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 bmr19372_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.99 _LACS_plot.Line_1_terminator_val_y_1 -2.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 4.71 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 28 ASP 1.68 -1.66 0 99 SER -4.99 -2.26 0 10 LEU -2.31 -2.35 1 11 ALA 3.08 1.92 1 13 ALA 0.40 0.30 1 15 GLN 4.40 3.50 1 16 ASP 5.20 2.39 1 17 VAL 5.00 3.74 1 18 VAL 6.47 5.25 1 19 LYS 4.19 3.53 1 20 ALA 3.44 2.52 1 21 PHE 4.71 2.86 1 22 PHE 6.08 4.76 1 23 GLU 3.93 2.10 1 24 LEU 4.39 2.99 1 25 LEU 4.11 2.73 1 26 LYS 3.45 2.50 1 27 LYS 3.79 2.64 1 29 GLU 4.15 2.80 1 30 THR 0.31 -0.71 1 31 LYS -0.97 -0.01 1 32 THR -1.65 -1.00 1 33 ASP 2.60 1.90 1 35 GLU 5.17 4.55 1 36 ILE 4.49 2.92 1 37 GLU 4.42 3.50 1 38 LYS 4.49 2.30 1 39 ASP 3.23 3.20 1 40 LEU 4.31 2.80 1 41 ASP 3.21 2.12 1 42 ALA 5.48 4.11 1 43 TRP 5.57 3.49 1 44 VAL 4.40 1.80 1 45 ASP 1.14 1.45 1 46 THR -0.22 0.50 1 47 LEU 0.46 -1.24 1 50 ASP 5.46 5.08 1 51 TYR 5.02 3.94 1 52 LYS 4.00 2.70 1 53 ALA 2.88 3.23 1 54 LYS 2.25 2.31 1 55 PHE 4.29 2.30 1 56 GLU 6.11 5.11 1 57 THR 3.71 3.10 1 58 PHE 5.25 3.76 1 59 LYS 4.30 3.50 1 60 LYS 3.95 2.10 1 61 GLU 2.90 1.80 1 62 MET 3.89 2.80 1 63 LYS 3.66 2.36 1 64 ALA 3.62 2.52 1 65 LYS 4.37 2.32 1 66 GLU 3.63 2.39 1 67 ALA 3.67 2.03 1 68 GLU 3.81 2.99 1 69 LEU 3.43 2.33 1 70 ALA 4.13 2.64 1 71 LYS 3.61 2.24 1 72 ALA 3.53 3.01 1 73 HIS 4.19 2.23 1 74 GLU 3.33 1.65 1 75 GLU 3.71 2.20 1 76 ALA 2.76 2.23 1 77 VAL 2.43 1.65 1 78 ALA -0.22 -0.60 1 79 LYS 0.11 1.10 1 80 MET 2.75 1.53 1 81 THR 4.58 3.00 1 83 GLU 3.01 2.50 1 84 ALA 4.42 4.08 1 85 LYS 3.74 3.00 1 86 LYS 2.50 2.16 1 87 ALA 3.03 3.38 1 88 ASP 4.03 2.69 1 89 ALA 3.49 2.09 1 90 GLU 3.80 3.02 1 91 LEU 4.43 3.36 1 92 SER 3.66 2.80 1 93 LYS 3.40 2.74 1 94 ILE 3.52 2.82 1 95 ALA -0.57 -1.90 1 96 GLU 1.30 -0.07 1 97 ASP 2.32 0.44 1 98 ASP 0.87 1.10 1 100 LEU -1.44 -1.90 1 101 ASN 3.73 3.09 1 103 ILE 4.05 2.68 1 104 GLN 3.89 4.32 1 105 LYS -1.16 -0.96 1 106 ALA -0.07 -0.70 1 107 GLN 3.79 3.32 1 108 LYS 5.22 4.57 1 109 ILE 4.47 3.20 1 110 GLN 3.43 2.30 1 111 ALA 3.39 2.75 1 112 ILE 4.74 4.45 1 113 TYR 3.10 2.60 1 114 LYS -0.51 -0.18 1 115 THR -0.43 -0.37 1 116 LEU 4.41 3.21 1 118 GLN 5.01 3.00 1 119 SER 4.37 3.20 1 120 VAL 6.01 4.86 1 121 LYS 4.54 2.49 1 122 ASP 2.17 3.06 1 123 GLU 2.91 2.11 1 124 LEU 2.62 1.13 1 125 GLU 1.80 1.25 1 126 LYS -0.19 -0.02 1 128 ILE -0.09 -0.19 1 131 ALA -0.34 -0.38 1 132 VAL -0.27 0.68 