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 bmr17775_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.44 _LACS_plot.Line_1_terminator_val_y_1 -1.81 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.66 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 5.68 _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 32 ARG -1.18 0.95 0 111 LEU 5.91 2.14 0 10 GLU 3.38 3.03 1 11 LEU 3.56 3.21 1 12 SER 4.68 3.37 1 13 ASN 3.58 2.77 1 14 THR 7.13 5.99 1 15 ALA 4.21 2.93 1 16 ASP 4.20 3.23 1 17 LYS 3.65 2.82 1 18 ILE 3.78 3.30 1 19 ALA 4.09 2.87 1 20 GLU -0.13 -0.20 1 22 ASN 0.85 -1.30 1 23 LEU 2.29 1.15 1 24 GLU -0.47 -0.96 1 25 ALA 0.92 0.39 1 26 GLU -1.71 -1.45 1 27 VAL 1.48 0.64 1 29 HIS 4.04 2.95 1 30 GLN 1.75 2.98 1 31 ASN 0.97 -0.30 1 33 ALA -0.58 -0.85 1 34 ASP -2.44 -1.96 1 35 GLU 6.10 3.86 1 36 ILE 5.10 2.07 1 38 ILE 4.84 3.65 1 39 LEU 3.43 2.52 1 40 ALA 2.91 3.68 1 42 SER 5.08 4.33 1 43 ILE 5.93 3.92 1 44 GLU 4.03 1.83 1 45 ARG 5.57 4.44 1 46 LEU 4.20 3.45 1 47 ARG 5.30 4.63 1 48 ARG 5.00 3.93 1 49 SER 5.18 4.33 1 50 LEU 3.69 3.48 1 51 LYS 4.58 3.50 1 52 GLN 3.94 2.99 1 53 LEU 2.76 2.98 1 54 ALA 3.91 3.13 1 55 ASP 4.70 3.23 1 56 ASP 3.84 3.18 1 57 ARG 3.39 2.79 1 58 THR 5.71 4.63 1 59 LEU 3.18 2.59 1 60 LEU 3.23 2.80 1 61 MET 3.15 2.45 1 62 ALA 3.91 2.77 1 64 VAL 4.63 3.42 1 65 SER 3.48 2.94 1 66 HIS 2.76 4.16 1 67 ASP 4.52 3.30 1 68 LEU 0.81 1.71 1 69 ARG 4.11 3.42 1 70 THR 4.43 3.35 1 72 LEU 5.99 4.96 1 73 THR 4.85 5.03 1 74 ARG 5.61 4.46 1 75 ILE 4.55 3.34 1 76 ARG 3.78 2.81 1 77 LEU 3.84 2.77 1 78 ALA 3.95 3.17 1 79 THR 1.83 1.42 1 80 GLU -0.35 -0.59 1 81 MET 1.07 2.03 1 82 MET 0.13 0.87 1 83 SER 2.62 2.28 1 84 GLU 3.85 2.74 1 85 GLN -0.37 -0.49 1 86 ASP 3.77 2.07 1 88 TYR 2.42 1.95 1 89 LEU 4.06 3.41 1 90 ALA 3.10 2.82 1 91 GLU 4.03 3.31 1 92 SER 5.14 4.37 1 93 ILE 4.86 4.24 1 94 ASN 4.82 3.45 1 95 LYS 4.17 4.20 1 96 ASP 5.52 3.98 1 97 ILE 3.96 2.97 1 98 GLU 3.91 3.23 1 99 GLU 3.82 3.36 1 101 ASN 3.76 2.62 1 102 ALA 4.48 3.76 1 103 ILE 5.13 4.39 1 104 ILE 2.99 2.66 1 105 GLU 3.10 2.47 1 106 GLN 2.50 1.66 1 107 PHE 4.11 3.18 1 108 ILE 2.54 2.30 1 109 ASP 1.40 1.04 1 110 TYR -0.28 -0.01 