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 bmr18827_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 -2.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.76 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 6.26 _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 34 ILE -2.30 -4.62 0 10 ASP 1.03 1.28 1 11 HIS -4.63 -1.08 1 13 LEU 4.52 3.85 1 14 GLU 4.45 3.76 1 15 HIS 3.15 4.53 1 18 VAL 4.80 3.93 1 19 GLU 3.43 3.18 1 20 SER 7.49 3.34 1 21 ALA 3.73 2.75 1 22 LYS 3.95 3.46 1 23 ILE 4.36 4.07 1 24 ARG 3.25 1.41 1 25 ALA 1.96 1.44 1 26 LYS 1.06 1.69 1 27 TYR -1.94 -1.90 1 29 ASP -0.37 -1.12 1 30 ARG -5.00 -2.18 1 31 VAL -3.51 -2.52 1 33 VAL -4.98 -2.09 1 35 VAL -3.70 -1.95 1 36 GLU -6.67 -1.58 1 37 LYS -0.69 -0.59 1 38 VAL 2.40 1.83 1 41 SER 0.02 0.22 1 42 GLN 1.26 0.06 1 43 ILE -1.24 -0.03 1 44 VAL 0.68 0.66 1 45 ASP -1.46 -0.15 1 46 ILE -2.76 -0.48 1 47 ASP 1.47 0.77 1 50 LYS -2.29 -1.09 1 51 TYR -4.33 -0.60 1 52 LEU -0.87 -1.42 1 55 SER 2.76 2.36 1 56 ASP 0.13 -0.25 1 57 ILE -0.30 -0.23 1 58 THR -3.47 -1.21 1 59 VAL 5.58 4.43 1 60 ALA 3.58 2.99 1 61 GLN 3.67 3.42 1 62 PHE 3.09 3.17 1 63 MET 4.87 4.59 1 64 TRP 4.08 3.59 1 65 ILE 6.01 4.78 1 66 ILE 5.27 2.51 1 67 ARG 4.75 4.31 1 68 LYS 3.43 2.22 1 69 ARG 3.38 2.51 1 70 ILE 1.88 0.34 1 71 GLN 3.81 0.53 1 72 LEU -2.62 -0.24 1 74 SER 4.46 3.59 1 75 GLU 2.45 1.16 1 76 LYS -1.48 -1.53 1 77 ALA -2.59 -0.48 1 78 ILE -4.59 -1.45 1 79 PHE -3.68 -0.65 1 80 LEU -4.11 -2.50 1 81 PHE -5.08 -0.92 1 82 VAL -1.58 -0.57 1 83 ASP 3.72 2.38 1 85 THR -2.85 -0.73 1 86 VAL -0.32 -0.14 1 88 GLN 1.61 1.23 1 89 SER 3.67 3.50 1 90 SER -0.31 -0.43 1 91 LEU -0.43 0.46 1 92 THR -1.74 -1.16 1 93 MET 5.04 0.25 1 95 GLN 3.28 3.08 1 96 LEU 2.86 2.73 1 97 TYR 4.00 4.65 1 98 GLU 2.79 2.43 1 99 LYS -0.07 1.74 1 100 GLU -1.95 -1.44 1 101 LYS 2.60 1.23 1 102 ASP -2.42 -0.14 1 103 GLU 3.24 2.38 1 104 ASP -0.21 -0.29 1 106 PHE 1.19 1.54 1 107 LEU -4.67 -1.61 1 108 TYR 1.54 0.47 1 109 VAL -3.56 -1.36 1 110 ALA -6.78 -3.34 1 111 TYR -7.09 -2.47 1 112 SER -4.29 -2.28 1 114 GLU -4.24 -1.45 1 115 ASN 1.07 -1.06 1 116 THR -0.13 0.14 1 117 PHE 0.65 0.32 1 119 PHE 0.50 1.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18827_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 4.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.27 _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 7.49 _LACS_plot.Line_2_terminator_val_y_2 -1.23 _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 34 ILE -2.30 -2.32 0 10 ASP 1.03 0.25 1 11 HIS -4.63 3.55 1 13 LEU 4.52 -0.67 1 14 GLU 4.45 -0.69 1 15 HIS 3.15 1.38 1 18 VAL 4.80 -0.87 1 19 GLU 3.43 -0.25 1 20 SER 7.49 -4.15 1 21 ALA 3.73 -0.98 1 22 LYS 3.95 -0.49 1 23 ILE 4.36 -0.29 1 24 ARG 3.25 -1.84 1 25 ALA 1.96 -0.52 1 26 LYS 1.06 0.63 1 27 TYR -1.94 0.04 1 29 ASP -0.37 -0.75 