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 bmr4857_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.43 _LACS_plot.Line_1_terminator_val_y_1 -3.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.72 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 6.55 _LACS_plot.Y_axis_chem_shift_offset 0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 LEU -4.43 -3.28 0 73 VAL 1.60 -2.33 0 39 MET 9.56 4.25 0 10 ALA 0.93 0.12 1 11 LEU 0.15 0.51 1 13 ASP -1.50 -3.80 1 14 ILE 3.12 2.51 1 16 MET 3.34 2.42 1 17 LEU 3.93 3.04 1 18 GLU 4.17 2.60 1 19 GLN 3.01 1.35 1 20 TYR 4.03 2.72 1 21 LEU 1.91 1.37 1 22 GLU 1.04 1.69 1 23 LEU -1.19 -0.48 1 24 VAL 4.01 2.44 1 27 LYS 3.55 2.37 1 28 LEU 3.72 2.35 1 29 ILE 7.12 4.48 1 30 THR 4.61 2.49 1 31 ASP 2.21 1.68 1 33 LEU 3.90 1.94 1 34 ALA 5.24 3.66 1 35 VAL 5.06 4.45 1 36 PHE 2.62 2.82 1 37 GLU 2.14 1.25 1 38 LYS 0.21 -0.47 1 40 MET 1.56 -1.05 1 43 TYR 6.24 4.12 1 44 VAL 4.57 3.10 1 45 SER 5.44 3.65 1 46 VAL 4.04 3.41 1 47 LEU 3.58 3.11 1 48 GLU 4.84 2.91 1 49 SER 3.68 2.34 1 50 ASN 4.79 2.92 1 51 LEU 5.95 4.01 1 52 THR -0.06 -0.80 1 53 ALA 4.21 0.39 1 54 GLN -1.22 -2.66 1 55 ASP 5.04 4.03 1 56 LYS 4.54 2.77 1 57 LYS 4.89 4.70 1 59 ILE 5.72 4.15 1 60 VAL 3.08 2.14 1 61 GLU 3.45 1.62 1 62 GLU 4.62 3.91 1 64 HIS 4.37 2.79 1 65 LYS 4.73 4.14 1 66 ILE 5.18 3.82 1 67 LYS 3.23 1.90 1 69 ALA 2.99 1.22 1 70 ALA 3.39 2.45 1 72 SER -1.10 -2.89 1 75 LEU 2.38 2.39 1 76 ARG 3.22 2.25 1 77 HIS 4.18 1.91 1 78 LEU 5.28 3.74 1 79 GLN 4.49 2.08 1 80 GLN 2.29 2.20 1 81 LEU 4.33 1.95 1 83 GLN 6.32 2.61 1 84 GLN 5.39 4.47 1 85 ILE 1.18 -0.43 1 86 GLN -1.01 -1.16 1 87 SER 0.68 -1.01 1 89 ASP 0.86 0.12 1 90 LEU 1.43 -0.27 1 92 ALA 5.72 5.68 1 93 TRP 4.21 2.93 1 94 GLU 0.95 0.65 1 95 ASP -0.93 -0.15 1 96 ASN 6.76 2.39 1 97 VAL 3.44 1.50 1 99 GLU 1.86 0.22 1 100 TRP 5.34 4.70 1 101 ILE 4.03 2.29 1 102 GLU 3.81 2.52 1 103 GLU 4.24 3.13 1 104 MET 4.23 3.47 1 105 LYS 0.82 0.81 1 106 GLU -1.12 -0.40 1 107 GLU 6.60 4.13 1 108 TRP 6.51 3.50 1 109 ARG 4.69 2.79 1 110 HIS 6.28 3.34 1 111 ASP 6.35 4.65 1 112 VAL 3.90 2.29 1 113 GLU 6.18 3.82 1 114 VAL 5.37 2.89 1 115 LEU 5.15 4.27 1 116 LYS 3.32 1.52 1 117 ALA 5.75 4.80 1 118 TRP 5.27 3.68 1 119 VAL 3.56 1.73 1 120 ALA 2.69 1.22 1 121 LYS 1.69 0.37 1 122 ALA 0.16 -0.46 1 123 THR 0.92 -0.27 1 124 LYS 0.81 0.78 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4857_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.43 _LACS_plot.Line_1_terminator_val_y_1 0.