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19372_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.99 _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 -1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -1.76 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 28 ASP 1.68 -3.34 0 99 SER -4.99 2.73 0 10 LEU -2.31 -0.04 1 11 ALA 3.08 -1.16 1 13 ALA 0.40 -0.10 1 15 GLN 4.40 -0.90 1 16 ASP 5.20 -2.81 1 17 VAL 5.00 -1.26 1 18 VAL 6.47 -1.22 1 19 LYS 4.19 -0.66 1 20 ALA 3.44 -0.92 1 21 PHE 4.71 -1.85 1 22 PHE 6.08 -1.32 1 23 GLU 3.93 -1.83 1 24 LEU 4.39 -1.40 1 25 LEU 4.11 -1.38 1 26 LYS 3.45 -0.95 1 27 LYS 3.79 -1.15 1 29 GLU 4.15 -1.35 1 30 THR 0.31 -1.02 1 31 LYS -0.97 0.96 1 32 THR -1.65 0.65 1 33 ASP 2.60 -0.70 1 35 GLU 5.17 -0.62 1 36 ILE 4.49 -1.57 1 37 GLU 4.42 -0.92 1 38 LYS 4.49 -2.19 1 39 ASP 3.23 -0.03 1 40 LEU 4.31 -1.51 1 41 ASP 3.21 -1.09 1 42 ALA 5.48 -1.37 1 43 TRP 5.57 -2.08 1 44 VAL 4.40 -2.60 1 45 ASP 1.14 0.31 1 46 THR -0.22 0.72 1 47 LEU 0.46 -1.70 1 50 ASP 5.46 -0.38 1 51 TYR 5.02 -1.08 1 52 LYS 4.00 -1.30 1 53 ALA 2.88 0.35 1 54 LYS 2.25 0.06 1 55 PHE 4.29 -1.99 1 56 GLU 6.11 -1.00 1 57 THR 3.71 -0.61 1 58 PHE 5.25 -1.49 1 59 LYS 4.30 -0.80 1 60 LYS 3.95 -1.85 1 61 GLU 2.90 -1.10 1 62 MET 3.89 -1.09 1 63 LYS 3.66 -1.30 1 64 ALA 3.62 -1.10 1 65 LYS 4.37 -2.05 1 66 GLU 3.63 -1.24 1 67 ALA 3.67 -1.64 1 68 GLU 3.81 -0.82 1 69 LEU 3.43 -1.10 1 70 ALA 4.13 -1.49 1 71 LYS 3.61 -1.37 1 72 ALA 3.53 -0.52 1 73 HIS 4.19 -1.96 1 74 GLU 3.33 -1.68 1 75 GLU 3.71 -1.51 1 76 ALA 2.76 -0.53 1 77 VAL 2.43 -0.78 1 78 ALA -0.22 -0.38 1 79 LYS 0.11 0.99 1 80 MET 2.75 -1.22 1 81 THR 4.58 -1.58 1 83 GLU 3.01 -0.51 1 84 ALA 4.42 -0.34 1 85 LYS 3.74 -0.74 1 86 LYS 2.50 -0.34 1 87 ALA 3.03 0.35 1 88 ASP 4.03 -1.34 1 89 ALA 3.49 -1.40 1 90 GLU 3.80 -0.78 1 91 LEU 4.43 -1.07 1 92 SER 3.66 -0.86 1 93 LYS 3.40 -0.66 1 94 ILE 3.52 -0.70 1 95 ALA -0.57 -1.33 1 96 GLU 1.30 -1.37 1 97 ASP 2.32 -1.88 1 98 ASP 0.87 0.23 1 100 LEU -1.44 -0.46 1 101 ASN 3.73 -0.64 1 103 ILE 4.05 -1.37 1 104 GLN 3.89 0.43 1 105 LYS -1.16 0.20 1 106 ALA -0.07 -0.63 1 107 GLN 3.79 -0.47 1 108 LYS 5.22 -0.65 1 109 ILE 4.47 -1.27 1 110 GLN 3.43 -1.13 1 111 ALA 3.39 -0.64 1 112 ILE 4.74 -0.29 1 113 TYR 3.10 -0.50 1 114 LYS -0.51 0.33 1 115 THR -0.43 0.06 1 116 LEU 4.41 -1.20 1 118 GLN 5.01 -2.01 1 119 SER 4.37 -1.17 1 120 VAL 6.01 -1.15 1 121 LYS 4.54 -2.05 1 122 ASP 2.17 0.89 1 123 GLU 2.91 -0.80 1 124 LEU 2.62 -1.49 1 125 GLU 1.80 -0.55 1 126 LYS -0.19 0.17 1 128 ILE -0.09 -0.10 1 131 ALA -0.34 -0.04 1 132 VAL -0.27 0.95 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19372_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.99 _LACS_plot.Line_1_terminator_val_y_1 0.