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 bmr30209_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.62 _LACS_plot.Line_1_terminator_val_y_1 -1.69 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.61 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 6.62 _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 35 HIS 2.37 4.72 0 97 GLN 0.57 3.49 0 34 MET 8.69 3.82 0 10 ILE -0.19 -0.59 1 12 PHE -0.40 0.19 1 14 ASP 0.24 0.45 1 16 LEU 0.11 0.09 1 17 ASP 0.29 -0.04 1 18 ASN -0.00 0.16 1 20 ARG 0.75 0.33 1 23 GLN 0.27 -0.54 1 24 ILE -1.53 -1.99 1 25 ARG 0.12 -1.35 1 26 ILE 2.99 2.21 1 27 GLN 4.91 3.22 1 28 GLN 1.56 0.41 1 29 LEU -1.86 -1.59 1 30 ASN 6.75 4.45 1 31 HIS 6.46 6.22 1 33 GLN 6.49 5.05 1 36 LEU 2.35 1.88 1 37 THR -0.16 -0.28 1 38 SER 0.35 0.11 1 39 PHE -0.93 -0.33 1 40 ASP -0.54 -0.49 1 41 TYR 1.55 1.09 1 42 LYS 1.23 0.73 1 43 LEU 0.49 0.24 1 44 ARG 1.51 0.67 1 45 MET -0.02 0.16 1 46 ALA 0.14 0.28 1 47 VAL 0.16 0.12 1 48 GLU -0.32 -0.13 1 49 ASN -0.48 -0.09 1 51 LYS 1.93 1.13 1 52 GLN 0.95 0.77 1 53 GLN 0.85 0.32 1 54 GLN 2.53 1.88 1 55 HIS 2.32 3.35 1 56 LEU 5.41 4.05 1 57 SER 5.50 3.75 1 58 LEU 3.31 2.55 1 61 ASN 4.22 3.62 1 62 GLN 5.74 4.37 1 63 LEU 2.77 2.94 1 64 GLN 3.15 1.88 1 65 GLU 0.41 -0.22 1 66 VAL 0.99 0.07 1 67 GLU 1.34 1.06 1 68 LYS 4.93 4.56 1 69 GLN 4.33 2.25 1 71 GLN 6.60 5.41 1 73 GLU 3.88 2.21 1 74 ALA 4.23 3.08 1 75 ILE 6.29 5.27 1 76 LYS 5.56 4.53 1 77 GLN 5.17 3.78 1 78 VAL 6.15 4.30 1 79 VAL 6.41 4.71 1 80 GLU 3.85 2.86 1 81 GLN 4.21 2.74 1 82 ALA 3.23 2.56 1 83 GLN 5.64 4.17 1 84 LYS 3.80 2.99 1 85 GLN 3.14 2.50 1 86 LEU 1.52 1.53 1 87 GLN 3.61 1.94 1 88 GLN 1.06 0.70 1 90 GLN 2.05 1.18 1 93 GLN 4.37 3.21 1 94 GLN 4.63 3.22 1 95 GLN 4.32 3.26 1 96 VAL 6.29 4.97 1 98 GLN 3.72 2.98 1 99 MET 6.51 4.44 1 100 VAL 6.31 5.00 1 101 LYS 4.15 3.00 1 102 LYS 3.32 3.53 1 103 ALA 3.54 3.08 1 104 GLN 3.59 2.68 1 105 MET -0.08 0.98 1 106 LEU 6.77 6.01 1 108 ASN 2.86 2.98 1 109 GLN 3.63 3.36 1 111 ASN 3.54 1.43 1 112 LEU -1.84 -1.50 1 113 GLN 1.15 -0.41 1 115 SER -2.62 -1.03 1 116 ILE 0.81 1.57 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30209_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.62 _LACS_plot.Line_1_terminator_val_y_1 0.93 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.39 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 -2.07 _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 35 HIS 2.37 2.35 0 97 GLN 0.57 2.92 0 34 MET 8.69 -4.87 0 10 ILE -0.19 -0.40 1 12 PHE -0.40 0.59 1 14 ASP 0.24 0.21 1 16 LEU 0.11 -0.02 1 17 ASP 0.29 -0.33 1 18 ASN -0.00 0.16 1 20 ARG 0.75 -0.42 1 23 GLN 0.27 -0.81 1 24 ILE -1.53 -0.46 1 25 ARG 0.12 -1.47 1 26 ILE 2.99 -0.78 1 27 GLN 4.91 -1.69 1 28 GLN 1.56 -1.15 1 29 LEU -1.86 0.27 1 30 ASN 