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17775_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.44 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.34 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 -1.45 _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 32 ARG -1.18 2.13 0 111 LEU 5.91 -3.77 0 10 GLU 3.38 -0.35 1 11 LEU 3.56 -0.35 1 12 SER 4.68 -1.31 1 13 ASN 3.58 -0.81 1 14 THR 7.13 -1.14 1 15 ALA 4.21 -1.28 1 16 ASP 4.20 -0.97 1 17 LYS 3.65 -0.83 1 18 ILE 3.78 -0.48 1 19 ALA 4.09 -1.22 1 20 GLU -0.13 -0.07 1 22 ASN 0.85 -2.15 1 23 LEU 2.29 -1.14 1 24 GLU -0.47 -0.49 1 25 ALA 0.92 -0.53 1 26 GLU -1.71 0.26 1 27 VAL 1.48 -0.84 1 29 HIS 4.04 -1.09 1 30 GLN 1.75 1.23 1 31 ASN 0.97 -1.27 1 33 ALA -0.58 -0.27 1 34 ASP -2.44 0.48 1 35 GLU 6.10 -2.24 1 36 ILE 5.10 -3.03 1 38 ILE 4.84 -1.19 1 39 LEU 3.43 -0.91 1 40 ALA 2.91 0.77 1 42 SER 5.08 -0.75 1 43 ILE 5.93 -2.01 1 44 GLU 4.03 -2.20 1 45 ARG 5.57 -1.13 1 46 LEU 4.20 -0.75 1 47 ARG 5.30 -0.67 1 48 ARG 5.00 -1.07 1 49 SER 5.18 -0.85 1 50 LEU 3.69 -0.21 1 51 LYS 4.58 -1.08 1 52 GLN 3.94 -0.95 1 53 LEU 2.76 0.22 1 54 ALA 3.91 -0.78 1 55 ASP 4.70 -1.47 1 56 ASP 3.84 -0.66 1 57 ARG 3.39 -0.60 1 58 THR 5.71 -1.08 1 59 LEU 3.18 -0.59 1 60 LEU 3.23 -0.43 1 61 MET 3.15 -0.70 1 62 ALA 3.91 -1.14 1 64 VAL 4.63 -1.21 1 65 SER 3.48 -0.54 1 66 HIS 2.76 1.40 1 67 ASP 4.52 -1.22 1 68 LEU 0.81 0.90 1 69 ARG 4.11 -0.69 1 70 THR 4.43 -1.08 1 72 LEU 5.99 -1.03 1 73 THR 4.85 0.18 1 74 ARG 5.61 -1.15 1 75 ILE 4.55 -1.21 1 76 ARG 3.78 -0.97 1 77 LEU 3.84 -1.07 1 78 ALA 3.95 -0.78 1 79 THR 1.83 -0.41 1 80 GLU -0.35 -0.24 1 81 MET 1.07 0.96 1 82 MET 0.13 0.74 1 83 SER 2.62 -0.34 1 84 GLU 3.85 -1.11 1 85 GLN -0.37 -0.12 1 86 ASP 3.77 -1.70 1 88 TYR 2.42 -0.47 1 89 LEU 4.06 -0.65 1 90 ALA 3.10 -0.28 1 91 GLU 4.03 -0.72 1 92 SER 5.14 -0.77 1 93 ILE 4.86 -0.62 1 94 ASN 4.82 -1.37 1 95 LYS 4.17 0.03 1 96 ASP 5.52 -1.54 1 97 ILE 3.96 -0.99 1 98 GLU 3.91 -0.68 1 99 GLU 3.82 -0.46 1 101 ASN 3.76 -1.14 1 102 ALA 4.48 -0.72 1 103 ILE 5.13 -0.74 1 104 ILE 2.99 -0.33 1 105 GLU 3.10 -0.63 1 106 GLN 2.50 -0.84 1 107 PHE 4.11 -0.93 1 108 ILE 2.54 -0.24 1 109 ASP 1.40 -0.36 1 110 