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 bmr18095_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.75 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.95 _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 8.60 _LACS_plot.Line_2_terminator_val_y_2 6.21 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 GLN 5.62 1.44 0 66 ARG 5.49 1.17 0 42 LYS -4.75 -1.46 0 10 GLU 1.65 1.66 1 11 ALA 2.53 2.25 1 12 LYS 2.84 2.13 1 13 THR 3.97 3.32 1 14 ARG 3.77 2.83 1 15 VAL 4.56 3.63 1 16 LYS 4.13 3.38 1 17 LEU 3.46 2.62 1 18 ASN 3.35 2.86 1 19 PHE 4.00 4.20 1 20 LEU 3.04 2.35 1 21 ASP 2.90 3.31 1 22 GLN 4.11 3.37 1 23 ILE 4.80 2.81 1 24 ALA 4.43 3.46 1 25 LYS 3.59 2.79 1 26 PHE 4.08 3.33 1 27 TRP 4.48 3.38 1 28 GLU 3.26 2.94 1 29 LEU 3.33 2.35 1 30 GLN 0.02 -0.96 1 32 SER -3.32 -2.67 1 33 SER -0.52 -0.25 1 34 LEU -0.06 0.48 1 35 LYS -2.01 -1.88 1 36 ILE 1.45 0.38 1 38 MET -2.14 -1.71 1 39 VAL -2.05 -0.39 1 40 GLU 3.45 0.75 1 41 ARG 5.66 2.10 1 43 ALA 1.59 0.84 1 44 LEU -0.81 0.14 1 45 ASP -0.19 -1.83 1 46 LEU 1.87 2.68 1 47 TYR 4.24 3.85 1 48 THR 8.42 5.84 1 49 LEU 3.97 3.62 1 50 HIS 4.56 5.91 1 51 ARG 4.36 3.26 1 52 ILE 5.16 3.82 1 53 VAL 6.95 4.79 1 54 GLN 5.37 3.34 1 55 GLU 3.30 2.94 1 56 GLU 0.06 -1.09 1 59 MET 4.68 5.05 1 60 GLU 5.09 3.72 1 61 GLN 3.87 2.91 1 62 THR 8.49 5.57 1 63 THR 5.78 4.73 1 64 LYS 4.39 3.90 1 65 ASP 0.97 0.10 1 67 LYS -1.13 -0.46 1 68 TRP 7.04 4.64 1 69 ALA 3.81 2.66 1 70 LYS 3.78 2.96 1 71 VAL 6.57 4.90 1 72 ALA 3.88 3.24 1 73 ASN 3.13 3.63 1 74 ARG 4.64 3.92 1 75 MET 0.51 1.05 1 77 TYR 1.49 1.11 1 79 SER 0.99 -0.19 1 81 LYS 2.62 1.91 1 82 SER 2.52 1.30 1 83 VAL 4.39 3.05 1 85 ALA 3.27 2.19 1 86 THR 5.63 4.20 1 87 LEU 4.50 3.28 1 88 LYS 2.93 2.29 1 89 ALA 3.61 2.19 1 90 HIS 1.64 3.72 1 91 TYR 4.02 5.12 1 92 GLU 2.95 3.28 1 93 ARG 1.61 2.66 1 94 ILE 1.31 2.94 1 95 LEU 0.37 1.35 1 96 HIS 8.60 7.74 1 98 PHE 2.50 1.75 1 99 GLU 3.24 2.28 1 100 VAL 4.42 3.41 1 101 TYR 2.28 2.84 1 102 THR 2.68 2.08 1 103 SER 1.97 1.67 1 105 LYS -0.32 -0.15 1 106 VAL 0.37 0.36 1 107 LEU 0.37 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18095_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.75 _LACS_plot.Line_1_terminator_val_y_1 2.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.06 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 -2.39 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 GLN 5.62 -4.18 0 66 ARG 5.49 -4.32 0 42 LYS -4.75 3.29 0 10 GLU 1.65 0.01 1 11 ALA 2.53 -0.28 1 12 LYS 2.84 -0.71 1 13 THR 3.97 -0.65 1 14 ARG 3.77 -0.94 1 15 VAL 4.56 -0.93 1 16 LYS 4.13 -0.75 1 17 LEU 3.46 -0.84 1 18 ASN 3.35 -0.49 1 19 PHE 4.00 0.20 1 20 LEU 3.04 -0.69 1 21 ASP 2.90 0.41 1 22 GLN 4.11 -0.74 1 23 ILE 4.80 -1.99 1 24 ALA 4.43 -0.97 1 25 LYS 3.59 -0.80 1 