52 0.38 1 39 ASP 4.58 -0.16 1 40 GLN 4.56 -1.64 1 41 ASP 4.05 -1.46 1 42 LEU 2.47 0.22 1 43 LEU 4.02 -0.27 1 44 GLN 4.28 -0.99 1 45 MET 1.32 1.49 1 46 PHE 3.33 -0.74 1 49 PHE 1.68 -1.15 1 51 ASN 1.30 -1.30 1 52 VAL 1.05 -0.65 1 53 VAL 3.01 -1.05 1 54 SER -3.26 2.69 1 55 ALA -3.25 2.11 1 56 LYS -5.54 3.52 1 57 VAL -0.20 0.32 1 58 PHE 1.97 -0.57 1 59 ILE -3.89 1.51 1 60 ASP -1.71 1.52 1 61 LYS 2.80 -0.76 1 62 GLN 2.51 -0.11 1 63 THR -1.15 0.96 1 64 ASN 2.72 -0.81 1 65 LEU -3.09 1.64 1 66 SER 0.38 -0.07 1 67 LYS 0.75 -0.07 1 69 PHE -5.71 3.13 1 71 PHE -6.99 4.62 1 72 VAL -6.19 3.88 1 73 SER -6.86 3.62 1 74 TYR -5.59 4.61 1 75 ASP -0.53 -0.48 1 76 ASN -2.90 2.84 1 78 VAL 5.82 -1.56 1 79 SER 4.14 -0.89 1 80 ALA 3.17 -0.72 1 81 GLN 4.49 -1.56 1 82 ALA 3.60 -1.14 1 83 ALA 2.40 -0.22 1 84 ILE 5.53 -0.16 1 85 GLN 4.01 -0.99 1 86 SER 2.24 1.05 1 87 MET -0.13 -1.43 1 88 ASN 3.57 -0.15 1 90 PHE 0.12 1.50 1 91 GLN 0.37 -0.27 1 92 ILE -1.93 0.92 1 94 MET 0.72 -0.67 1 95 LYS -3.33 2.23 1 96 ARG -2.61 1.03 1 97 LEU -0.20 0.97 1 98 LYS -3.29 2.02 1 99 VAL -2.09 1.23 1 100 GLN -6.64 4.57 1 101 LEU 0.09 0.42 1 102 LYS -0.09 0.53 1 103 ARG -0.48 0.46 1 104 SER -0.19 0.24 1 105 LYS 0.71 -0.11 1 106 ASN 0.27 -0.02 1 107 ASP -0.02 0.20 1 108 SER 0.64 -0.13 1 109 LYS 0.64 -0.36 1 110 SER -0.36 0.45 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11405_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 0.78 _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 0.26 _LACS_plot.Line_2_terminator_val_x_2 6.50 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 83 ALA 2.40 -1.97 0 10 GLN 0.21 -0.03 1 11 GLN 0.49 -0.03 1 12 SER 0.21 0.01 1 13 ILE 0.77 -0.01 1 15 ALA 0.03 -0.03 1 16 ALA 1.48 0.11 1 18 SER -1.08 -0.03 1 19 GLN -1.39 0.06 1 20 LYS 0.28 -0.15 1 21 GLU -1.42 0.07 1 24 GLU 2.28 -0.29 1 26 ALA -3.46 0.31 1 27 ASN -2.68 0.34 1 28 LEU -4.93 0.74 1 29 PHE -4.91 0.86 1 30 ILE -3.49 0.84 1 31 TYR -3.26 0.42 1 32 HIS 3.33 -0.27 1 33 LEU -0.92 -0.70 1 35 GLN 3.75 -0.19 1 36 GLU 1.73 -0.01 1 37 PHE 0.52 -0.04 1 39 ASP 4.58 -0.68 1 40 GLN 4.56 -0.45 1 41 ASP 4.05 -0.67 1 42 LEU 2.47 -0.18 1 43 LEU 4.02 -0.60 1 44 GLN 4.28 -0.39 1 45 MET 1.32 -0.51 1 46 PHE 3.33 0.12 1 47 MET 6.50 -0.08 1 49 PHE 1.68 -0.30 1 51 ASN 1.30 -0.06 1 52 VAL 1.05 -0.40 1 53 VAL 3.01 -0.41 1 54 SER -3.26 0.27 1 55 ALA -3.25 0.77 1 56 LYS -5.54 0.21 1 57 VAL -0.20 -0.22 1 58 PHE 1.97 -0.19 1 59 ILE -3.89 0.34 1 60 ASP -1.71 0.00 1 61 LYS 2.80 -0.21 1 62 GLN 2.51 -0.06 1 63 THR -1.15 -0.03 1 64 ASN 2.72 -0.43 1 65 LEU -3.09 0.29 1 66 SER 0.38 0.04 1 67 LYS 0.75 0.23 1 69 PHE -5.71 0.84 1 71 PHE -6.99 0.86 1 72 VAL -6.19 0.21 1 73 SER -6.86 0.79 1 74 TYR -5.59 0.84 1 75 ASP -0.53 -0.11 1 76 ASN -2.90 0.05 1 78 VAL 5.82 -0.44 1 79 SER 4.14 -0.48 1 80 ALA 3.17 -0.53 1 81 GLN 4.49 -0.46 1 82 ALA 3.60 -0.27 1 84 ILE 5.53 -0.89 1 85 GLN 4.01 -0.38 1 86 SER 2.24 -0.02 1 87 MET -0.13 0.44 1 88 ASN 3.57 -0.20 1 90 PHE 0.12 -0.36 1 91 GLN 0.37 0.32 1 92 ILE -1.93 0.05 1 94 MET 0.72 -0.04 1 95 LYS -3.33 0.24 1 96 ARG -2.61 0.53 1 97 LEU -0.20 0.21 1 98 LYS -3.29 0.89 1 99 VAL -2.09 0.83 1 100 GLN -6.64 0.51 1 101 LEU 0.09 0.18 1 102 LYS -0.09 -0.02 1 103 ARG -0.48 0.11 1 104 SER -0.19 -0.02 1 105 LYS 0.71 -0.03 1 106 ASN 0.27 -0.05 1 107 ASP -0.02 -0.03 1 108 SER 0.64 -0.09 1 109 LYS 0.64 0.04 1 110 SER -0.36 -0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11405_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 -2.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.94 _LACS_plot.Line_2_terminator_val_x_2 6.50 _LACS_plot.Line_2_terminator_val_y_2 2.33 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 SER -6.86 -0.59 0 47 MET 6.50 -0.43 0 10 GLN 0.21 -0.15 1 11 GLN 0.49 0.08 1 12 SER 0.21 0.28 1 13 ILE 0.77 0.57 1 15 ALA 0.03 1.37 1 16 ALA 1.48 0.22 1 18 SER -1.08 -1.59 1 19 GLN -1.39 -1.07 1 20 LYS 0.28 -0.66 1 21 GLU -1.42 1.10 1 24 GLU 2.28 1.30 1 26 ALA -3.46 -3.30 1 27 ASN -2.68 -1.91 1 28 LEU -4.93 -2.27 1 29 PHE -4.91 -1.21 1 30 ILE -3.49 -1.96 1 31 TYR -3.26 -1.37 1 32 HIS 3.33 -0.09 1 33 LEU -0.92 -0.34 1 35 GLN 3.75 -0.09 1 36 GLU 1.73 0.27 1 37 PHE 0.52 1.04 1 39 ASP 4.58 1.88 1 40 GLN 4.56 2.14 1 41 ASP 4.05 1.92 1 42 LEU 2.47 0.15 1 43 LEU 4.02 0.80 1 44 GLN 4.28 2.29 1 45 MET 1.32 -0.47 1 46 PHE 3.33 1.81 1 49 PHE 1.68 -0.81 1 51 ASN 1.30 -1.58 1 52 VAL 1.05 -0.03 1 53 VAL 3.01 0.11 1 54 SER -3.26 -3.46 1 55 ALA -3.25 -3.22 1 56 LYS -5.54 -2.96 1 57 VAL -0.20 -0.44 1 58 PHE 1.97 -1.77 1 59 ILE -3.89 -0.22 1 60 ASP -1.71 0.48 1 61 LYS 2.80 0.92 1 62 GLN 2.51 1.75 1 63 THR -1.15 0.91 1 64 ASN 2.72 -1.40 1 65 LEU -3.09 -0.48 1 66 SER 0.38 2.49 1 69 PHE -5.71 -3.09 1 71 PHE -6.99 -2.61 1 72 VAL -6.19 -3.69 1 74 TYR -5.59 -1.83 1 75 ASP -0.53 0.39 1 76 ASN -2.90 -0.19 1 78 VAL 5.82 3.24 1 79 SER 4.14 -0.58 1 80 ALA 3.17 0.72 1 81 GLN 4.49 2.46 1 82 ALA 3.60 2.06 1 83 ALA 2.40 2.10 1 84 ILE 5.53 1.60 1 85 GLN 4.01 2.61 1 86 SER 2.24 1.02 1 87 MET -0.13 1.56 1 88 ASN 3.57 1.48 1 90 PHE 0.12 -0.99 1 91 GLN 0.37 -1.65 1 92 ILE -1.93 -0.82 1 94 MET 0.72 -0.24 1 95 LYS -3.33 -1.93 1 96 ARG -2.61 -0.21 1 97 LEU -0.20 0.67 1 98 LYS -3.29 -2.12 1 99 VAL -2.09 -2.29 1 100 GLN -6.64 -2.02 1 101 LEU 0.09 0.06 1 102 LYS -0.09 -0.94 1 103 ARG -0.48 -0.11 1 104 SER -0.19 1.60 1 105 LYS 0.71 -0.06 1 106 ASN 0.27 -0.28 1 107 ASP -0.02 0.10 1 108 SER 0.64 0.21 1 109 LYS 0.64 0.10 1 110 SER -0.36 -0.12 1 stop_ save_