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 bmr19633_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.33 _LACS_plot.Line_1_terminator_val_y_1 -2.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 4.96 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 ARG 5.66 -0.21 0 10 MET 1.58 1.71 1 11 ALA 1.72 1.42 1 12 SER 1.14 1.10 1 13 LYS 3.21 2.72 1 14 ARG 4.41 3.10 1 15 ASP 2.74 2.07 1 16 LYS 3.81 3.37 1 17 ILE 4.78 3.74 1 18 ALA 3.12 2.26 1 19 ASP 1.96 3.21 1 20 ILE 5.48 3.86 1 21 GLN 4.47 4.42 1 22 GLU 3.41 2.68 1 23 ALA 3.16 2.87 1 24 LEU 3.38 3.12 1 25 ALA 1.27 1.01 1 26 HIS 0.13 1.79 1 27 ALA 1.41 1.83 1 28 ASP 1.96 -0.48 1 29 ALA 1.47 1.98 1 30 ASN 0.41 -1.54 1 31 ALA 2.82 0.83 1 32 ASP -1.15 -1.24 1 33 GLN 6.25 2.71 1 34 HIS -2.70 -0.94 1 35 LEU -2.34 -1.95 1 36 ASP -0.91 -0.07 1 37 PHE 6.01 5.08 1 38 ASP 4.55 3.87 1 39 GLU 2.55 2.63 1 40 TRP 1.47 2.20 1 41 ARG 4.93 3.42 1 42 GLN 4.65 3.46 1 43 GLU 2.76 1.95 1 44 LEU 4.55 3.10 1 45 LYS 5.08 2.92 1 47 ARG -0.09 0.14 1 49 HIS -1.04 1.94 1 50 ALA -1.41 -0.97 1 51 ASP 4.70 4.17 1 52 ALA 3.59 2.92 1 53 ASP 2.74 2.84 1 54 ILE 5.60 5.30 1 55 GLU 2.62 2.77 1 56 ALA 3.41 3.14 1 57 VAL 4.70 4.27 1 58 PHE 4.38 4.78 1 59 ALA 2.88 2.01 1 60 LYS 3.12 2.34 1 61 TYR 0.98 1.66 1 62 ASP 0.26 -1.70 1 63 VAL 4.31 3.24 1 64 ASP 0.08 -1.31 1 66 ASP 0.44 -0.50 1 68 VAL -4.33 -1.01 1 69 LEU -2.60 -2.76 1 70 ASP -0.82 -1.65 1 71 ALA 4.42 3.81 1 72 GLU 3.56 3.09 1 73 GLU 2.37 2.52 1 74 GLN 3.17 3.97 1 75 MET 3.90 3.20 1 76 LYS 4.33 3.36 1 77 MET 3.99 4.12 1 78 ALA 4.28 3.09 1 79 HIS 4.02 3.57 1 80 ASP 3.55 2.99 1 81 LEU 3.64 2.77 1 82 GLU 3.03 2.32 1 84 GLN 2.33 2.23 1 85 LYS 3.52 2.95 1 86 SER 2.57 2.07 1 87 ASP 2.09 1.94 1 88 LEU 2.33 1.95 1 89 ASN 2.29 1.64 1 90 ASN 1.96 1.54 1 91 GLN 1.78 1.78 1 92 LEU 1.31 1.11 1 93 ALA 0.89 0.78 1 94 GLU -0.14 0.05 1 95 LEU 0.02 0.21 1 96 GLU 0.18 1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19633_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.33 _LACS_plot.Line_1_terminator_val_y_1 2.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.92 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 -1.28 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 ARG 5.66 -5.87 0 10 MET 1.58 0.13 1 11 ALA 1.72 -0.30 1 12 SER 1.14 -0.04 1 13 LYS 3.21 -0.49 1 14 ARG 4.41 -1.31 1 15 ASP 2.74 -0.67 1 16 LYS 3.81 -0.44 1 17 ILE 4.78 -1.04 1 18 ALA 3.12 -0.86 1 19 ASP 1.96 1.25 1 20 ILE 5.48 -1.62 1 21 GLN 4.47 -0.05 1 22 GLU 3.41 -0.73 1 23 ALA 3.16 -0.29 1 24 LEU 3.38 -0.26 1 25 ALA 1.27 -0.26 1 