26 PHE 4.08 -0.75 1 27 TRP 4.48 -1.10 1 28 GLU 3.26 -0.32 1 29 LEU 3.33 -0.98 1 30 GLN 0.02 -0.98 1 32 SER -3.32 0.65 1 33 SER -0.52 0.27 1 34 LEU -0.06 0.54 1 35 LYS -2.01 0.13 1 36 ILE 1.45 -1.07 1 38 MET -2.14 0.43 1 39 VAL -2.05 1.66 1 40 GLU 3.45 -2.70 1 41 ARG 5.66 -3.56 1 43 ALA 1.59 -0.75 1 44 LEU -0.81 0.95 1 45 ASP -0.19 -1.64 1 46 LEU 1.87 0.81 1 47 TYR 4.24 -0.39 1 48 THR 8.42 -2.58 1 49 LEU 3.97 -0.35 1 50 HIS 4.56 1.35 1 51 ARG 4.36 -1.10 1 52 ILE 5.16 -1.34 1 53 VAL 6.95 -2.16 1 54 GLN 5.37 -2.03 1 55 GLU 3.30 -0.36 1 56 GLU 0.06 -1.15 1 59 MET 4.68 0.37 1 60 GLU 5.09 -1.37 1 61 GLN 3.87 -0.96 1 62 THR 8.49 -2.92 1 63 THR 5.78 -1.05 1 64 LYS 4.39 -0.49 1 65 ASP 0.97 -0.87 1 67 LYS -1.13 0.67 1 68 TRP 7.04 -2.40 1 69 ALA 3.81 -1.15 1 70 LYS 3.78 -0.82 1 71 VAL 6.57 -1.67 1 72 ALA 3.88 -0.64 1 73 ASN 3.13 0.50 1 74 ARG 4.64 -0.72 1 75 MET 0.51 0.54 1 77 TYR 1.49 -0.38 1 79 SER 0.99 -1.18 1 81 LYS 2.62 -0.71 1 82 SER 2.52 -1.22 1 83 VAL 4.39 -1.34 1 85 ALA 3.27 -1.08 1 86 THR 5.63 -1.43 1 87 LEU 4.50 -1.22 1 88 LYS 2.93 -0.64 1 89 ALA 3.61 -1.42 1 90 HIS 1.64 2.08 1 91 TYR 4.02 1.10 1 92 GLU 2.95 0.33 1 93 ARG 1.61 1.05 1 94 ILE 1.31 1.63 1 95 LEU 0.37 0.98 1 96 HIS 8.60 -0.86 1 98 PHE 2.50 -0.75 1 99 GLU 3.24 -0.96 1 100 VAL 4.42 -1.01 1 101 TYR 2.28 0.56 1 102 THR 2.68 -0.60 1 103 SER 1.97 -0.30 1 105 LYS -0.32 0.17 1 106 VAL 0.37 -0.01 1 107 LEU 0.37 1.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18095_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.75 _LACS_plot.Line_1_terminator_val_y_1 0.40 _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 0.15 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 -0.81 _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 88 LYS 2.93 -2.47 0 10 GLU 1.65 -0.19 1 11 ALA 2.53 -0.18 1 12 LYS 2.84 -0.17 1 13 THR 3.97 -0.35 1 14 ARG 3.77 -0.31 1 15 VAL 4.56 -0.33 1 16 LYS 4.13 -0.93 1 17 LEU 3.46 -0.26 1 18 ASN 3.35 -0.20 1 19 PHE 4.00 -0.34 1 20 LEU 3.04 -0.28 1 21 ASP 2.90 -0.21 1 22 GLN 4.11 -0.31 1 23 ILE 4.80 -0.87 1 24 ALA 4.43 -0.13 1 25 LYS 3.59 -0.28 1 26 PHE 4.08 -0.63 1 27 TRP 4.48 -0.65 1 28 GLU 3.26 -0.16 1 29 LEU 3.33 -0.28 1 30 GLN 0.02 -0.26 1 32 SER -3.32 0.28 1 33 SER -0.52 -0.07 1 34 LEU -0.06 -0.38 1 35 LYS -2.01 0.15 1 36 ILE 1.45 -0.46 1 38 MET -2.14 0.28 1 39 VAL -2.05 0.08 1 40 GLU 3.45 -0.58 1 41 ARG 5.66 -0.63 1 42 LYS -4.75 0.35 1 43 ALA 1.59 0.00 1 44 LEU -0.81 -0.16 1 45 ASP -0.19 0.11 1 46 LEU 1.87 -0.36 1 47 TYR 4.24 -0.87 1 48 THR 8.42 -0.52 1 49 LEU 3.97 0.04 1 50 HIS 4.56 -0.24 1 51 ARG 4.36 -0.78 1 52 ILE 5.16 -0.66 1 53 VAL 6.95 -1.06 1 54 GLN 5.37 -0.66 1 55 GLU 3.30 -0.43 1 56 GLU 0.06 -0.18 1 59 MET 4.68 -1.29 1 60 GLU 5.09 -0.35 1 61 GLN 3.87 -0.63 1 62 THR 8.49 -0.92 1 63 THR 5.78 -0.11 1 64 