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 PHE 4.71 -1.81 0 10 LEU -2.31 -0.05 1 11 ALA 3.08 -0.45 1 13 ALA 0.40 -0.04 1 15 GLN 4.40 -0.41 1 16 ASP 5.20 -0.36 1 17 VAL 5.00 -0.24 1 18 VAL 6.47 -0.81 1 19 LYS 4.19 -0.29 1 20 ALA 3.44 -0.36 1 22 PHE 6.08 -0.86 1 23 GLU 3.93 -0.41 1 24 LEU 4.39 -0.61 1 25 LEU 4.11 -0.82 1 26 LYS 3.45 -0.36 1 27 LYS 3.79 -0.36 1 28 ASP 1.68 -0.02 1 29 GLU 4.15 -0.30 1 30 THR 0.31 0.07 1 31 LYS -0.97 0.17 1 32 THR -1.65 -0.12 1 33 ASP 2.60 -0.41 1 35 GLU 5.17 -0.56 1 36 ILE 4.49 -0.43 1 37 GLU 4.42 -0.23 1 38 LYS 4.49 -0.19 1 39 ASP 3.23 -0.19 1 40 LEU 4.31 -0.41 1 41 ASP 3.21 -0.25 1 42 ALA 5.48 -0.43 1 43 TRP 5.57 -1.26 1 44 VAL 4.40 -0.32 1 45 ASP 1.14 -0.17 1 46 THR -0.22 -0.50 1 47 LEU 0.46 0.18 1 50 ASP 5.46 -0.52 1 51 TYR 5.02 -0.44 1 52 LYS 4.00 -0.22 1 53 ALA 2.88 -0.24 1 54 LYS 2.25 -0.70 1 55 PHE 4.29 -0.64 1 56 GLU 6.11 -0.55 1 57 THR 3.71 -0.31 1 58 PHE 5.25 -0.91 1 59 LYS 4.30 -0.48 1 60 LYS 3.95 -0.35 1 61 GLU 2.90 -0.38 1 62 MET 3.89 -0.38 1 63 LYS 3.66 -0.18 1 64 ALA 3.62 -0.32 1 65 LYS 4.37 -0.32 1 66 GLU 3.63 -0.14 1 67 ALA 3.67 -0.44 1 68 GLU 3.81 -0.30 1 69 LEU 3.43 -0.16 1 70 ALA 4.13 -0.23 1 71 LYS 3.61 -0.19 1 72 ALA 3.53 -0.34 1 73 HIS 4.19 -0.44 1 74 GLU 3.33 -0.27 1 75 GLU 3.71 -0.32 1 76 ALA 2.76 -0.32 1 77 VAL 2.43 -0.28 1 78 ALA -0.22 -0.01 1 79 LYS 0.11 -0.06 1 80 MET 2.75 -0.26 1 81 THR 4.58 -0.38 1 83 GLU 3.01 -0.26 1 84 ALA 4.42 -0.56 1 85 LYS 3.74 -0.32 1 86 LYS 2.50 -0.23 1 87 ALA 3.03 -0.45 1 88 ASP 4.03 -0.25 1 89 ALA 3.49 -0.34 1 90 GLU 3.80 -0.38 1 91 LEU 4.43 -0.44 1 92 SER 3.66 -0.47 1 93 LYS 3.40 -0.44 1 94 ILE 3.52 -0.51 1 95 ALA -0.57 -0.08 1 96 GLU 1.30 -0.21 1 97 ASP 2.32 0.02 1 98 ASP 0.87 -0.07 1 99 SER -4.99 0.31 1 100 LEU -1.44 -0.04 1 101 ASN 3.73 -0.35 1 103 ILE 4.05 -0.32 1 104 GLN 3.89 -0.70 1 105 LYS -1.16 -0.38 1 106 ALA -0.07 0.22 1 107 GLN 3.79 -0.33 1 108 LYS 5.22 -0.68 1 109 ILE 4.47 -0.35 1 110 GLN 3.43 -0.29 1 111 ALA 3.39 -0.44 1 112 ILE 4.74 -0.66 1 113 TYR 3.10 -0.27 1 114 LYS -0.51 -0.01 1 115 THR -0.43 -0.18 1 116 LEU 4.41 -0.74 1 118 GLN 5.01 -0.60 1 119 SER 4.37 -0.30 1 120 VAL 6.01 -0.67 1 121 LYS 4.54 -0.35 1 122 ASP 2.17 -0.36 1 123 GLU 2.91 -0.35 1 124 LEU 2.62 -0.33 1 125 GLU 1.80 -0.22 1 126 LYS -0.19 -0.06 1 128 ILE -0.09 -0.16 1 131 ALA -0.34 -0.17 1 132 VAL -0.27 -0.22 1 stop_ save_