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 bmr5303_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.81 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.97 _LACS_plot.Line_2_terminator_val_x_2 7.07 _LACS_plot.Line_2_terminator_val_y_2 5.06 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 SER -5.13 1.18 0 13 SER -3.08 -5.06 0 10 ASP -2.60 0.44 1 11 ASP 0.60 1.39 1 12 ASP -1.18 -1.00 1 14 SER 4.56 3.46 1 15 ILE 2.86 -0.03 1 16 ARG 6.39 5.92 1 17 TRP 3.29 2.97 1 18 VAL 4.72 3.54 1 19 LEU 3.35 2.51 1 20 GLU 4.82 3.92 1 21 ARG 3.36 2.47 1 22 ALA 3.17 2.10 1 23 LEU 5.47 2.72 1 24 ALA 3.80 2.23 1 26 ALA -0.69 -1.16 1 28 LEU -1.57 -1.47 1 29 THR 1.09 0.70 1 31 THR -0.54 0.13 1 32 THR -4.00 -2.69 1 33 PHE -5.27 -1.24 1 34 GLU -1.50 0.14 1 35 ASN -3.43 -1.05 1 37 ASN 4.96 3.64 1 38 GLU 1.35 2.08 1 39 VAL 5.45 3.67 1 40 LEU 4.36 3.13 1 41 ALA 3.65 2.35 1 42 ALA 2.16 2.41 1 43 LEU 0.14 0.32 1 44 ALA 2.40 1.83 1 45 SER -1.31 0.35 1 46 LYS -3.85 -0.70 1 47 THR -2.64 -1.89 1 49 ASP 0.91 2.35 1 50 VAL -3.26 -1.68 1 51 LEU -6.10 -2.02 1 52 LEU -2.69 -0.72 1 54 ASP -3.95 -0.61 1 55 ILE 4.67 4.26 1 56 ARG 4.58 1.10 1 57 MET -4.16 0.48 1 60 MET -1.60 0.88 1 61 ASP -2.33 -0.75 1 63 LEU 4.51 2.12 1 64 ALA 3.54 2.66 1 66 LEU 3.29 2.93 1 67 LYS 3.49 2.73 1 68 GLN 3.05 2.95 1 69 ILE 5.81 4.12 1 70 LYS 3.44 1.64 1 71 GLN 2.95 2.33 1 72 ARG 0.53 1.52 1 73 HIS -1.65 -0.14 1 75 MET 0.23 -1.26 1 76 LEU -1.97 -0.07 1 78 VAL -3.56 -1.99 1 79 ILE -2.90 -1.69 1 80 ILE -3.81 -4.56 1 81 MET -5.52 -1.84 1 82 THR -2.26 -1.03 1 83 ALA 0.22 0.16 1 84 HIS 2.46 2.02 1 85 SER -0.19 -0.07 1 87 LEU 2.77 2.28 1 88 ASP 3.44 2.70 1 89 ALA 2.99 1.92 1 90 ALA 3.60 2.47 1 91 VAL 4.52 3.83 1 92 SER 4.28 3.39 1 93 ALA 4.38 2.48 1 94 TYR 4.90 4.12 1 95 GLN 4.19 3.31 1 96 GLN -0.32 -0.13 1 98 ALA 1.41 0.53 1 99 PHE 2.18 2.97 1 100 ASP -4.74 -1.65 1 101 TYR -4.78 -1.75 1 102 LEU -6.81 -2.76 1 106 PHE -5.12 -4.38 1 107 ASP -2.28 -0.93 1 108 ILE 3.18 2.03 1 109 ASP 4.61 3.38 1 110 GLU 2.77 2.56 1 111 ALA 3.47 2.67 1 112 VAL 6.24 4.89 1 113 ALA 3.98 2.28 1 114 LEU 3.52 2.85 1 115 VAL 7.07 4.94 1 116 GLU 4.20 3.33 1 117 ARG 2.52 3.86 1 118 ALA 3.13 2.15 1 119 ILE 3.55 2.62 1 120 SER 1.91 1.51 1 121 HIS 2.03 2.22 1 122 TYR 0.85 0.64 1 123 GLN 0.03 0.43 1 124 GLU 0.37 1.43 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5303_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.81 _LACS_plot.Line_1_terminator_val_y_1 4.