TYR -0.28 0.27 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17775_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.44 _LACS_plot.Line_1_terminator_val_y_1 -0.02 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.05 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 -0.51 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 GLU 4.03 0.25 0 85 GLN -0.37 0.43 0 10 GLU 3.38 -0.27 1 11 LEU 3.56 -0.33 1 12 SER 4.68 -0.28 1 13 ASN 3.58 -0.29 1 14 THR 7.13 -0.52 1 15 ALA 4.21 -0.47 1 16 ASP 4.20 -0.28 1 17 LYS 3.65 -0.31 1 18 ILE 3.78 -0.48 1 19 ALA 4.09 -0.47 1 20 GLU -0.13 -0.19 1 22 ASN 0.85 0.22 1 23 LEU 2.29 -0.39 1 24 GLU -0.47 -0.12 1 25 ALA 0.92 -0.44 1 26 GLU -1.71 -0.27 1 27 VAL 1.48 -0.21 1 29 HIS 4.04 -0.52 1 30 GLN 1.75 -0.35 1 31 ASN 0.97 -0.10 1 32 ARG -1.18 -0.20 1 33 ALA -0.58 0.21 1 34 ASP -2.44 0.02 1 35 GLU 6.10 -0.48 1 36 ILE 5.10 -0.60 1 38 ILE 4.84 -0.54 1 39 LEU 3.43 -0.22 1 40 ALA 2.91 -0.48 1 42 SER 5.08 -0.13 1 43 ILE 5.93 -0.53 1 45 ARG 5.57 -0.41 1 46 LEU 4.20 -0.32 1 47 ARG 5.30 -0.65 1 48 ARG 5.00 -0.50 1 49 SER 5.18 -0.35 1 50 LEU 3.69 -0.35 1 51 LYS 4.58 -0.46 1 52 GLN 3.94 -0.26 1 53 LEU 2.76 -0.19 1 54 ALA 3.91 -0.27 1 55 ASP 4.70 -0.22 1 56 ASP 3.84 -0.15 1 57 ARG 3.39 -0.40 1 58 THR 5.71 -0.39 1 59 LEU 3.18 -0.27 1 60 LEU 3.23 -0.32 1 61 MET 3.15 -0.37 1 62 ALA 3.91 -0.21 1 64 VAL 4.63 -0.34 1 65 SER 3.48 -0.47 1 66 HIS 2.76 -0.29 1 67 ASP 4.52 -0.20 1 68 LEU 0.81 -0.15 1 69 ARG 4.11 -0.41 1 70 THR 4.43 -0.39 1 72 LEU 5.99 -0.47 1 73 THR 4.85 -0.37 1 74 ARG 5.61 -0.47 1 75 ILE 4.55 -0.41 1 76 ARG 3.78 -0.34 1 77 LEU 3.84 -0.25 1 78 ALA 3.95 -0.36 1 79 THR 1.83 -0.26 1 80 GLU -0.35 0.00 1 81 MET 1.07 -0.46 1 82 MET 0.13 -0.17 1 83 SER 3.85 -0.12 1 86 ASP 3.77 -0.12 1 88 TYR 2.42 -0.42 1 89 LEU 4.06 -0.53 1 90 ALA 3.10 -0.34 1 91 GLU 4.03 -0.41 1 92 SER 5.14 -0.17 1 93 ILE 4.86 -0.45 1 94 ASN 4.82 -0.23 1 95 LYS 4.17 -0.58 1 96 ASP 5.52 -0.55 1 97 ILE 3.96 -0.23 1 98 GLU 3.91 -0.21 1 99 GLU 3.82 -0.45 1 101 ASN 3.76 -0.19 1 102 ALA 4.48 -0.49 1 103 ILE 5.13 -0.74 1 104 ILE 2.99 -0.38 1 105 GLU 3.10 -0.30 1 106 GLN 2.50 -0.13 1 107 PHE 4.11 -0.45 1 108 ILE 2.54 -0.20 