26 HIS 0.13 1.66 1 27 ALA 1.41 0.42 1 28 ASP 1.96 -2.44 1 29 ALA 1.47 0.51 1 30 ASN 0.41 -1.95 1 31 ALA 2.82 -1.99 1 32 ASP -1.15 -0.09 1 33 GLN 6.25 -3.54 1 34 HIS -2.70 1.76 1 35 LEU -2.34 0.39 1 36 ASP -0.91 0.84 1 37 PHE 6.01 -0.93 1 38 ASP 4.55 -0.68 1 39 GLU 2.55 0.08 1 40 TRP 1.47 0.73 1 41 ARG 4.93 -1.51 1 42 GLN 4.65 -1.19 1 43 GLU 2.76 -0.81 1 44 LEU 4.55 -1.45 1 45 LYS 5.08 -2.16 1 47 ARG -0.09 0.23 1 49 HIS -1.04 2.98 1 50 ALA -1.41 0.44 1 51 ASP 4.70 -0.53 1 52 ALA 3.59 -0.67 1 53 ASP 2.74 0.10 1 54 ILE 5.60 -0.30 1 55 GLU 2.62 0.15 1 56 ALA 3.41 -0.27 1 57 VAL 4.70 -0.43 1 58 PHE 4.38 0.40 1 59 ALA 2.88 -0.87 1 60 LYS 3.12 -0.78 1 61 TYR 0.98 0.68 1 62 ASP 0.26 -1.96 1 63 VAL 4.31 -1.07 1 64 ASP 0.08 -1.39 1 66 ASP 0.44 -0.94 1 68 VAL -4.33 3.32 1 69 LEU -2.60 -0.16 1 70 ASP -0.82 -0.83 1 71 ALA 4.42 -0.61 1 72 GLU 3.56 -0.47 1 73 GLU 2.37 0.15 1 74 GLN 3.17 0.80 1 75 MET 3.90 -0.70 1 76 LYS 4.33 -0.97 1 77 MET 3.99 0.13 1 78 ALA 4.28 -1.19 1 79 HIS 4.02 -0.45 1 80 ASP 3.55 -0.56 1 81 LEU 3.64 -0.87 1 82 GLU 3.03 -0.71 1 84 GLN 2.33 -0.10 1 85 LYS 3.52 -0.57 1 86 SER 2.57 -0.50 1 87 ASP 2.09 -0.15 1 88 LEU 2.33 -0.38 1 89 ASN 2.29 -0.65 1 90 ASN 1.96 -0.42 1 91 GLN 1.78 0.00 1 92 LEU 1.31 -0.20 1 93 ALA 0.89 -0.11 1 94 GLU -0.14 0.19 1 95 LEU 0.02 0.19 1 96 GLU 0.18 1.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19633_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.33 _LACS_plot.Line_1_terminator_val_y_1 0.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 LEU -2.34 1.05 0 77 MET 3.99 -1.33 0 69 LEU -2.60 1.11 0 10 MET 1.58 -0.22 1 11 ALA 1.72 -0.14 1 12 SER 1.14 -0.07 1 13 LYS 3.21 -0.20 1 14 ARG 4.41 -0.41 1 15 ASP 2.74 -0.17 1 16 LYS 3.81 -0.14 1 17 ILE 4.78 -0.51 1 18 ALA 3.12 0.06 1 19 ASP 1.96 -0.22 1 20 ILE 5.48 -0.68 1 21 GLN 4.47 -0.46 1 22 GLU 3.41 -0.28 1 23 ALA 3.16 -0.39 1 24 LEU 3.38 -0.33 1 25 ALA 1.27 -0.09 1 26 HIS 0.13 -0.04 1 27 ALA 1.41 -0.09 1 28 ASP 1.96 -0.03 1 29 ALA 1.47 -0.14 1 30 ASN 0.41 0.05 1 31 ALA 2.82 -0.32 1 32 ASP -1.15 0.16 1 33 GLN 6.25 -0.53 1 34 HIS -2.70 -0.04 1 36 ASP -0.91 0.50 1 37 PHE 6.01 -1.07 1 38 ASP 4.55 -0.38 1 39 GLU 2.55 -0.33 1 40 TRP 1.47 -0.56 1 41 ARG 4.93 -0.87 1 42 GLN 4.65 -0.41 1 43 GLU 2.76 -0.31 1 44 LEU 4.55 -0.62 1 45 LYS 5.08 -0.17 1 47 ARG -0.09 -0.06 1 49 HIS -1.04 -0.37 1 50 ALA -1.41 0.08 1 51 ASP 4.70 -0.29 1 52 ALA 3.59 -0.11 1 53 ASP 2.74 0.01 1 54 ILE 5.60 -0.58 1 55 GLU 2.62 0.04 1 56 ALA 3.41 -0.08 1 57 VAL 4.70 -0.23 1 58 PHE 4.38 -1.27 1 59 ALA 2.88 -0.20 1 60 LYS 3.12 -0.55 