6.75 -2.30 1 31 HIS 6.46 -0.24 1 33 GLN 6.49 -1.44 1 36 LEU 2.35 -0.47 1 37 THR -0.16 -0.12 1 38 SER 0.35 -0.24 1 39 PHE -0.93 0.60 1 40 ASP -0.54 0.05 1 41 TYR 1.55 -0.46 1 42 LYS 1.23 -0.50 1 43 LEU 0.49 -0.25 1 44 ARG 1.51 -0.84 1 45 MET -0.02 0.18 1 46 ALA 0.14 0.14 1 47 VAL 0.16 -0.04 1 48 GLU -0.32 0.19 1 49 ASN -0.48 0.39 1 51 LYS 1.93 -0.80 1 52 GLN 0.95 -0.18 1 53 GLN 0.85 -0.53 1 54 GLN 2.53 -0.65 1 55 HIS 2.32 1.03 1 56 LEU 5.41 -1.36 1 57 SER 5.50 -1.75 1 58 LEU 3.31 -0.76 1 61 ASN 4.22 -0.60 1 62 GLN 5.74 -1.37 1 63 LEU 2.77 0.17 1 64 GLN 3.15 -1.27 1 65 GLU 0.41 -0.63 1 66 VAL 0.99 -0.92 1 67 GLU 1.34 -0.28 1 68 LYS 4.93 -0.37 1 69 GLN 4.33 -2.08 1 71 GLN 6.60 -1.19 1 73 GLU 3.88 -1.67 1 74 ALA 4.23 -1.15 1 75 ILE 6.29 -1.02 1 76 LYS 5.56 -1.03 1 77 GLN 5.17 -1.39 1 78 VAL 6.15 -1.85 1 79 VAL 6.41 -1.70 1 80 GLU 3.85 -0.99 1 81 GLN 4.21 -1.47 1 82 ALA 3.23 -0.67 1 83 GLN 5.64 -1.47 1 84 LYS 3.80 -0.81 1 85 GLN 3.14 -0.64 1 86 LEU 1.52 0.01 1 87 GLN 3.61 -1.67 1 88 GLN 1.06 -0.36 1 90 GLN 2.05 -0.87 1 93 GLN 4.37 -1.16 1 94 GLN 4.63 -1.41 1 95 GLN 4.32 -1.06 1 96 VAL 6.29 -1.32 1 98 GLN 3.72 -0.74 1 99 MET 6.51 -2.07 1 100 VAL 6.31 -1.31 1 101 LYS 4.15 -1.15 1 102 LYS 3.32 0.21 1 103 ALA 3.54 -0.46 1 104 GLN 3.59 -0.91 1 105 MET -0.08 1.06 1 106 LEU 6.77 -0.76 1 108 ASN 2.86 0.12 1 109 GLN 3.63 -0.27 1 111 ASN 3.54 -2.11 1 112 LEU -1.84 0.34 1 113 GLN 1.15 -1.56 1 115 SER -2.62 1.59 1 116 ILE 0.81 0.76 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30209_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.62 _LACS_plot.Line_1_terminator_val_y_1 0.12 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 -0.80 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 ASN -0.00 -1.42 0 10 ILE -0.19 -0.10 1 12 PHE -0.40 -0.07 1 14 ASP 0.24 -0.12 1 16 LEU 0.11 -0.08 1 17 ASP 0.29 -0.19 1 20 ARG 0.75 -0.13 1 23 GLN 0.27 0.04 1 24 ILE -1.53 -0.10 1 25 ARG 0.12 0.16 1 26 ILE 2.99 -0.55 1 27 GLN 4.91 -0.35 1 28 GLN 1.56 -0.02 1 29 LEU -1.86 0.28 1 30 ASN 6.75 -0.40 1 31 HIS 6.46 -0.47 1 33 GLN 6.49 -0.76 1 34 MET 8.69 -0.43 1 35 HIS 2.37 -0.35 1 36 LEU 2.35 -0.61 1 37 THR -0.16 -0.15 1 38 SER 0.35 -0.18 1 39 PHE -0.93 -0.14 1 40 ASP -0.54 -0.13 1 41 TYR 1.55 -0.21 1 42 LYS 1.23 -0.22 1 43 LEU 0.49 -0.18 1 44 ARG 1.51 -0.22 1 45 MET -0.02 -0.13 1 46 ALA 0.14 -0.09 1 47 VAL 0.16 -0.13 1 48 GLU -0.32 -0.17 1 49 ASN -0.48 -0.20 1 51 LYS 1.93 -0.22 1 52 GLN 0.95 -0.14 1 53 GLN 0.85 -0.04 1 54 GLN 2.53 -0.30 1 55 HIS 2.32 -0.31 1 56 LEU 5.41 -1.09 1 57 SER 5.50 -0.76 1 58 LEU 3.31 -0.45 1 61 ASN 4.22 -0.42 1 62 GLN 5.74 -0.27 1 63 LEU 2.77 -0.38 1 64 GLN 3.15 -0.31 1 65 GLU 0.41 -0.17 1 66 VAL 0.99 -0.34 1 67 GLU 1.34 -0.35 1 68 LYS 4.93 -0.61 1 69 GLN 4.33 -0.06 1 71 GLN 6.60 -0.73 1 73 GLU 