1 30 ARG -5.00 2.82 1 31 VAL -3.51 0.99 1 33 VAL -4.98 2.89 1 35 VAL -3.70 1.75 1 36 GLU -6.67 5.09 1 37 LYS -0.69 0.10 1 38 VAL 2.40 -0.57 1 41 SER 0.02 0.20 1 42 GLN 1.26 -1.20 1 43 ILE -1.24 1.21 1 44 VAL 0.68 -0.02 1 45 ASP -1.46 1.31 1 46 ILE -2.76 2.28 1 47 ASP 1.47 -0.70 1 50 LYS -2.29 1.20 1 51 TYR -4.33 3.73 1 52 LEU -0.87 -0.55 1 55 SER 2.76 -0.40 1 56 ASP 0.13 -0.38 1 57 ILE -0.30 0.07 1 58 THR -3.47 2.26 1 59 VAL 5.58 -1.15 1 60 ALA 3.58 -0.59 1 61 GLN 3.67 -0.25 1 62 PHE 3.09 0.08 1 63 MET 4.87 -0.28 1 64 TRP 4.08 -0.49 1 65 ILE 6.01 -1.23 1 66 ILE 5.27 -2.76 1 67 ARG 4.75 -0.44 1 68 LYS 3.43 -1.21 1 69 ARG 3.38 -0.87 1 70 ILE 1.88 -1.54 1 71 GLN 3.81 -3.28 1 72 LEU -2.62 2.38 1 74 SER 4.46 -0.87 1 75 GLU 2.45 -1.29 1 76 LYS -1.48 -0.05 1 77 ALA -2.59 2.11 1 78 ILE -4.59 3.14 1 79 PHE -3.68 3.03 1 80 LEU -4.11 1.61 1 81 PHE -5.08 4.16 1 82 VAL -1.58 1.01 1 83 ASP 3.72 -1.34 1 85 THR -2.85 2.12 1 86 VAL -0.32 0.18 1 88 GLN 1.61 -0.38 1 89 SER 3.67 -0.17 1 90 SER -0.31 -0.12 1 91 LEU -0.43 0.89 1 92 THR -1.74 0.58 1 93 MET 5.04 -4.79 1 95 GLN 3.28 -0.20 1 96 LEU 2.86 -0.13 1 97 TYR 4.00 0.65 1 98 GLU 2.79 -0.36 1 99 LYS -0.07 1.81 1 100 GLU -1.95 0.51 1 101 LYS 2.60 -1.37 1 102 ASP -2.42 2.28 1 103 GLU 3.24 -0.86 1 104 ASP -0.21 -0.08 1 106 PHE 1.19 0.35 1 107 LEU -4.67 3.06 1 108 TYR 1.54 -1.07 1 109 VAL -3.56 2.20 1 110 ALA -6.78 3.44 1 111 TYR -7.09 4.62 1 112 SER -4.29 2.01 1 114 GLU -4.24 2.79 1 115 ASN 1.07 -2.13 1 116 THR -0.13 0.27 1 117 PHE 0.65 -0.33 1 119 PHE 0.50 0.69 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18827_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.09 _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 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 7.49 _LACS_plot.Line_2_terminator_val_y_2 -0.88 _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 111 TYR -7.09 -0.50 0 10 ASP 1.03 -0.41 1 13 LEU 4.52 -0.30 1 14 GLU 4.45 -0.35 1 15 HIS 3.15 -0.51 1 18 VAL 4.80 -0.44 1 19 GLU 3.43 -0.33 1 20 SER 7.49 -1.11 1 21 ALA 3.73 -0.29 1 22 LYS 3.95 -0.34 1 23 ILE 4.36 -0.43 1 24 ARG 3.25 -0.33 1 25 ALA 1.96 -0.25 1 26 LYS 1.06 -0.46 1 29 ASP -0.37 -0.01 1 30 ARG -5.00 0.57 1 33 VAL -4.98 0.88 1 34 ILE -2.30 0.69 1 36 GLU -6.67 0.55 1 37 LYS -0.69 -0.82 1 41 SER 0.02 -0.08 1 42 GLN 1.26 0.01 1 44 VAL 0.68 -0.13 1 45 ASP -1.46 0.03 1 50 LYS -2.29 0.71 1 51 TYR -4.33 -0.12 1 52 LEU -0.87 0.43 1 55 SER 2.76 -0.80 1 56 ASP 0.13 -0.10 1 57 ILE -0.30 0.42 1 58 THR -3.47 0.64 1 59 VAL 5.58 -0.44 1 60 ALA 3.58 -0.19 1 61 GLN 3.67 -0.25 1 62 PHE 3.09 -0.32 1 63 MET 4.87 -1.10 1 64 TRP 4.08 -0.57 1 65 ILE 6.01 -0.72 1 66 ILE 5.27 -0.97 1 67 ARG 4.75 -1.01 1 68 LYS 3.43 -0.41 1 69 ARG 3.38 -0.27 1 70 ILE 1.88 0.16 1 71 GLN 3.81 -0.57 1 74 SER 4.46 -0.52 1 75 GLU 2.45 -0.15 1 76 LYS -1.48 0.19 1 77 ALA -2.59 -0.24 1 78 ILE -4.59 0.46 1 79 PHE -3.68 -0.29 1 80 LEU -4.11 0.98 1 81 PHE -5.08 0.51 1 82 VAL -1.58 0.52 1 83 ASP 3.72 -0.34 1 85 THR -2.85 0.41 1 88 GLN 1.61 -0.18 1 89 SER 3.67 -0.55 1 90 SER -0.31 -0.05 1 91 LEU -0.43 -0.04 1 92 THR -1.74 0.43 1 93 MET 5.04 -0.08 1 95 GLN 3.28 -0.23 1 96 LEU 2.86 -0.32 1 97 TYR 4.00 -0.78 1 98 GLU 2.79 -0.60 1 99 LYS -0.07 -0.08 1 100 GLU -1.95 0.44 1 101 LYS 2.60 -0.46 1 102 ASP -2.42 -0.13 1 103 GLU 3.24 -0.22 1 104 ASP -0.21 0.35 1 106 PHE 1.19 0.03 1 107 LEU -4.67 0.42 1 108 TYR 1.54 -0.07 1 109 VAL -3.56 0.71 1 112 SER -4.29 0.18 1 114 GLU -4.24 0.22 1 115 ASN 1.07 -0.93 1 116 THR -0.13 -0.31 1 117 PHE 0.65 -0.61 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18827_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.67 _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 7.49 _LACS_plot.Line_2_terminator_val_y_2 2.82 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 PHE 0.50 4.48 0 10 ASP 1.03 -0.57 1 11 HIS -4.63 0.19 1 13 LEU 4.52 0.99 1 14 GLU 4.45 2.06 1 15 HIS 3.15 4.58 1 18 VAL 4.80 2.09 1 19 GLU 3.43 2.83 1 20 SER 7.49 2.32 1 21 ALA 3.73 3.34 1 22 LYS 3.95 3.26 1 23 ILE 4.36 1.28 1 24 ARG 3.25 1.92 1 25 ALA 1.96 1.34 1 26 LYS 1.06 -0.35 1 27 TYR -1.94 -2.05 1 29 ASP -0.37 -0.67 1 30 ARG -5.00 -1.76 1 31 VAL -3.51 -1.37 1 33 VAL -4.98 -2.41 1 34 ILE -2.30 -1.60 1 35 VAL -3.70 -0.58 1 36 GLU -6.67 -1.93 1 37 LYS -0.69 0.53 1 38 VAL 2.40 0.90 1 41 SER 0.02 1.17 1 42 GLN 1.26 -0.51 1 43 ILE -1.24 -3.79 1 44 VAL 0.68 -1.33 1 45 ASP -1.46 -1.94 1 46 ILE -2.76 -1.70 1 47 ASP 1.47 -0.88 1 50 LYS -2.29 -1.76 1 51 TYR -4.33 -1.90 1 52 LEU -0.87 -1.10 1 55 SER 2.76 -0.03 1 56 ASP 0.13 0.91 1 57 ILE -0.30 -0.55 1 58 THR -3.47 1.77 1 59 VAL 5.58 2.10 1 60 ALA 3.58 2.66 1 61 GLN 3.67 3.50 1 62 PHE 3.09 0.93 1 63 MET 4.87 1.28 1 64 TRP 4.08 1.69 1 65 ILE 6.01 2.59 1 66 ILE 5.27 0.91 1 67 ARG 4.75 2.04 1 68 LYS 3.43 2.97 1 69 ARG 3.38 2.47 1 70 ILE 1.88 -1.81 1 71 GLN 3.81 -0.65 1 72 LEU -2.62 -0.23 1 74 SER 4.46 0.23 1 75 GLU 2.45 -0.11 1 76 LYS -1.48 -1.57 1 77 ALA -2.59 -2.22 1 78 ILE -4.59 -4.85 1 79 PHE -3.68 -2.16 1 80 LEU -4.11 -2.92 1 81 PHE -5.08 0.53 1 82 VAL -1.58 0.00 1 83 ASP 3.72 -0.74 1 85 THR -2.85 -1.64 1 86 VAL -0.32 0.77 1 88 GLN 1.61 1.70 1 89 SER 3.67 -0.44 1 90 SER -0.31 0.96 1 91 LEU -0.43 -0.48 1 92 THR -1.74 1.82 1 93 MET 5.04 3.37 1 95 GLN 3.28 3.67 1 96 LEU 2.86 0.23 1 97 TYR 4.00 0.16 1 98 GLU 2.79 1.38 1 99 LYS -0.07 2.09 1 100 GLU -1.95 0.45 1 101 LYS 2.60 -1.96 1 102 ASP -2.42 0.86 1 103 GLU 3.24 0.48 1 104 ASP -0.21 1.11 1 106 PHE 1.19 -1.29 1 107 LEU -4.67 -4.25 1 108 TYR 1.54 -0.77 1 109 VAL -3.56 -2.39 1 110 ALA -6.78 -0.26 1 111 TYR -7.09 -2.75 1 112 SER -4.29 -1.17 1 114 GLU -4.24 -2.06 1 115 ASN 1.07 0.23 1 116 THR -0.13 -1.21 1 117 PHE 0.65 -0.35 1 stop_ save_