1 61 TYR 0.98 -0.31 1 62 ASP 0.26 -0.04 1 63 VAL 4.31 -0.43 1 64 ASP 0.08 -0.05 1 66 ASP 0.44 -0.16 1 67 ARG 5.66 -0.47 1 68 VAL -4.33 0.56 1 70 ASP -0.82 -0.24 1 71 ALA 4.42 -0.44 1 72 GLU 3.56 -0.29 1 73 GLU 2.37 -0.15 1 74 GLN 3.17 -0.69 1 75 MET 3.90 -0.36 1 76 LYS 4.33 -0.24 1 78 ALA 4.28 -0.50 1 79 HIS 4.02 -0.33 1 80 ASP 3.55 -0.14 1 81 LEU 3.64 -0.33 1 82 GLU 3.03 -0.36 1 84 GLN 2.33 -0.11 1 85 LYS 3.52 -0.35 1 86 SER 2.57 -0.15 1 87 ASP 2.09 -0.09 1 88 LEU 2.33 -0.17 1 89 ASN 2.29 -0.14 1 90 ASN 1.96 -0.11 1 91 GLN 1.78 -0.12 1 92 LEU 1.31 -0.13 1 93 ALA 0.89 -0.07 1 94 GLU -0.14 -0.07 1 95 LEU 0.02 0.00 1 96 GLU 0.18 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19633_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.33 _LACS_plot.Line_1_terminator_val_y_1 -1.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 2.14 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 GLU 0.18 3.91 0 33 GLN 6.25 -2.10 0 10 MET 1.58 -0.43 1 11 ALA 1.72 -0.15 1 12 SER 1.14 0.75 1 13 LYS 3.21 0.51 1 14 ARG 4.41 0.78 1 15 ASP 2.74 0.95 1 16 LYS 3.81 1.17 1 17 ILE 4.78 0.58 1 18 ALA 3.12 1.84 1 19 ASP 1.96 1.25 1 20 ILE 5.48 0.61 1 21 GLN 4.47 2.98 1 22 GLU 3.41 1.89 1 23 ALA 3.16 1.33 1 24 LEU 3.38 0.17 1 25 ALA 1.27 0.39 1 26 HIS 0.13 0.71 1 27 ALA 1.41 -0.52 1 28 ASP 1.96 -0.15 1 29 ALA 1.47 -0.18 1 30 ASN 0.41 -1.18 1 31 ALA 2.82 -2.35 1 32 ASP -1.15 1.96 1 34 HIS -2.70 -1.36 1 35 LEU -2.34 -2.48 1 36 ASP -0.91 -0.57 1 37 PHE 6.01 -0.06 1 38 ASP 4.55 2.48 1 39 GLU 2.55 2.81 1 40 TRP 1.47 -1.11 1 41 ARG 4.93 0.88 1 42 GLN 4.65 1.91 1 43 GLU 2.76 0.82 1 44 LEU 4.55 1.93 1 45 LYS 5.08 4.29 1 47 ARG -0.09 -0.89 1 49 HIS -1.04 -0.16 1 50 ALA -1.41 0.27 1 51 ASP 4.70 1.47 1 52 ALA 3.59 2.08 1 53 ASP 2.74 0.68 1 54 ILE 5.60 2.30 1 55 GLU 2.62 0.78 1 56 ALA 3.41 2.94 1 57 VAL 4.70 -0.43 1 58 PHE 4.38 0.59 1 59 ALA 2.88 1.32 1 60 LYS 3.12 -0.16 1 61 TYR 0.98 -1.56 1 62 ASP 0.26 0.70 1 63 VAL 4.31 0.76 1 64 ASP 0.08 0.96 1 66 ASP 0.44 -0.68 1 67 ARG 5.66 -1.61 1 68 VAL -4.33 -2.01 1 69 LEU -2.60 -0.79 1 70 ASP -0.82 -1.30 1 71 ALA 4.42 1.94 1 72 GLU 3.56 2.41 1 73 GLU 2.37 3.33 1 74 GLN 3.17 1.18 1 75 MET 3.90 1.90 1 76 LYS 4.33 1.70 1 77 MET 3.99 0.53 1 78 ALA 4.28 2.08 1 79 HIS 4.02 3.14 1 80 ASP 3.55 2.45 1 81 LEU 3.64 0.30 1 82 GLU 3.03 1.96 1 84 GLN 2.33 1.47 1 85 LYS 3.52 0.41 1 86 SER 2.57 0.54 1 87 ASP 2.09 0.97 1 88 LEU 2.33 0.03 1 89 ASN 2.29 1.12 1 90 ASN 1.96 0.52 1 91 GLN 1.78 0.87 1 92 LEU 1.31 -0.22 1 93 ALA 0.89 -0.23 1 94 GLU -0.14 -0.75 1 95 LEU 0.02 -1.35 1 stop_ save_