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.03 _LACS_plot.Line_2_terminator_val_x_2 7.07 _LACS_plot.Line_2_terminator_val_y_2 -2.01 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 SER -5.13 6.31 0 13 SER -3.08 -1.98 0 10 ASP -2.60 3.04 1 11 ASP 0.60 0.79 1 12 ASP -1.18 0.18 1 14 SER 4.56 -1.10 1 15 ILE 2.86 -2.89 1 16 ARG 6.39 -0.47 1 17 TRP 3.29 -0.32 1 18 VAL 4.72 -1.18 1 19 LEU 3.35 -0.84 1 20 GLU 4.82 -0.90 1 21 ARG 3.36 -0.89 1 22 ALA 3.17 -1.07 1 23 LEU 5.47 -2.75 1 24 ALA 3.80 -1.57 1 26 ALA -0.69 -0.47 1 28 LEU -1.57 0.10 1 29 THR 1.09 -0.39 1 31 THR -0.54 0.67 1 32 THR -4.00 1.31 1 33 PHE -5.27 4.03 1 34 GLU -1.50 1.64 1 35 ASN -3.43 2.38 1 37 ASN 4.96 -1.32 1 38 GLU 1.35 0.73 1 39 VAL 5.45 -1.78 1 40 LEU 4.36 -1.23 1 41 ALA 3.65 -1.30 1 42 ALA 2.16 0.25 1 43 LEU 0.14 0.18 1 44 ALA 2.40 -0.57 1 45 SER -1.31 1.66 1 46 LYS -3.85 3.15 1 47 THR -2.64 0.75 1 49 ASP 0.91 1.44 1 50 VAL -3.26 1.58 1 51 LEU -6.10 4.08 1 52 LEU -2.69 1.97 1 54 ASP -3.95 3.34 1 55 ILE 4.67 -0.41 1 56 ARG 4.58 -3.48 1 57 MET -4.16 4.64 1 60 MET -1.60 2.48 1 61 ASP -2.33 1.58 1 63 LEU 4.51 -2.39 1 64 ALA 3.54 -0.88 1 66 LEU 3.29 -0.36 1 67 LYS 3.49 -0.76 1 68 GLN 3.05 -0.10 1 69 ILE 5.81 -1.69 1 70 LYS 3.44 -1.80 1 71 GLN 2.95 -0.62 1 72 ARG 0.53 0.99 1 73 HIS -1.65 1.51 1 75 MET 0.23 -1.49 1 76 LEU -1.97 1.90 1 78 VAL -3.56 1.57 1 79 ILE -2.90 1.21 1 80 ILE -3.81 -0.75 1 81 MET -5.52 3.68 1 82 THR -2.26 1.23 1 83 ALA 0.22 -0.06 1 84 HIS 2.46 -0.44 1 85 SER -0.19 0.12 1 87 LEU 2.77 -0.49 1 88 ASP 3.44 -0.74 1 89 ALA 2.99 -1.07 1 90 ALA 3.60 -1.13 1 91 VAL 4.52 -0.69 1 92 SER 4.28 -0.89 1 93 ALA 4.38 -1.90 1 94 TYR 4.90 -0.78 1 95 GLN 4.19 -0.88 1 96 GLN -0.32 0.19 1 98 ALA 1.41 -0.88 1 99 PHE 2.18 0.79 1 100 ASP -4.74 3.09 1 101 TYR -4.78 3.03 1 102 LEU -6.81 4.05 1 106 PHE -5.12 0.74 1 107 ASP -2.28 1.35 1 108 ILE 3.18 -1.15 1 109 ASP 4.61 -1.23 1 110 GLU 2.77 -0.21 1 111 ALA 3.47 -0.80 1 112 VAL 6.24 -1.35 1 113 ALA 3.98 -1.70 1 114 LEU 3.52 -0.67 1 115 VAL 7.07 -2.13 1 116 GLU 4.20 -0.87 1 117 ARG 2.52 1.34 1 118 ALA 3.13 -0.98 1 119 ILE 3.55 -0.93 1 120 SER 1.91 -0.40 1 121 HIS 2.03 0.19 1 122 TYR 0.85 -0.21 1 123 GLN 0.03 0.40 1 124 GLU 0.37 1.06 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5303_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.81 _LACS_plot.Line_1_terminator_val_y_1 0.