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 bmr30290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 -5.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.29 _LACS_plot.Line_2_terminator_val_x_2 9.85 _LACS_plot.Line_2_terminator_val_y_2 5.17 _LACS_plot.Y_axis_chem_shift_offset 1.81 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 ALA 9.85 4.97 0 52 LYS -0.55 -3.98 0 80 THR -1.45 -0.01 0 34 TRP -3.07 -5.35 0 74 GLN 4.49 -1.07 0 15 PHE 5.85 4.13 0 10 VAL -3.95 -4.08 1 11 THR -6.64 -4.93 1 12 ASP 4.12 2.12 1 13 ASP 1.95 0.18 1 14 SER -1.05 -1.53 1 16 SER 5.17 1.63 1 17 THR 4.02 1.38 1 18 ASP 1.92 0.51 1 19 VAL 2.97 -0.61 1 20 LEU 6.30 0.76 1 22 SER -0.82 -2.59 1 23 SER 2.02 -0.30 1 24 LYS -1.18 -2.30 1 26 VAL -4.88 -4.53 1 27 LEU -3.90 -3.93 1 28 VAL -0.78 -2.80 1 29 ASP -0.96 -3.73 1 30 PHE 1.16 -1.93 1 31 TRP -6.23 -5.01 1 32 ALA -4.88 -3.41 1 33 THR 3.67 1.22 1 39 LYS 3.85 0.62 1 40 MET 2.74 0.05 1 41 VAL 0.31 -1.50 1 44 VAL 4.99 1.41 1 45 LEU 3.97 0.60 1 46 GLU 3.53 0.33 1 47 GLU 3.57 1.30 1 48 ILE 5.71 2.66 1 49 ALA 3.00 0.47 1 50 ALA 2.50 -0.07 1 51 GLU 1.11 -0.09 1 54 ASP 2.49 -0.55 1 55 GLN -1.54 -1.22 1 56 LEU -4.11 -2.64 1 57 THR -0.91 -2.07 1 58 VAL 0.21 -2.34 1 59 ALA -8.14 -5.86 1 60 LYS -3.62 -3.48 1 61 ILE -4.38 -3.69 1 62 ASP -2.12 -4.40 1 63 VAL 3.73 0.22 1 64 ASP 3.04 0.40 1 65 ALA -2.04 -2.57 1 66 ASN -0.87 -1.34 1 68 ALA 4.85 1.63 1 69 THR 6.95 3.43 1 70 ALA 4.29 0.80 1 71 ARG 4.33 1.10 1 72 ASP 4.26 0.99 1 73 PHE 2.42 -1.17 1 75 VAL 4.54 -0.39 1 76 VAL -0.63 -2.37 1 77 SER -2.22 -3.20 1 78 ILE -3.14 -4.25 1 81 MET -5.33 -3.81 1 82 ILE -4.26 -3.04 1 83 LEU -3.99 -3.89 1 84 PHE -2.49 -2.50 1 85 LYS -3.23 -1.93 1 86 ASP 3.26 -0.30 1 88 ALA -3.85 -3.29 1 90 VAL -0.80 -2.18 1 91 LYS -3.19 -2.37 1 92 ARG -2.92 -2.84 1 93 ILE -2.37 -2.31 1 94 VAL -0.46 -1.93 1 96 ALA 0.12 -1.96 1 97 LYS -5.46 -4.01 1 99 LYS 5.11 3.06 1 100 ALA 4.45 0.87 1 101 ALA 2.73 0.29 1 102 LEU 3.70 1.27 1 103 LEU 4.58 1.17 1 104 ARG 4.78 1.58 1 105 GLU 2.62 0.30 1 106 LEU 1.31 -0.76 1 107 SER 4.35 1.87 1 108 ASP 1.57 -1.04 1 109 ALA -2.55 -2.49 1 110 LEU 0.33 -0.71 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 2.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.29 _LACS_plot.Line_2_terminator_val_x_2 9.85 _LACS_plot.Line_2_terminator_val_y_2 -4.68 _LACS_plot.Y_axis_chem_shift_offset 1.81 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 ALA 9.85 -4.88 0 52 LYS -0.55 -3.43 0 80 THR -1.45 1.44 0 34 TRP -3.07 -2.28 0 74 GLN 4.49 -5.56 0 15 PHE 5.85 -1.72 0 10 VAL -3.95 -0.13 1 11 THR -6.64 1.71 1 12 ASP 4.12 -2.00 1 13 ASP 1.95 -1.77 1 14 SER -1.05 -0.48 1 16 SER 5.17 -3.54 1 17 THR 4.02 -2.64 1 18 ASP 1.92 -1.41 1 19 VAL 2.97 -3.58 1 20 LEU 6.30 -5.54 