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 -3.01 _LACS_plot.Y_axis_chem_shift_offset 0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 LEU -4.43 1.15 0 73 VAL 1.60 -3.93 0 39 MET 9.56 -5.31 0 10 ALA 0.93 -0.81 1 11 LEU 0.15 0.36 1 13 ASP -1.50 -2.30 1 14 ILE 3.12 -0.61 1 16 MET 3.34 -0.92 1 17 LEU 3.93 -0.89 1 18 GLU 4.17 -1.57 1 19 GLN 3.01 -1.66 1 20 TYR 4.03 -1.31 1 21 LEU 1.91 -0.54 1 22 GLU 1.04 0.65 1 23 LEU -1.19 0.71 1 24 VAL 4.01 -1.57 1 27 LYS 3.55 -1.18 1 28 LEU 3.72 -1.37 1 29 ILE 7.12 -2.64 1 30 THR 4.61 -2.12 1 31 ASP 2.21 -0.53 1 33 LEU 3.90 -1.96 1 34 ALA 5.24 -1.58 1 35 VAL 5.06 -0.61 1 36 PHE 2.62 0.20 1 37 GLU 2.14 -0.89 1 38 LYS 0.21 -0.68 1 40 MET 1.56 -2.61 1 43 TYR 6.24 -2.12 1 44 VAL 4.57 -1.47 1 45 SER 5.44 -1.79 1 46 VAL 4.04 -0.63 1 47 LEU 3.58 -0.47 1 48 GLU 4.84 -1.93 1 49 SER 3.68 -1.34 1 50 ASN 4.79 -1.87 1 51 LEU 5.95 -1.94 1 52 THR -0.06 -0.74 1 53 ALA 4.21 -3.82 1 54 GLN -1.22 -1.44 1 55 ASP 5.04 -1.01 1 56 LYS 4.54 -1.77 1 57 LYS 4.89 -0.19 1 59 ILE 5.72 -1.57 1 60 VAL 3.08 -0.94 1 61 GLU 3.45 -1.83 1 62 GLU 4.62 -0.71 1 64 HIS 4.37 -1.58 1 65 LYS 4.73 -0.59 1 66 ILE 5.18 -1.36 1 67 LYS 3.23 -1.33 1 69 ALA 2.99 -1.77 1 70 ALA 3.39 -0.94 1 72 SER -1.10 -1.79 1 75 LEU 2.38 0.01 1 76 ARG 3.22 -0.97 1 77 HIS 4.18 -2.27 1 78 LEU 5.28 -1.54 1 79 GLN 4.49 -2.41 1 80 GLN 2.29 -0.09 1 81 LEU 4.33 -2.38 1 83 GLN 6.32 -3.71 1 84 GLN 5.39 -0.92 1 85 ILE 1.18 -1.61 1 86 GLN -1.01 -0.15 1 87 SER 0.68 -1.69 1 89 ASP 0.86 -0.74 1 90 LEU 1.43 -1.70 1 92 ALA 5.72 -0.04 1 93 TRP 4.21 -1.28 1 94 GLU 0.95 -0.30 1 95 ASP -0.93 0.78 1 96 ASN 6.76 -4.37 1 97 VAL 3.44 -1.94 1 99 GLU 1.86 -1.64 1 100 TRP 5.34 -0.64 1 101 ILE 4.03 -1.74 1 102 GLU 3.81 -1.29 1 103 GLU 4.24 -1.11 1 104 MET 4.23 -0.76 1 105 LYS 0.82 -0.01 1 106 GLU -1.12 0.72 1 107 GLU 6.60 -2.47 1 108 TRP 6.51 -3.01 1 109 ARG 4.69 -1.90 1 110 HIS 6.28 -2.94 1 111 ASP 6.35 -1.70 1 112 VAL 3.90 -1.61 1 113 GLU 6.18 -2.36 1 114 VAL 5.37 -2.48 1 115 LEU 5.15 -0.88 1 116 LYS 3.32 -1.80 1 117 ALA 5.75 -0.95 1 118 TRP 5.27 -1.59 1 119 VAL 3.56 -1.83 1 120 ALA 2.69 -1.47 1 121 LYS 1.69 -1.32 1 122 ALA 0.16 -0.62 1 123 THR 0.92 -1.19 1 124 LYS 0.81 -0.