LYS 4.39 -0.35 1 65 ASP 0.97 0.09 1 66 ARG 5.49 -0.08 1 67 LYS -1.13 0.44 1 68 TRP 7.04 -0.75 1 69 ALA 3.81 -0.07 1 70 LYS 3.78 -0.25 1 71 VAL 6.57 -0.88 1 72 ALA 3.88 -0.29 1 73 ASN 3.13 -0.16 1 74 ARG 4.64 -0.27 1 75 MET 0.51 -0.30 1 76 GLN 5.62 -0.45 1 77 TYR 1.49 0.05 1 79 SER 0.99 0.27 1 81 LYS 2.62 -0.10 1 82 SER 2.52 -0.58 1 83 VAL 4.39 -0.36 1 85 ALA 3.27 -0.46 1 86 THR 5.63 -0.60 1 87 LEU 4.50 -0.44 1 89 ALA 3.61 -0.28 1 90 HIS 1.64 0.02 1 91 TYR 4.02 -0.76 1 92 GLU 2.95 -0.30 1 93 ARG 1.61 0.01 1 94 ILE 1.31 0.10 1 95 LEU 0.37 0.28 1 96 HIS 8.60 -0.14 1 98 PHE 2.50 -1.88 1 99 GLU 3.24 -0.61 1 100 VAL 4.42 -0.54 1 101 TYR 2.28 -0.37 1 102 THR 2.68 -0.64 1 103 SER 1.97 -0.21 1 105 LYS -0.32 -0.01 1 106 VAL 0.37 -0.04 1 107 LEU 0.37 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18095_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.75 _LACS_plot.Line_1_terminator_val_y_1 -1.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.65 _LACS_plot.Line_2_terminator_val_x_2 8.49 _LACS_plot.Line_2_terminator_val_y_2 2.99 _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 42 LYS -4.75 -1.45 0 82 SER 2.52 5.97 0 10 GLU 1.65 1.29 1 11 ALA 2.53 1.63 1 12 LYS 2.84 1.85 1 13 THR 3.97 0.74 1 14 ARG 3.77 1.61 1 15 VAL 4.56 1.92 1 16 LYS 4.13 1.37 1 17 LEU 3.46 2.11 1 18 ASN 3.35 1.98 1 19 PHE 4.00 0.28 1 20 LEU 3.04 0.20 1 21 ASP 2.90 2.29 1 22 GLN 4.11 2.75 1 23 ILE 4.80 0.98 1 24 ALA 4.43 3.00 1 25 LYS 3.59 2.79 1 26 PHE 4.08 1.28 1 27 TRP 4.48 2.66 1 28 GLU 3.26 4.59 1 29 LEU 3.33 1.12 1 30 GLN 0.02 0.57 1 32 SER -3.32 -1.82 1 33 SER -0.52 -0.86 1 34 LEU -0.06 -2.32 1 35 LYS -2.01 -1.40 1 38 MET -2.14 0.39 1 39 VAL -2.05 -1.03 1 40 GLU 3.45 -1.19 1 41 ARG 5.66 -1.52 1 43 ALA 1.59 0.80 1 44 LEU -0.81 -2.45 1 45 ASP -0.19 -0.82 1 46 LEU 1.87 0.29 1 47 TYR 4.24 0.73 1 48 THR 8.42 0.45 1 49 LEU 3.97 -0.59 1 50 HIS 4.56 2.54 1 51 ARG 4.36 3.01 1 52 ILE 5.16 1.40 1 53 VAL 6.95 2.86 1 54 GLN 5.37 0.62 1 55 GLU 3.30 2.09 1 56 GLU 0.06 -0.98 1 59 MET 4.68 0.67 1 60 GLU 5.09 2.86 1 61 GLN 3.87 1.59 1 62 THR 8.49 2.01 1 63 THR 5.78 3.20 1 64 LYS 4.39 1.29 1 65 ASP 0.97 -1.70 1 66 ARG 5.49 1.18 1 67 LYS -1.13 0.46 1 68 TRP 7.04 2.25 1 69 ALA 3.81 1.91 1 70 LYS 3.78 2.53 1 71 VAL 6.57 1.06 1 72 ALA 3.88 1.47 1 73 ASN 3.13 4.92 1 74 ARG 4.64 1.77 1 75 MET 0.51 -2.45 1 76 GLN 5.62 -0.38 1 81 LYS 2.62 1.51 1 83 VAL 4.39 1.53 1 85 ALA 3.27 2.83 1 86 THR 5.63 0.58 1 87 LEU 4.50 -0.20 1 88 LYS 2.93 0.69 1 89 ALA 3.61 3.43 1 90 HIS 1.64 4.35 1 91 TYR 4.02 4.01 1 92 GLU 2.95 1.38 1 93 ARG 1.61 1.32 1 94 ILE 1.31 0.44 1 95 LEU 0.37 0.99 1 98 PHE 2.50 0.86 1 99 GLU 3.24 2.53 1 100 VAL 4.42 2.25 1 101 TYR 2.28 1.76 1 102 THR 2.68 0.95 1 103 SER 1.97 0.62 1 105 LYS -0.32 -0.72 1 106 VAL 0.37 -1.13 1 stop_ save_