1 22 SER -0.82 -1.77 1 23 SER 2.02 -2.32 1 24 LYS -1.18 -1.12 1 26 VAL -4.88 0.35 1 27 LEU -3.90 -0.03 1 28 VAL -0.78 -2.02 1 29 ASP -0.96 -2.77 1 30 PHE 1.16 -3.09 1 31 TRP -6.23 1.22 1 32 ALA -4.88 1.47 1 33 THR 3.67 -2.45 1 39 LYS 3.85 -3.23 1 40 MET 2.74 -2.69 1 41 VAL 0.31 -1.81 1 44 VAL 4.99 -3.58 1 45 LEU 3.97 -3.37 1 46 GLU 3.53 -3.20 1 47 GLU 3.57 -2.27 1 48 ILE 5.71 -3.05 1 49 ALA 3.00 -2.53 1 50 ALA 2.50 -2.57 1 51 GLU 1.11 -1.20 1 54 ASP 2.49 -3.04 1 55 GLN -1.54 0.32 1 56 LEU -4.11 1.47 1 57 THR -0.91 -1.16 1 58 VAL 0.21 -2.55 1 59 ALA -8.14 2.28 1 60 LYS -3.62 0.14 1 61 ILE -4.38 0.69 1 62 ASP -2.12 -2.28 1 63 VAL 3.73 -3.51 1 64 ASP 3.04 -2.64 1 65 ALA -2.04 -0.53 1 66 ASN -0.87 -0.47 1 68 ALA 4.85 -3.22 1 69 THR 6.95 -3.52 1 70 ALA 4.29 -3.49 1 71 ARG 4.33 -3.23 1 72 ASP 4.26 -3.27 1 73 PHE 2.42 -3.59 1 75 VAL 4.54 -4.93 1 76 VAL -0.63 -1.74 1 77 SER -2.22 -0.98 1 78 ILE -3.14 -1.11 1 81 MET -5.33 1.52 1 82 ILE -4.26 1.22 1 83 LEU -3.99 0.10 1 84 PHE -2.49 -0.01 1 85 LYS -3.23 1.30 1 86 ASP 3.26 -3.56 1 88 ALA -3.85 0.56 1 90 VAL -0.80 -1.38 1 91 LYS -3.19 0.82 1 92 ARG -2.92 0.08 1 93 ILE -2.37 0.06 1 94 VAL -0.46 -1.47 1 96 ALA 0.12 -2.08 1 97 LYS -5.46 1.45 1 99 LYS 5.11 -2.05 1 100 ALA 4.45 -3.58 1 101 ALA 2.73 -2.44 1 102 LEU 3.70 -2.43 1 103 LEU 4.58 -3.41 1 104 ARG 4.78 -3.20 1 105 GLU 2.62 -2.32 1 106 LEU 1.31 -2.07 1 107 SER 4.35 -2.48 1 108 ASP 1.57 -2.61 1 109 ALA -2.55 0.06 1 110 LEU 0.33 -1.04 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 0.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 9.85 _LACS_plot.Line_2_terminator_val_y_2 -1.03 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 MET -5.33 1.67 0 62 ASP -2.12 -1.02 0 10 VAL -3.95 0.33 1 11 THR -6.64 0.40 1 12 ASP 4.12 -0.29 1 13 ASP 1.95 -0.08 1 14 SER -1.05 0.21 1 15 PHE 5.85 -1.05 1 16 SER 5.17 -0.47 1 17 THR 4.02 -0.36 1 18 ASP 1.92 -0.44 1 19 VAL 2.97 -0.34 1 20 LEU 6.30 -0.70 1 22 SER -0.82 -0.18 1 23 SER 2.02 0.00 1 24 LYS -1.18 0.14 1 26 VAL -4.88 0.90 1 27 LEU -3.90 0.53 1 28 VAL -0.78 0.37 1 29 ASP -0.96 0.36 1 30 PHE 1.16 0.50 1 31 TRP -6.23 0.46 1 32 ALA -4.88 -0.51 1 33 THR 3.67 -0.39 1 34 TRP -3.07 -0.13 1 39 LYS 3.85 -0.25 1 40 MET 2.74 -0.21 1 41 VAL 0.31 0.01 1 42 ALA 9.85 -0.73 1 44 VAL 4.99 -0.48 1 45 LEU 3.97 -0.54 1 46 GLU 3.53 -0.50 1 47 GLU 3.57 -0.33 1 48 ILE 5.71 -0.73 1 49 ALA 3.00 -0.54 1 50 ALA 2.50 -0.20 1 51 GLU 1.11 -0.25 1 52 LYS -0.55 0.38 1 54 ASP 2.49 -0.22 1 55 GLN -1.54 -0.01 1 56 LEU -4.11 0.34 1 57 THR -0.91 0.03 1 58 VAL 0.21 0.62 1 59 ALA -8.14 1.22 1 60 LYS -3.62 0.87 1 61 ILE -4.38 0.51 1 63 VAL 3.73 -0.19 1 64 ASP 3.04 -0.16 1 65 ALA -2.04 -0.01 1 66 ASN -0.87 0.21 1 68 ALA 4.85 -0.38 1 69 THR 6.95 -0.64 1 70 ALA 4.29 -0.57 1 71 