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4857_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.43 _LACS_plot.Line_1_terminator_val_y_1 0.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 7.12 _LACS_plot.Line_2_terminator_val_y_2 -0.59 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 LEU -4.43 0.86 0 10 ALA 0.93 0.03 1 11 LEU 0.15 -0.03 1 13 ASP -1.50 0.05 1 14 ILE 3.12 -0.55 1 16 MET 3.34 -0.48 1 17 LEU 3.93 -0.16 1 18 GLU 4.17 -0.06 1 19 GLN 3.01 -0.04 1 20 TYR 4.03 -0.54 1 21 LEU 1.91 -0.24 1 22 GLU 1.04 0.03 1 23 LEU -1.19 0.40 1 24 VAL 4.01 -0.13 1 27 LYS 3.55 -0.12 1 28 LEU 3.72 -0.28 1 29 ILE 7.12 -0.34 1 30 THR 4.61 -0.02 1 31 ASP 2.21 -0.02 1 33 LEU 3.90 0.16 1 34 ALA 5.24 -0.39 1 35 VAL 5.06 -0.58 1 36 PHE 2.62 -0.34 1 37 GLU 2.14 -0.12 1 38 LYS 0.21 -0.34 1 39 MET 1.56 0.43 1 43 TYR 6.24 -0.59 1 44 VAL 4.57 -0.01 1 45 SER 5.44 -0.33 1 46 VAL 4.04 -0.42 1 47 LEU 3.58 -0.35 1 48 GLU 4.84 -0.14 1 49 SER 3.68 -0.08 1 50 ASN 4.79 -0.10 1 51 LEU 5.95 -0.37 1 52 THR -0.06 0.05 1 53 ALA 4.21 -0.51 1 54 GLN -1.22 0.19 1 55 ASP 5.04 -0.23 1 56 LYS 4.54 -0.34 1 57 LYS 4.89 -0.58 1 59 ILE 5.72 -0.41 1 60 VAL 3.08 -0.23 1 61 GLU 3.45 -0.17 1 62 GLU 4.62 -0.43 1 64 HIS 4.37 -0.52 1 65 LYS 4.73 -0.79 1 66 ILE 5.18 -0.46 1 67 LYS 3.23 0.00 1 69 ALA 2.99 -0.64 1 70 ALA 3.39 -0.18 1 72 SER -1.10 0.35 1 73 VAL 1.60 0.27 1 75 LEU 2.38 -0.30 1 76 ARG 3.22 -0.01 1 77 HIS 4.18 -0.58 1 78 LEU 5.28 -0.55 1 79 GLN 4.49 -0.41 1 80 GLN 2.29 -0.59 1 81 LEU 4.33 -0.30 1 83 GLN 6.32 -0.61 1 84 GLN 5.39 -0.19 1 85 ILE 1.18 0.67 1 86 GLN -1.01 0.29 1 87 SER 0.68 -0.13 1 89 ASP 0.86 -0.10 1 90 LEU 1.43 0.07 1 92 ALA 5.72 -0.71 1 93 TRP 4.21 -0.58 1 94 GLU 0.95 -0.14 1 95 ASP -0.93 -0.35 1 96 ASN 6.76 -0.63 1 97 VAL 3.44 -0.21 1 99 GLU 1.86 0.08 1 100 TRP 5.34 -0.58 1 101 ILE 4.03 -0.24 1 102 GLU 3.81 -0.18 1 103 GLU 4.24 -0.68 1 104 MET 4.23 -0.17 1 105 LYS 0.82 -0.08 1 106 GLU -1.12 0.38 1 107 GLU 6.60 -0.08 1 108 TRP 6.51 -0.92 1 109 ARG 4.69 -0.28 1 110 HIS 6.28 -0.56 1 111 ASP 6.35 -0.39 1 112 VAL 3.90 -0.32 1 113 GLU 6.18 -0.38 1 114 VAL 5.37 0.06 1 115 LEU 5.15 -0.47 1 116 LYS 3.32 -0.06 1 117 ALA 5.75 -0.59 1 118 TRP 5.27 -0.74 1 119 VAL 3.56 -0.27 1 120 ALA 2.69 -0.24 1 121 LYS 1.69 -0.46 1 122 ALA 0.16 -0.08 1 123 THR 0.92 0.00 1 124 LYS 0.81 