3.88 -0.40 1 74 ALA 4.23 -0.52 1 75 ILE 6.29 -0.89 1 76 LYS 5.56 -0.69 1 77 GLN 5.17 -0.34 1 78 VAL 6.15 -0.52 1 79 VAL 6.41 -0.65 1 80 GLU 3.85 -0.45 1 81 GLN 4.21 -0.41 1 82 ALA 3.23 -0.42 1 83 GLN 5.64 -0.71 1 84 LYS 3.80 -0.39 1 85 GLN 3.14 -0.31 1 86 LEU 1.52 -0.22 1 87 GLN 3.61 -0.42 1 88 GLN 1.06 -0.11 1 90 GLN 2.05 -0.16 1 93 GLN 4.37 -0.39 1 94 GLN 4.63 -0.30 1 95 GLN 4.32 -0.46 1 96 VAL 6.29 -0.72 1 97 GLN 0.57 -0.56 1 98 GLN 3.72 -0.36 1 99 MET 6.51 -0.52 1 100 VAL 6.31 -0.70 1 101 LYS 4.15 -0.42 1 102 LYS 3.32 -0.33 1 103 ALA 3.54 -0.47 1 104 GLN 3.59 -0.53 1 105 MET -0.08 -0.07 1 106 LEU 6.77 -0.22 1 108 ASN 2.86 -0.16 1 109 GLN 3.63 -0.42 1 111 ASN 3.54 -0.35 1 112 LEU -1.84 0.19 1 113 GLN 1.15 0.03 1 115 SER -2.62 0.13 1 116 ILE 0.81 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30209_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.62 _LACS_plot.Line_1_terminator_val_y_1 -1.69 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.85 _LACS_plot.Line_2_terminator_val_x_2 8.69 _LACS_plot.Line_2_terminator_val_y_2 3.48 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 LYS 3.32 4.13 0 29 LEU -1.86 1.31 0 56 LEU 5.41 -0.83 0 10 ILE -0.19 -0.72 1 14 ASP 0.24 0.45 1 16 LEU 0.11 -0.55 1 17 ASP 0.29 -0.97 1 20 ARG 0.75 0.64 1 23 GLN 0.27 -1.36 1 24 ILE -1.53 -0.56 1 25 ARG 0.12 0.76 1 26 ILE 2.99 1.53 1 27 GLN 4.91 1.60 1 28 GLN 1.56 -1.20 1 30 ASN 6.75 2.51 1 31 HIS 6.46 4.42 1 33 GLN 6.49 2.34 1 34 MET 8.69 2.91 1 35 HIS 2.37 2.64 1 36 LEU 2.35 -0.56 1 37 THR -0.16 -0.69 1 38 SER 0.35 -1.01 1 39 PHE -0.93 -1.09 1 40 ASP -0.54 -0.29 1 41 TYR 1.55 0.09 1 42 LYS 1.23 0.04 1 43 LEU 0.49 -0.47 1 44 ARG 1.51 -0.16 1 45 MET -0.02 -0.68 1 46 ALA 0.14 -0.20 1 47 VAL 0.16 -0.31 1 48 GLU -0.32 -0.81 1 51 LYS 1.93 0.90 1 52 GLN 0.95 0.51 1 53 GLN 0.85 0.81 1 54 GLN 2.53 0.98 1 55 HIS 2.32 1.87 1 57 SER 5.50 2.85 1 58 LEU 3.31 1.66 1 61 ASN 4.22 2.54 1 62 GLN 5.74 4.53 1 63 LEU 2.77 1.66 1 64 GLN 3.15 0.71 1 65 GLU 0.41 0.26 1 66 VAL 0.99 -1.00 1 67 GLU 1.34 2.23 1 68 LYS 4.93 2.34 1 69 GLN 4.33 0.96 1 71 GLN 6.60 0.63 1 73 GLU 3.88 1.69 1 74 ALA 4.23 1.04 1 75 ILE 6.29 0.90 1 76 LYS 5.56 2.65 1 77 GLN 5.17 3.30 1 78 VAL 6.15 1.52 1 79 VAL 6.41 1.13 1 80 GLU 3.85 2.64 1 81 GLN 4.21 2.63 1 82 ALA 3.23 1.59 1 83 GLN 5.64 1.57 1 84 LYS 3.80 2.16 1 85 GLN 3.14 2.56 1 86 LEU 1.52 1.29 1 87 GLN 3.61 1.13 1 88 GLN 1.06 0.68 1 90 GLN 2.05 1.17 1 93 GLN 4.37 2.35 1 94 GLN 4.63 2.42 1 95 GLN 4.32 2.59 1 96 VAL 6.29 1.90 1 98 GLN 3.72 2.12 1 99 MET 6.51 1.58 1 100 VAL 6.31 1.02 1 101 LYS 4.15 3.06 1 103 ALA 3.54 1.13 1 104 GLN 3.59 2.06 1 105 MET -0.08 0.35 1 108 ASN 2.86 3.68 1 109 GLN 3.63 2.39 1 111 ASN 3.54 -0.97 1 112 LEU -1.84 -0.18 1 113 GLN 1.15 -1.14 1 115 SER -2.62 -1.56 1 stop_ save_