ARG 4.33 -0.31 1 72 ASP 4.26 -0.51 1 73 PHE 2.42 -0.11 1 74 GLN 4.49 -0.56 1 75 VAL 4.54 -0.42 1 76 VAL -0.63 0.16 1 77 SER -2.22 0.21 1 78 ILE -3.14 0.18 1 80 THR -1.45 0.62 1 82 ILE -4.26 0.75 1 83 LEU -3.99 0.78 1 84 PHE -2.49 0.45 1 85 LYS -3.23 0.23 1 86 ASP 3.26 -0.23 1 88 ALA -3.85 0.56 1 90 VAL -0.80 0.25 1 91 LYS -3.19 0.19 1 92 ARG -2.92 0.61 1 93 ILE -2.37 0.13 1 94 VAL -0.46 0.35 1 96 ALA 0.12 -0.36 1 97 LYS -5.46 0.19 1 99 LYS 5.11 -0.84 1 100 ALA 4.45 -0.37 1 101 ALA 2.73 -0.32 1 102 LEU 3.70 -0.51 1 103 LEU 4.58 -0.52 1 104 ARG 4.78 -0.30 1 105 GLU 2.62 -0.26 1 106 LEU 1.31 -0.33 1 107 SER 4.35 -0.46 1 108 ASP 1.57 -0.10 1 109 ALA -2.55 0.14 1 110 LEU 0.33 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.14 _LACS_plot.Line_1_terminator_val_y_1 -3.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 9.85 _LACS_plot.Line_2_terminator_val_y_2 3.43 _LACS_plot.Y_axis_chem_shift_offset 0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 ALA -4.88 1.51 0 110 LEU 0.33 4.26 0 11 THR -6.64 0.85 0 42 ALA 9.85 0.69 0 10 VAL -3.95 -2.91 1 12 ASP 4.12 2.39 1 13 ASP 1.95 0.87 1 14 SER -1.05 0.97 1 15 PHE 5.85 2.18 1 16 SER 5.17 1.19 1 17 THR 4.02 1.00 1 18 ASP 1.92 -0.16 1 19 VAL 2.97 1.06 1 20 LEU 6.30 0.30 1 22 SER -0.82 2.28 1 23 SER 2.02 -0.19 1 24 LYS -1.18 -0.29 1 26 VAL -4.88 -1.05 1 27 LEU -3.90 -4.09 1 28 VAL -0.78 -1.80 1 29 ASP -0.96 -2.40 1 30 PHE 1.16 -2.33 1 31 TRP -6.23 -4.73 1 33 THR 3.67 0.39 1 34 TRP -3.07 -0.34 1 39 LYS 3.85 1.95 1 40 MET 2.74 1.65 1 41 VAL 0.31 0.12 1 44 VAL 4.99 1.81 1 45 LEU 3.97 1.11 1 46 GLU 3.53 2.56 1 47 GLU 3.57 2.53 1 48 ILE 5.71 0.63 1 49 ALA 3.00 1.96 1 50 ALA 2.50 2.32 1 51 GLU 1.11 2.22 1 52 LYS -0.55 1.08 1 54 ASP 2.49 0.53 1 55 GLN -1.54 -1.15 1 56 LEU -4.11 -3.40 1 57 THR -0.91 -2.11 1 58 VAL 0.21 -3.42 1 59 ALA -8.14 -1.97 1 60 LYS -3.62 -1.67 1 61 ILE -4.38 -4.56 1 62 ASP -2.12 2.93 1 63 VAL 3.73 0.82 1 64 ASP 3.04 1.37 1 65 ALA -2.04 -1.00 1 66 ASN -0.87 -3.24 1 68 ALA 4.85 2.22 1 69 THR 6.95 1.96 1 70 ALA 4.29 0.87 1 71 ARG 4.33 4.40 1 72 ASP 4.26 1.14 1 73 PHE 2.42 -2.39 1 74 GLN 4.49 -1.02 1 75 VAL 4.54 -0.63 1 76 VAL -0.63 -0.97 1 77 SER -2.22 -2.53 1 78 ILE -3.14 -1.59 1 80 THR -1.45 -2.63 1 81 MET -5.33 -1.54 1 82 ILE -4.26 -1.66 1 83 LEU -3.99 -3.43 1 84 PHE -2.49 -0.54 1 85 LYS -3.23 -0.62 1 86 ASP 3.26 0.03 1 88 ALA -3.85 -1.87 1 90 VAL -0.80 -0.34 1 91 LYS -3.19 -3.47 1 92 ARG -2.92 -1.96 1 93 ILE -2.37 -2.06 1 94 VAL -0.46 -0.30 1 96 ALA 0.12 -1.01 1 97 LYS -5.46 -1.00 1 99 LYS 5.11 0.84 1 100 ALA 4.45 3.06 1 101 ALA 2.73 2.46 1 102 LEU 3.70 1.25 1 103 LEU 4.58 2.74 1 104 ARG 4.78 2.99 1 105 GLU 2.62 1.93 1 106 LEU 1.31 0.85 1 107 SER 4.35 0.96 1 108 ASP 1.57 -0.09 1 109 ALA -2.55 -1.75 1 stop_ save_