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 7.07 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _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 16 ARG 6.39 0.58 0 10 ASP -2.60 -0.04 1 11 ASP 0.60 0.02 1 12 ASP -1.18 0.15 1 13 SER -3.08 0.31 1 14 SER 4.56 -0.18 1 15 ILE 2.86 -0.18 1 17 TRP 3.29 -0.17 1 18 VAL 4.72 -0.44 1 19 LEU 3.35 -0.23 1 20 GLU 4.82 -0.28 1 21 ARG 3.36 -0.39 1 22 ALA 3.17 -0.18 1 23 LEU 5.47 -0.29 1 24 ALA 3.80 0.41 1 26 ALA -0.69 0.23 1 28 LEU -1.57 0.29 1 29 THR 1.09 0.04 1 31 THR -0.54 0.14 1 32 THR -4.00 1.15 1 33 PHE -5.27 0.13 1 34 GLU -1.50 0.15 1 35 ASN -3.43 0.27 1 37 ASN 4.96 -0.34 1 38 GLU 1.35 -0.25 1 39 VAL 5.45 -0.54 1 40 LEU 4.36 -0.37 1 41 ALA 3.65 -0.13 1 42 ALA 2.16 -0.06 1 43 LEU 0.14 0.97 1 44 ALA 2.40 -0.05 1 45 SER -1.31 0.33 1 46 LYS -3.85 0.33 1 47 THR -2.64 -0.27 1 49 ASP 0.91 -0.14 1 50 VAL -3.26 0.23 1 51 LEU -6.10 1.07 1 52 LEU -2.69 1.19 1 53 SER -5.13 0.97 1 54 ASP -3.95 1.04 1 55 ILE 4.67 -0.01 1 56 ARG 4.58 0.12 1 57 MET -4.16 0.02 1 60 MET -1.60 -0.09 1 61 ASP -2.33 0.27 1 63 LEU 4.51 -0.16 1 64 ALA 3.54 -0.17 1 67 LYS 3.49 -0.43 1 68 GLN 3.05 -0.25 1 69 ILE 5.81 -0.56 1 70 LYS 3.44 -0.34 1 71 GLN 2.95 -0.24 1 72 ARG 0.53 -0.17 1 73 HIS -1.65 0.01 1 75 MET 0.23 0.15 1 76 LEU -1.97 -0.35 1 78 VAL -3.56 1.01 1 79 ILE -2.90 0.36 1 80 ILE -3.81 1.14 1 81 MET -5.52 1.06 1 82 THR -2.26 0.84 1 83 ALA 0.22 0.44 1 84 HIS 2.46 -0.04 1 85 SER -0.19 -0.04 1 87 LEU 2.77 -0.24 1 88 ASP 3.44 -0.25 1 89 ALA 2.99 -0.23 1 90 ALA 3.60 -1.00 1 91 VAL 4.52 -0.46 1 92 SER 4.28 -0.22 1 93 ALA 4.38 -0.52 1 94 TYR 4.90 -0.36 1 95 GLN 4.19 -0.34 1 96 GLN -0.32 0.01 1 98 ALA 1.41 0.01 1 99 PHE 2.18 -0.32 1 100 ASP -4.74 -0.06 1 101 TYR -4.78 0.91 1 102 LEU -6.81 0.06 1 106 PHE -5.12 0.60 1 107 ASP -2.28 0.24 1 108 ILE 3.18 -0.21 1 109 ASP 4.61 -0.20 1 110 GLU 2.77 -0.21 1 111 ALA 3.47 -0.52 1 112 VAL 6.24 -0.89 1 113 ALA 3.98 -0.12 1 114 LEU 3.52 -0.19 1 115 VAL 7.07 -0.83 1 116 GLU 4.20 -0.50 1 117 ARG 2.52 -0.20 1 118 ALA 3.13 -0.80 1 119 ILE 3.55 -0.43 1 120 SER 1.91 -0.14 1 121 HIS 2.03 -0.25 1 122 TYR 0.85 -0.06 1 123 GLN 0.03 -0.01 1 124 GLU 0.37 -0.24 1 stop_ save_