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4857_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.43 _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 0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.15 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 3.01 _LACS_plot.Y_axis_chem_shift_offset 0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 SER -1.10 -4.07 0 124 LYS 0.81 4.02 0 12 LEU -4.43 -2.78 0 10 ALA 0.93 0.20 1 11 LEU 0.15 -1.18 1 13 ASP -1.50 -2.21 1 14 ILE 3.12 1.12 1 16 MET 3.34 1.25 1 17 LEU 3.93 2.73 1 18 GLU 4.17 1.96 1 19 GLN 3.01 2.18 1 20 TYR 4.03 0.45 1 21 LEU 1.91 0.52 1 22 GLU 1.04 0.27 1 23 LEU -1.19 -0.48 1 24 VAL 4.01 0.44 1 27 LYS 3.55 2.16 1 28 LEU 3.72 0.66 1 29 ILE 7.12 2.81 1 30 THR 4.61 2.57 1 31 ASP 2.21 -0.83 1 33 LEU 3.90 2.72 1 34 ALA 5.24 0.71 1 35 VAL 5.06 0.48 1 36 PHE 2.62 0.22 1 37 GLU 2.14 1.27 1 38 LYS 0.21 0.28 1 39 MET 9.56 3.97 1 40 MET 1.56 2.50 1 43 TYR 6.24 0.60 1 44 VAL 4.57 2.50 1 45 SER 5.44 1.67 1 46 VAL 4.04 -0.12 1 47 LEU 3.58 1.96 1 48 GLU 4.84 2.23 1 49 SER 3.68 1.06 1 50 ASN 4.79 2.26 1 51 LEU 5.95 0.31 1 52 THR -0.06 -2.37 1 53 ALA 4.21 -1.90 1 54 GLN -1.22 -1.55 1 55 ASP 5.04 0.49 1 56 LYS 4.54 1.77 1 57 LYS 4.89 -0.07 1 59 ILE 5.72 1.19 1 60 VAL 3.08 2.56 1 61 GLU 3.45 2.61 1 62 GLU 4.62 3.27 1 64 HIS 4.37 2.35 1 65 LYS 4.73 -0.43 1 66 ILE 5.18 2.11 1 67 LYS 3.23 1.64 1 69 ALA 2.99 1.76 1 70 ALA 3.39 -0.55 1 73 VAL 1.60 -2.45 1 75 LEU 2.38 0.40 1 76 ARG 3.22 1.55 1 77 HIS 4.18 0.12 1 78 LEU 5.28 0.51 1 79 GLN 4.49 2.02 1 80 GLN 2.29 0.96 1 81 LEU 4.33 1.04 1 83 GLN 6.32 1.24 1 84 GLN 5.39 -0.59 1 85 ILE 1.18 -2.84 1 86 GLN -1.01 -2.18 1 87 SER 0.68 0.07 1 89 ASP 0.86 -0.31 1 90 LEU 1.43 -0.77 1 92 ALA 5.72 0.82 1 93 TRP 4.21 0.81 1 94 GLU 0.95 -0.13 1 95 ASP -0.93 -0.67 1 96 ASN 6.76 -1.11 1 97 VAL 3.44 2.43 1 99 GLU 1.86 1.93 1 100 TRP 5.34 -0.15 1 101 ILE 4.03 0.92 1 102 GLU 3.81 0.78 1 103 GLU 4.24 0.80 1 104 MET 4.23 1.50 1 105 LYS 0.82 2.13 1 106 GLU -1.12 1.53 1 107 GLU 6.60 0.56 1 108 TRP 6.51 2.32 1 109 ARG 4.69 2.10 1 110 HIS 6.28 0.82 1 111 ASP 6.35 0.43 1 112 VAL 3.90 2.71 1 113 GLU 6.18 1.94 1 114 VAL 5.37 0.26 1 115 LEU 5.15 2.56 1 116 LYS 3.32 1.34 1 117 ALA 5.75 2.12 1 118 TRP 5.27 1.16 1 119 VAL 3.56 1.04 1 120 ALA 2.69 0.67 1 121 LYS 1.69 0.08 1 122 ALA 0.16 -1.14 1 123 THR 0.92 -1.96 1 stop_ save_