1 109 ASP 1.40 -0.12 1 110 TYR -0.28 -0.11 1 111 LEU 5.91 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17775_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.44 _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 0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.57 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 2.96 _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 14 THR 7.13 0.33 0 34 ASP -2.44 0.44 0 10 GLU 3.38 4.38 1 11 LEU 3.56 0.43 1 12 SER 4.68 1.06 1 13 ASN 3.58 3.28 1 15 ALA 4.21 0.67 1 16 ASP 4.20 2.12 1 17 LYS 3.65 3.57 1 18 ILE 3.78 2.52 1 19 ALA 4.09 1.59 1 20 GLU -0.13 -0.04 1 22 ASN 0.85 -0.64 1 23 LEU 2.29 -1.21 1 24 GLU -0.47 -0.55 1 25 ALA 0.92 -2.41 1 26 GLU -1.71 -0.09 1 29 HIS 4.04 1.49 1 30 GLN 1.75 0.29 1 31 ASN 0.97 0.41 1 33 ALA -0.58 -1.19 1 35 GLU 6.10 0.84 1 36 ILE 5.10 1.06 1 38 ILE 4.84 2.67 1 39 LEU 3.43 0.96 1 40 ALA 2.91 1.90 1 42 SER 5.08 2.83 1 43 ILE 5.93 0.79 1 44 GLU 4.03 1.59 1 45 ARG 5.57 3.65 1 46 LEU 4.20 0.44 1 47 ARG 5.30 1.82 1 48 ARG 5.00 2.76 1 49 SER 5.18 1.45 1 50 LEU 3.69 -0.22 1 51 LYS 4.58 2.45 1 52 GLN 3.94 1.96 1 53 LEU 2.76 1.98 1 54 ALA 3.91 2.73 1 55 ASP 4.70 2.80 1 56 ASP 3.84 2.78 1 57 ARG 3.39 1.47 1 58 THR 5.71 1.99 1 59 LEU 3.18 2.44 1 60 LEU 3.23 1.76 1 61 MET 3.15 3.45 1 62 ALA 3.91 2.62 1 64 VAL 4.63 0.66 1 65 SER 3.48 1.26 1 66 HIS 2.76 3.68 1 67 ASP 4.52 2.17 1 68 LEU 0.81 -0.59 1 69 ARG 4.11 2.54 1 72 LEU 4.43 1.52 1 73 THR 5.99 1.40 1 74 ARG 4.85 3.83 1 75 ILE 5.61 0.67 1 76 ARG 4.55 3.28 1 77 LEU 3.78 2.00 1 78 ALA 3.84 2.82 1 79 THR 3.95 2.55 1 80 GLU 1.83 0.68 1 81 MET -0.35 -0.16 1 82 MET 1.07 -0.63 1 83 SER 0.13 1.56 1 85 GLN 3.85 0.37 1 86 ASP -0.37 0.44 1 88 TYR 3.77 1.70 1 89 LEU 2.42 0.58 1 90 ALA 4.06 1.81 1 91 GLU 3.10 1.31 1 92 SER 4.03 1.76 1 93 ILE 5.14 1.60 1 94 ASN 4.86 4.53 1 95 LYS 4.82 2.65 1 96 ASP 4.17 3.00 1 97 ILE 5.52 1.93 1 98 GLU 3.96 3.14 1 99 GLU 3.91 2.21 1 101 ASN 3.82 1.78 1 102 ALA 3.76 2.71 1 103 ILE 4.48 1.86 1 104 ILE 5.13 1.26 1 105 GLU 2.99 1.84 1 106 GLN 3.10 1.55 1 107 PHE 2.50 0.77 1 108 ILE 4.11 1.05 1 109 ASP 2.54 1.32 1 110 TYR 1.40 0.42 1 111 LEU -0.28 -1.70 1 stop_ save_